*HEADER    STRUCTURAL GENOMICS                     07-DEC-01   1KKG              
*TITLE     NMR STRUCTURE OF RIBOSOME-BINDING FACTOR A (RBFA)                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RIBOSOME-BINDING FACTOR A;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: RBFA, COLD-SHOCK ADAPTATION PROTEIN;                        
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: RBFA;                                                          
*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: PET11A                                    
*KEYWDS    COLD-SHOCK ADAPTATION, RIBOSOME-BINDING FACTOR, NESG                  
*KEYWDS   2 PROJECT, STRUCTURAL GENOMICS                                         
*EXPDTA    NMR, 16 STRUCTURES                                                    
*AUTHOR    Y.J.HUANG, G.V.T.SWAPNA, P.K.RAJAN, H.KE, B.XIA, K.SHUKLA,            
*AUTHOR   2 M.INOUYE, G.T.MONTELIONE                                             
*REVDAT   1   18-MAR-03 1KKG    0                                                



# NOE-derived distance constraints
  2 ALA   
         HA      2 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA      3 LYS  HN      4.00       #,  n15_0925_2_Filter
         HA      3 LYS  QB      5.60       #,i;db  c13_0928_3
  3 LYS   
         HN      3 LYS  HA      5.00       #,  n15_0925_2_Filter
         HN      3 LYS  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     10 ARG  HA      5.00       #,  n15_0925_2_Filter
         HN     10 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HA      3 LYS  QB      4.60       #,i;db  c13_0928_3
         HA      3 LYS  QG      6.00       #,m;dg  c13_0928_3
         HA      4 GLU  HN      2.50       #,  c13_0928_3
         HA      5 PHE  QB      5.00       #,m;one  c13_0928_3
         HA     13 GLN  HG2     5.00       #,both  c13_0928_3
         HA     13 GLN  HG3     5.00       #,both  c13_0928_3
         QB      4 GLU  HN      5.60       #i;db,  n15_0925_2_Filter
         QB      5 PHE  HN      6.00       #m;db,  n15_0925_2_Filter
         QB      9 GLN  QG      7.00       #m;db,m;one  c13_0928_3
         QB     10 ARG  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     13 GLN  HN      5.00       #m;db,  n15_0925_2_Filter
         QB     13 GLN  QG      7.00       #m;db,m;one  c13_0928_3
         QG      3 LYS  QE      7.00       #m;dg,m;de  c13_0928_3
         QG      5 PHE  HN      6.00       #m;dg,  c13_0928_3
         QE      5 PHE  HN      6.00       #m;de,  n15_0925_2_Filter
         QE      9 GLN  QG      7.00       #m;de,m;one  c13_0928_3
  4 GLU   
         HN      4 GLU  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     10 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HA      4 GLU  QG      6.00       #,m;dg  c13_0928_3
         HA      5 PHE  HN      2.50       #,  n15_0925_2_Filter
         QB      5 PHE  HN      5.60       #i;db,  n15_0925_2_Filter
         QB      5 PHE  QB      6.20       #i;db,i;one  c13_0928_3
         QG      5 PHE  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG      5 PHE  HA      6.00       #m;dg,  c13_0928_3
         QG      5 PHE  QB      6.60       #m;dg,i;one  c13_0928_3
  5 PHE   
         HN      5 PHE  HA      4.00       #,  c13_0928_3
         HN      5 PHE  HB2     5.00       #,both  n15_0925_2_Filter
         HN      5 PHE  HB3     5.00       #,both  n15_0925_2_Filter
         HN     10 ARG  HN      4.00       #,  n15_0925_2_Filter
         HN     10 ARG  HA      3.00       #,  n15_0925_2_Filter
         HN     10 ARG  QB      5.00       #,m;db  n15_0925_2_Filter
         HN     10 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HA      5 PHE  HB2     4.00       #,both  c13_0928_3
         HA      5 PHE  HB3     4.00       #,both  c13_0928_3
         HA      6 GLY  HN      3.00       #,  n15_0925_2_Filter
         HA      6 GLY  QA      4.60       #,i;one  c13_0928_3
         HA      7 ARG  HN      4.00       #,  c13_0928_3
         HA      7 ARG  QB      6.00       #,m;db  c13_0928_3
         HA     10 ARG  QB      6.00       #,m;db  c13_0928_3
         QB      6 GLY  HN      4.60       #i;one,  n15_0925_2_Filter
         HB2     7 ARG  HN      5.00       #both,  c13_0928_3
         HB3     7 ARG  HN      5.00       #both,  c13_0928_3
         QB      7 ARG  QB      7.00       #m;one,m;db  c13_0928_3
         QB     10 ARG  QG      7.00       #m;one,m;dg  c13_0928_3
  6 GLY   
         HN      6 GLY  HA2     3.00       #,both  n15_0925_2_Filter
         HN      6 GLY  HA1     3.00       #,both  n15_0925_2_Filter
         HN     10 ARG  QB      5.00       #,m;db  n15_0925_2_Filter
         HA2     7 ARG  HN      3.00       #both,  c13_0928_3
         HA1     7 ARG  HN      3.00       #both,  c13_0928_3
         QA     10 ARG  QG      7.00       #m;one,m;dg  c13_0928_3
  7 ARG   
         HN      7 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN      8 PRO  HD2     5.00       #,both  c13_0928_3
         HN      8 PRO  HD3     5.00       #,both  c13_0928_3
         HN      9 GLN  HN      4.00       #,  n15_0925_2_Filter
         HN      9 GLN  QB      5.00       #,m;db  n15_0925_2_Filter
         HN     10 ARG  QB      5.00       #,m;db  n15_0925_2_Filter
         HA      8 PRO  HD2     5.00       #,both  c13_0928_3
         HA      8 PRO  HD3     5.00       #,both  c13_0928_3
         QB      9 GLN  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     10 ARG  HN      6.00       #m;db,  n15_0925_2_Filter
  8 PRO   
         HA      8 PRO  QB      5.60       #,i;db  c13_0928_3
         HA      8 PRO  QG      6.00       #,m;one  c13_0928_3
         HA      8 PRO  HD2     5.00       #,both  c13_0928_3
         HA      8 PRO  HD3     5.00       #,both  c13_0928_3
         HA      9 GLN  HN      4.00       #,  c13_0928_3
         HA     10 ARG  HN      4.00       #,  n15_0925_2_Filter
         HA     10 ARG  QB      6.00       #,m;db  c13_0928_3
         HA     11 VAL  HN      5.00       #,  n15_0925_2_Filter
         HA     11 VAL  HB      4.00       #,  c13_0928_3
         HA     11 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     12 ALA  HN      4.00       #,  c13_0928_3
         HA     12 ALA  QB      6.00       #,m;Me  c13_0928_3
         QB      8 PRO  QG      6.60       #i;db,m;one  c13_0928_3
         QB      8 PRO  HD2     5.60       #i;db,both  c13_0928_3
         QB      8 PRO  HD3     5.60       #i;db,both  c13_0928_3
         QB      9 GLN  HN      5.60       #i;db,  c13_0928_3
         QB      9 GLN  HA      5.60       #i;db,  c13_0928_3
         QB     12 ALA  HN      6.00       #m;db,  c13_0928_3
         QB     12 ALA  QB      7.00       #m;db,m;Me  c13_0928_3
         HG2     8 PRO  QD      6.00       #both,m;one  c13_0928_3
         HG3     8 PRO  QD      6.00       #both,m;one  c13_0928_3
         QG      8 PRO  QD      7.00       #m;one,m;one  c13_0928_3
         HD2     9 GLN  HN      5.00       #both,  n15_0925_2_Filter
         HD3     9 GLN  HN      5.00       #both,  n15_0925_2_Filter
         QD      9 GLN  HA      6.00       #m;one,  c13_0928_3
         QD      9 GLN  QB      6.60       #m;one,i;db  c13_0928_3
  9 GLN   
         HN      9 GLN  HA      4.00       #,  c13_0928_3
         HN      9 GLN  QB      4.60       #,i;db  n15_0925_2_Filter
         HN      9 GLN  HG2     5.00       #,both  n15_0925_2_Filter
         HN      9 GLN  HG3     5.00       #,both  n15_0925_2_Filter
         HN     10 ARG  HN      3.00       #,  n15_0925_2_Filter
         HN     10 ARG  QB      5.60       #,i;db  c13_0928_3
         HN     12 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HA     10 ARG  HN      4.00       #,  n15_0925_2_Filter
         HA     11 VAL  HN      5.00       #,  n15_0925_2_Filter
         HA     12 ALA  HN      4.00       #,  c13_0928_3
         HA     12 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     13 GLN  QG      6.00       #,m;one  c13_0928_3
         QB      9 GLN  HG2     5.60       #i;db,both  c13_0928_3
         QB      9 GLN  HG3     5.60       #i;db,both  c13_0928_3
         QB     10 ARG  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     10 ARG  QG      6.60       #i;db,m;dg  c13_0928_3
         QB     12 ALA  QB      7.00       #m;db,m;Me  c13_0928_3
         QB     13 GLN  QG      7.00       #m;db,m;one  c13_0928_3
         QG      9 GLN  HE21    6.00       #m;one,both  c13_0928_3
         QG      9 GLN  HE22    6.00       #m;one,both  c13_0928_3
         QG      9 GLN  QE2     7.00       #m;one,m;one  c13_0928_3
         QG     10 ARG  HN      6.00       #m;one,  c13_0928_3
         QG     12 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
         QG     13 GLN  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     13 GLN  QB      7.00       #m;one,m;one  c13_0928_3
         QG     13 GLN  QG      7.00       #m;one,m;one  c13_0928_3
         QG     13 GLN  HE21    6.00       #m;one,both  c13_0928_3
         QG     13 GLN  HE22    6.00       #m;one,both  c13_0928_3
         QE2    12 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
         QE2    13 GLN  QG      7.00       #m;one,m;one  c13_0928_3
         QE2    13 GLN  QE2     7.00       #m;one,m;one  n15_0925_2_Filter
 10 ARG   
         HN     10 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN     10 ARG  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     12 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     13 GLN  QG      6.00       #,m;one  c13_0928_3
         HN     13 GLN  QG      6.00       #,m;one  n15_0925_2_Filter
         HA     10 ARG  QB      5.60       #,i;db  c13_0928_3
         HA     10 ARG  QD      6.00       #,m;dd  c13_0928_3
         HA     11 VAL  HN      5.00       #,  n15_0925_2_Filter
         HA     13 GLN  QG      6.00       #,m;one  c13_0928_3
         QB     10 ARG  QD      6.60       #i;db,m;dd  c13_0928_3
         QB     11 VAL  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     11 VAL  QQG     8.00       #i;db,q;dMe  c13_0928_3
         QB     12 ALA  HN      5.00       #m;db,  n15_0925_2_Filter
         QB     13 GLN  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     13 GLN  QB      7.00       #m;db,m;one  c13_0928_3
         QG     10 ARG  QD      7.00       #m;dg,m;dd  c13_0928_3
         QG     11 VAL  HA      6.00       #m;dg,  c13_0928_3
         QG     13 GLN  QB      7.00       #m;dg,m;one  c13_0928_3
         QG     14 GLU  QG      7.00       #m;dg,m;one  c13_0928_3
         QD     11 VAL  HA      6.00       #m;dd,  c13_0928_3
         QD     13 GLN  QG      7.00       #m;dd,m;one  c13_0928_3
 11 VAL   
         HN     11 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     11 VAL  HB      3.00       #,  n15_0925_2_Filter
         HN     11 VAL  QQG     6.70       #,s;dMe  n15_0925_2_Filter
         HN     12 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     12 ALA  QB      6.00       #,m;Me  c13_0928_3
         HN     13 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     11 VAL  HB      4.00       #,  c13_0928_3
         HA     11 VAL  QQG     5.60       #,i;dMe  c13_0928_3
         HA     12 ALA  HN      5.00       #,  c13_0928_3
         HA     14 GLU  HN      5.00       #,  c13_0928_3
         HA     15 MET  HN      4.00       #,  n15_0925_2_Filter
         HB     12 ALA  HN      4.00       #,  n15_0925_2_Filter
         HB     12 ALA  QB      6.00       #,m;Me  c13_0928_3
         QQG    12 ALA  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    12 ALA  HA      7.40       #q;dMe,  c13_0928_3
         QQG    13 GLN  HN      7.40       #q;dMe,  c13_0928_3
         QQG    14 GLU  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    15 MET  QB      8.40       #q;dMe,m;one  c13_0928_3
         QQG    43 MET  QB      8.40       #q;dMe,m;one  c13_0928_3
         QQG    45 ARG  QB      8.40       #q;dMe,m;one  c13_0928_3
 12 ALA   
         HN     12 ALA  HA      4.00       #,  c13_0928_3
         HN     12 ALA  QB      5.60       #,i;Me  n15_0925_2_Filter
         HN     13 GLN  HN      4.00       #,  n15_0925_2_Filter
         HN     13 GLN  QB      5.60       #,i;one  c13_0928_3
         HN     13 GLN  QG      6.00       #,m;one  c13_0928_3
         HA     12 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA     13 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     15 MET  HN      4.00       #,  c13_0928_3
         HA     15 MET  HB2     5.00       #,both  c13_0928_3
         HA     15 MET  HB3     5.00       #,both  c13_0928_3
         HA     16 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     16 GLN  QB      6.00       #,m;one  c13_0928_3
         HA     41 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     43 MET  QB      5.00       #,m;one  c13_0928_3
         HA     43 MET  QE      6.00       #,m;Me  c13_0928_3
         QB     13 GLN  HN      5.00       #m;Me,  n15_0925_2_Filter
         QB     13 GLN  QG      7.00       #m;Me,m;one  c13_0928_3
         QB     13 GLN  QE2     7.00       #m;Me,m;one  n15_0925_2_Filter
         QB     15 MET  QB      6.00       #m;Me,m;one  c13_0928_3
         QB     16 GLN  QB      7.00       #m;Me,m;one  c13_0928_3
         QB     41 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
         QB     43 MET  HN      6.00       #m;Me,  c13_0928_3
         QB     43 MET  QG      7.00       #m;Me,m;dg  c13_0928_3
         QB     43 MET  QE      7.00       #m;Me,m;Me  c13_0928_3
 13 GLN   
         HN     13 GLN  HA      4.00       #,  n15_0925_2_Filter
         HN     13 GLN  QB      4.60       #,i;one  c13_0928_3
         HN     13 GLN  HG2     5.00       #,both  n15_0925_2_Filter
         HN     13 GLN  HG3     5.00       #,both  n15_0925_2_Filter
         HN     13 GLN  HE21    5.00       #,both  n15_0925_2_Filter
         HN     13 GLN  HE22    5.00       #,both  n15_0925_2_Filter
         HN     14 GLU  HN      4.00       #,  n15_0925_2_Filter
         HN     15 MET  HN      4.00       #,  n15_0925_2_Filter
         HA     13 GLN  QB      4.60       #,i;one  c13_0928_3
         HA     13 GLN  QG      6.00       #,m;one  c13_0928_3
         HA     13 GLN  QE2     6.00       #,m;one  c13_0928_3
         HA     14 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA     16 GLN  HN      5.00       #,  c13_0928_3
         HA     16 GLN  HB2     4.00       #,both  c13_0928_3
         HA     16 GLN  HB3     4.00       #,both  c13_0928_3
         HA     17 LYS  HN      5.00       #,  c13_0928_3
         HA     41 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HB2    13 GLN  HG3     5.00       #both,both  c13_0928_3
         HB3    13 GLN  HG2     5.00       #both,both  c13_0928_3
         QB     13 GLN  QG      6.60       #i;one,m;one  c13_0928_3
         QB     13 GLN  QE2     6.60       #i;one,m;one  n15_0925_2_Filter
         HB2    14 GLU  HN      4.00       #both,  n15_0925_2_Filter
         HB3    14 GLU  HN      4.00       #both,  n15_0925_2_Filter
         QB     15 MET  HN      5.00       #m;one,  n15_0925_2_Filter
         QB     16 GLN  HN      6.00       #m;one,  c13_0928_3
         QB     17 LYS  HN      5.00       #m;one,  n15_0925_2_Filter
         QB     17 LYS  QB      7.00       #m;one,m;db  c13_0928_3
         QG     13 GLN  HE21    6.00       #m;one,both  n15_0925_2_Filter
         QG     13 GLN  HE22    6.00       #m;one,both  n15_0925_2_Filter
         QG     13 GLN  HE21    6.00       #m;one,both  n15_0925_2_Filter
         QG     13 GLN  HE22    6.00       #m;one,both  n15_0925_2_Filter
         QG     14 GLU  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     16 GLN  QB      7.00       #m;one,m;one  c13_0928_3
         HE21   16 GLN  HN      5.00       #both,  n15_0925_2_Filter
         HE22   16 GLN  HN      5.00       #both,  n15_0925_2_Filter
         QE2    16 GLN  QB      7.00       #m;one,m;one  n15_0925_2_Filter
         QE2    16 GLN  QE2     7.00       #m;one,m;one  n15_0925_2_Filter
 14 GLU   
         HN     14 GLU  HA      4.00       #,  n15_0925_2_Filter
         HN     14 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     14 GLU  HG2     5.00       #,both  n15_0925_2_Filter
         HN     14 GLU  HG3     5.00       #,both  n15_0925_2_Filter
         HN     15 MET  HN      3.00       #,  n15_0925_2_Filter
         HA     14 GLU  QB      4.60       #,i;db  c13_0928_3
         HA     14 GLU  HG2     5.00       #,both  c13_0928_3
         HA     14 GLU  HG3     5.00       #,both  c13_0928_3
         HA     15 MET  HN      4.00       #,  n15_0925_2_Filter
         HA     16 GLN  HN      5.00       #,  c13_0928_3
         HA     17 LYS  HN      5.00       #,  c13_0928_3
         HA     17 LYS  QE      6.00       #,m;de  c13_0928_3
         QB     14 GLU  QG      6.60       #i;db,m;one  c13_0928_3
         QB     15 MET  HN      5.60       #i;db,  c13_0928_3
         QG     15 MET  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     15 MET  HN      6.00       #m;one,  c13_0928_3
         QG     17 LYS  QB      7.00       #m;one,m;db  c13_0928_3
 15 MET   
         HN     15 MET  HA      5.00       #,  n15_0925_2_Filter
         HN     15 MET  HB2     5.00       #,both  n15_0925_2_Filter
         HN     15 MET  HB3     5.00       #,both  n15_0925_2_Filter
         HN     16 GLN  HN      4.00       #,  n15_0925_2_Filter
         HN     16 GLN  QB      5.60       #,i;one  n15_0925_2_Filter
         HN     43 MET  QE      6.00       #,m;Me  n15_0925_2_Filter
         HA     15 MET  HB2     4.00       #,both  c13_0928_3
         HA     15 MET  HB3     4.00       #,both  c13_0928_3
         HA     15 MET  QG      6.00       #,m;dg  c13_0928_3
         HA     15 MET  QE      6.00       #,m;Me  c13_0928_3
         HA     18 GLU  HN      5.00       #,  n15_0925_2_Filter
         HA     19 ILE  HN      4.00       #,  n15_0925_2_Filter
         HA     19 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     87 MET  QE      6.00       #,m;Me  c13_0928_3
         HB2    15 MET  QG      6.00       #both,m;dg  c13_0928_3
         HB3    15 MET  QG      6.00       #both,m;dg  c13_0928_3
         HB2    15 MET  QE      6.00       #both,m;Me  c13_0928_3
         HB3    15 MET  QE      6.00       #both,m;Me  c13_0928_3
         HB2    16 GLN  HN      4.00       #both,  n15_0925_2_Filter
         HB3    16 GLN  HN      4.00       #both,  n15_0925_2_Filter
         QB     16 GLN  HA      5.60       #i;one,  c13_0928_3
         QB     17 LYS  HN      5.00       #m;one,  n15_0925_2_Filter
         QB     19 ILE  QG1     7.00       #m;one,m;dg  c13_0928_3
         QB     19 ILE  QG2     7.00       #m;one,m;Me  c13_0928_3
         QB     19 ILE  QD1     7.00       #m;one,m;Me  c13_0928_3
         HB2    41 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         HB3    41 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         QB     43 MET  QB      6.00       #m;one,m;one  c13_0928_3
         QB     43 MET  QE      7.00       #m;one,m;Me  c13_0928_3
         QB     45 ARG  QD      7.00       #m;one,m;dd  c13_0928_3
         QB     87 MET  QE      7.00       #m;one,m;Me  c13_0928_3
         QG     15 MET  QE      7.00       #m;dg,m;Me  c13_0928_3
         QG     18 GLU  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     19 ILE  QD1     7.00       #m;dg,m;Me  c13_0928_3
         QE     19 ILE  QG2     7.00       #m;Me,m;Me  c13_0928_3
         QE     83 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QE     87 MET  QB      7.00       #m;Me,m;one  c13_0928_3
         QE     87 MET  QG      7.00       #m;Me,m;dg  c13_0928_3
         QE     87 MET  QE      7.00       #m;Me,m;Me  c13_0928_3
         QE     89 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QE     91 ILE  QD1     7.00       #m;Me,m;Me  c13_0928_3
         QE     93 PRO  QD      7.00       #m;Me,m;one  c13_0928_3
         QE     95 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
 16 GLN   
         HN     16 GLN  HA      4.00       #,  n15_0925_2_Filter
         HN     16 GLN  HB2     4.00       #,both  n15_0925_2_Filter
         HN     16 GLN  HB3     4.00       #,both  n15_0925_2_Filter
         HN     16 GLN  QG      6.00       #,m;one  n15_0925_2_Filter
         HN     16 GLN  QG      6.00       #,m;one  c13_0928_3
         HN     17 LYS  HN      4.00       #,  n15_0925_2_Filter
         HN     19 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     19 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     41 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HA     16 GLN  HB2     5.00       #,both  c13_0928_3
         HA     16 GLN  HB3     5.00       #,both  c13_0928_3
         HA     16 GLN  HG2     5.00       #,both  c13_0928_3
         HA     16 GLN  HG3     5.00       #,both  c13_0928_3
         HA     17 LYS  HN      4.00       #,  n15_0925_2_Filter
         HA     19 ILE  HN      5.00       #,  n15_0925_2_Filter
         HA     19 ILE  HB      5.00       #,  c13_0928_3
         HA     19 ILE  QG1     6.00       #,m;dg  c13_0928_3
         HA     19 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     19 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     41 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     43 MET  QE      6.00       #,m;Me  c13_0928_3
         QB     16 GLN  HE21    5.60       #i;one,both  n15_0925_2_Filter
         QB     16 GLN  HE22    5.60       #i;one,both  n15_0925_2_Filter
         HB2    17 LYS  HN      4.00       #both,  n15_0925_2_Filter
         HB3    17 LYS  HN      4.00       #both,  n15_0925_2_Filter
         HB2    19 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         HB3    19 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         QB     41 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QG     16 GLN  HE21    6.00       #m;one,both  c13_0928_3
         HG2    16 GLN  HE22    5.00       #both,both  n15_0925_2_Filter
         HG3    16 GLN  HE21    5.00       #both,both  n15_0925_2_Filter
         QG     16 GLN  HE22    6.00       #m;one,both  c13_0928_3
         QG     17 LYS  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     17 LYS  HA      6.00       #m;one,  c13_0928_3
         QG     20 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
         QG     41 VAL  HN      6.00       #m;one,  c13_0928_3
         HG2    41 VAL  HA      5.00       #both,  c13_0928_3
         HG3    41 VAL  HA      5.00       #both,  c13_0928_3
         QE2    17 LYS  HA      6.00       #m;one,  c13_0928_3
         QE2    38 VAL  HB      6.00       #m;one,  n15_0925_2_Filter
         HE21   39 SER  HA      5.00       #both,  n15_0925_2_Filter
         HE22   39 SER  HA      5.00       #both,  n15_0925_2_Filter
         QE2    40 GLY  HN      6.00       #m;one,  n15_0925_2_Filter
 17 LYS   
         HN     17 LYS  HA      4.00       #,  c13_0928_3
         HN     17 LYS  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     17 LYS  HG2     5.00       #,both  c13_0928_3
         HN     17 LYS  HG3     5.00       #,both  c13_0928_3
         HN     17 LYS  QD      6.00       #,m;dd  n15_0925_2_Filter
         HN     18 GLU  HN      3.00       #,  n15_0925_2_Filter
         HN     18 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     19 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     20 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     17 LYS  QB      4.60       #,i;db  c13_0928_3
         HA     17 LYS  HG2     5.00       #,both  c13_0928_3
         HA     17 LYS  HG3     5.00       #,both  c13_0928_3
         HA     18 GLU  HN      5.00       #,  n15_0925_2_Filter
         HA     20 ALA  HN      5.00       #,  c13_0928_3
         HA     21 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     21 LEU  QB      5.00       #,m;one  c13_0928_3
         QB     17 LYS  QE      6.60       #i;db,m;de  c13_0928_3
         QB     18 GLU  HN      4.60       #i;db,  n15_0925_2_Filter
         HG2    17 LYS  QE      6.00       #both,m;de  c13_0928_3
         HG3    17 LYS  QE      6.00       #both,m;de  c13_0928_3
         QG     21 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     21 LEU  QB      7.00       #m;one,m;one  c13_0928_3
         QG     21 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QD     17 LYS  QE      7.00       #m;dd,m;de  c13_0928_3
         QD     18 GLU  HA      6.00       #m;dd,  c13_0928_3
         QD     21 LEU  QB      7.00       #m;dd,m;one  c13_0928_3
         QE     18 GLU  QB      6.60       #m;de,i;db  c13_0928_3
         QE     21 LEU  HB2     6.00       #m;de,both  c13_0928_3
         QE     21 LEU  HB3     6.00       #m;de,both  c13_0928_3
         QE     21 LEU  QQD     8.40       #m;de,q;dMe  c13_0928_3
 18 GLU   
         HN     18 GLU  HA      4.00       #,  n15_0925_2_Filter
         HN     18 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     18 GLU  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     19 ILE  HN      4.00       #,  n15_0925_2_Filter
         HA     18 GLU  QG      6.00       #,m;dg  c13_0928_3
         HA     19 ILE  HN      4.00       #,  c13_0928_3
         HA     21 LEU  HN      5.00       #,  c13_0928_3
         HA     21 LEU  HB2     4.00       #,both  c13_0928_3
         HA     21 LEU  HB3     4.00       #,both  c13_0928_3
         HA     21 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HA     22 ILE  HN      5.00       #,  c13_0928_3
         QB     19 ILE  HN      5.60       #i;db,  c13_0928_3
         QB     19 ILE  HA      5.60       #i;db,  c13_0928_3
         QB     22 ILE  QD1     7.00       #m;db,m;Me  c13_0928_3
         QB     83 LEU  QQD     8.40       #m;db,q;dMe  c13_0928_3
         QG     19 ILE  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     86 ALA  QB      7.00       #m;dg,m;Me  c13_0928_3
         QG     87 MET  HA      6.00       #m;dg,  c13_0928_3
         QG     87 MET  QB      7.00       #m;dg,m;one  c13_0928_3
 19 ILE   
         HN     19 ILE  HA      5.00       #,  n15_0925_2_Filter
         HN     19 ILE  HB      4.00       #,  n15_0925_2_Filter
         HN     19 ILE  QG1     6.00       #,m;dg  n15_0925_2_Filter
         HN     19 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     19 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     20 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     20 ALA  QB      6.00       #,m;Me  c13_0928_3
         HN     22 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     83 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HA     19 ILE  HB      5.00       #,  c13_0928_3
         HA     19 ILE  QG2     5.60       #,i;Me  c13_0928_3
         HA     19 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     21 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     22 ILE  HN      4.00       #,  n15_0925_2_Filter
         HA     22 ILE  HB      5.00       #,  c13_0928_3
         HA     22 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     22 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     23 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     23 LEU  QB      5.00       #,m;one  c13_0928_3
         HA     83 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HA     83 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HB     19 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     19 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HB     20 ALA  HN      4.00       #,  c13_0928_3
         HB     23 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     41 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HB     83 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     87 MET  QE      6.00       #,m;Me  c13_0928_3
         QG1    19 ILE  QG2     7.00       #m;dg,m;Me  c13_0928_3
         QG1    19 ILE  QD1     7.00       #m;dg,m;Me  c13_0928_3
         QG1    41 VAL  QQG     8.40       #m;dg,q;dMe  c13_0928_3
         QG2    19 ILE  QD1     7.00       #m;Me,m;Me  c13_0928_3
         QG2    20 ALA  HN      6.00       #m;Me,  c13_0928_3
         QG2    20 ALA  QB      7.00       #m;Me,m;Me  c13_0928_3
         QG2    22 ILE  QD1     7.00       #m;Me,m;Me  c13_0928_3
         QG2    23 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QG2    41 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
         QG2    43 MET  QG      7.00       #m;Me,m;dg  c13_0928_3
         QG2    43 MET  QE      7.00       #m;Me,m;Me  c13_0928_3
         QG2    52 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
         QG2    83 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QG2    87 MET  QE      7.00       #m;Me,m;Me  c13_0928_3
         QD1    20 ALA  HA      6.00       #m;Me,  c13_0928_3
         QD1    41 VAL  HB      6.00       #m;Me,  c13_0928_3
         QD1    43 MET  QG      7.00       #m;Me,m;dg  c13_0928_3
         QD1    43 MET  QE      7.00       #m;Me,m;Me  c13_0928_3
         QD1    52 VAL  HB      6.00       #m;Me,  c13_0928_3
         QD1    52 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
 20 ALA   
         HN     20 ALA  HA      4.00       #,  n15_0925_2_Filter
         HN     20 ALA  QB      4.60       #,i;Me  c13_0928_3
         HN     21 LEU  HN      3.00       #,  n15_0925_2_Filter
         HA     20 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA     21 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     23 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     24 GLN  QG      6.00       #,m;dg  c13_0928_3
         HA     24 GLN  QE2     6.00       #,m;one  c13_0928_3
         HA     38 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     54 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         QB     21 LEU  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     24 GLN  QG      7.00       #m;Me,m;dg  c13_0928_3
         QB     24 GLN  QE2     7.00       #m;Me,m;one  c13_0928_3
         QB     38 VAL  HB      6.00       #m;Me,  c13_0928_3
         QB     38 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
 21 LEU   
         HN     21 LEU  HA      3.00       #,  n15_0925_2_Filter
         HN     21 LEU  HB2     4.00       #,both  c13_0928_3
         HN     21 LEU  HB3     4.00       #,both  c13_0928_3
         HN     21 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN     22 ILE  HN      4.00       #,  n15_0925_2_Filter
         HN     23 LEU  QB      5.00       #,m;one  n15_0925_2_Filter
         HA     21 LEU  HB2     4.00       #,both  c13_0928_3
         HA     21 LEU  HB3     4.00       #,both  c13_0928_3
         HA     22 ILE  HN      4.00       #,  n15_0925_2_Filter
         HA     24 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     25 ARG  HN      4.00       #,  n15_0925_2_Filter
         HB2    21 LEU  QQD     5.00       #both,  c13_0928_3
         HB3    21 LEU  QQD     5.00       #both,  c13_0928_3
         QB     22 ILE  HN      4.60       #i;one,  n15_0925_2_Filter
         QB     22 ILE  HA      5.60       #i;one,  c13_0928_3
         QB     22 ILE  QD1     6.60       #i;one,m;Me  c13_0928_3
         QB     25 ARG  QB      6.00       #m;one,m;db  c13_0928_3
         HG     21 LEU  QQD     5.00       #,  c13_0928_3
         HG     23 LEU  HN      5.00       #,  c13_0928_3
         HG     24 GLN  QB      6.00       #,m;db  c13_0928_3
         HG     25 ARG  HN      5.00       #,  n15_0925_2_Filter
         HG     25 ARG  HA      5.00       #,  c13_0928_3
         HG     25 ARG  QD      6.00       #,m;dd  c13_0928_3
         QQD    24 GLN  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQD    25 ARG  QD      8.40       #q;dMe,m;dd  c13_0928_3
 22 ILE   
         HN     22 ILE  HA      4.00       #,  n15_0925_2_Filter
         HN     22 ILE  HB      4.00       #,  c13_0928_3
         HN     22 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HN     22 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HN     23 LEU  HN      4.00       #,  n15_0925_2_Filter
         HN     24 GLN  HN      4.00       #,  n15_0925_2_Filter
         HN     25 ARG  QB      6.00       #,m;db  n15_0925_2_Filter
         HN     26 GLU  HN      5.00       #,  n15_0925_2_Filter
         HA     22 ILE  HB      5.00       #,  c13_0928_3
         HA     22 ILE  QG2     5.60       #,i;Me  c13_0928_3
         HA     22 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     23 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     25 ARG  HN      5.00       #,  c13_0928_3
         HA     25 ARG  QB      5.00       #,m;db  c13_0928_3
         HA     25 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     26 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA     26 GLU  QG      6.00       #,m;dg  c13_0928_3
         HB     22 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     22 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HB     23 LEU  HN      5.00       #,  n15_0925_2_Filter
         HB     23 LEU  HA      5.00       #,  c13_0928_3
         HB     23 LEU  QB      4.60       #,i;one  c13_0928_3
         HB     82 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     83 LEU  HA      5.00       #,  c13_0928_3
         HB     83 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HB     83 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         QG1    22 ILE  QD1     7.00       #m;dg,m;Me  c13_0928_3
         QG1    23 LEU  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG1    25 ARG  QB      7.00       #m;dg,m;db  c13_0928_3
         QG1    82 LEU  QQD     8.40       #m;dg,q;dMe  c13_0928_3
         QG2    23 LEU  HA      6.00       #m;Me,  c13_0928_3
         QG2    23 LEU  QB      6.60       #m;Me,i;one  c13_0928_3
         QG2    26 GLU  HA      6.00       #m;Me,  c13_0928_3
         QG2    26 GLU  QB      7.00       #m;Me,m;db  c13_0928_3
         QG2    26 GLU  QG      7.00       #m;Me,m;dg  c13_0928_3
         QG2    79 ILE  HA      6.00       #m;Me,  c13_0928_3
         QG2    79 ILE  HB      6.00       #m;Me,  c13_0928_3
         QG2    82 LEU  QB      7.00       #m;Me,m;one  c13_0928_3
         QG2    82 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QG2    83 LEU  HA      6.00       #m;Me,  c13_0928_3
         QG2    86 ALA  QB      7.00       #m;Me,m;Me  c13_0928_3
         QD1    23 LEU  HN      6.00       #m;Me,  n15_0925_2_Filter
         QD1    82 LEU  HG      6.00       #m;Me,  c13_0928_3
         QD1    83 LEU  HA      6.00       #m;Me,  c13_0928_3
         QD1    86 ALA  HN      6.00       #m;Me,  c13_0928_3
         QD1    86 ALA  QB      7.00       #m;Me,m;Me  c13_0928_3
         QD1    87 MET  QE      7.00       #m;Me,m;Me  c13_0928_3
 23 LEU   
         HN     23 LEU  HA      4.00       #,  n15_0925_2_Filter
         HN     23 LEU  HB2     5.00       #,both  n15_0925_2_Filter
         HN     23 LEU  HB3     5.00       #,both  n15_0925_2_Filter
         HN     23 LEU  HG      5.00       #,  n15_0925_2_Filter
         HN     23 LEU  QQD     7.20       #,r;dMe  c13_0928_3
         HN     24 GLN  HN      4.00       #,  n15_0925_2_Filter
         HN     24 GLN  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     26 GLU  QB      6.00       #,m;db  n15_0925_2_Filter
         HN     27 ILE  HB      5.00       #,  n15_0925_2_Filter
         HA     23 LEU  HB2     5.00       #,both  c13_0928_3
         HA     23 LEU  HB3     5.00       #,both  c13_0928_3
         HA     23 LEU  HG      5.00       #,  c13_0928_3
         HA     23 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA     24 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     26 GLU  QB      6.00       #,m;db  c13_0928_3
         HA     27 ILE  HN      4.00       #,  n15_0925_2_Filter
         HA     27 ILE  HB      4.00       #,  c13_0928_3
         HA     27 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     27 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     79 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     83 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QB     23 LEU  HG      5.60       #i;one,  c13_0928_3
         HB2    23 LEU  QQD     5.00       #both,  c13_0928_3
         HB3    23 LEU  QQD     5.00       #both,  c13_0928_3
         HB2    24 GLN  HN      4.00       #both,  n15_0925_2_Filter
         HB3    24 GLN  HN      4.00       #both,  n15_0925_2_Filter
         QB     24 GLN  QG      6.60       #i;one,m;dg  c13_0928_3
         QB     27 ILE  HB      6.00       #m;one,  c13_0928_3
         QB     27 ILE  QG1     7.00       #m;one,m;one  c13_0928_3
         QB     27 ILE  QD1     7.00       #m;one,m;Me  c13_0928_3
         QB     54 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QB     79 ILE  QG2     7.00       #m;one,m;Me  c13_0928_3
         HB2    83 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         HB3    83 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         HG     23 LEU  QQD     5.00       #,  c13_0928_3
         HG     24 GLN  QG      6.00       #,m;dg  c13_0928_3
         HG     27 ILE  QG1     6.00       #,m;one  c13_0928_3
         HG     27 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HG     54 VAL  HB      5.00       #,  c13_0928_3
         HG     54 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HG     54 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HG     72 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HG     72 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HG     79 ILE  QG2     6.00       #,m;Me  c13_0928_3
         QQD    24 GLN  HN      7.40       #q;dMe,  c13_0928_3
         QQD    36 THR  HB      7.40       #q;dMe,  c13_0928_3
         QQD    36 THR  QG2     8.40       #q;dMe,m;Me  c13_0928_3
         QQD    54 VAL  HA      7.40       #q;dMe,  c13_0928_3
         QQD    54 VAL  HB      7.40       #q;dMe,  c13_0928_3
         QQD    72 LEU  QQD     9.80       #q;dMe,q;dMe  c13_0928_3
         QQD    79 ILE  HB      7.40       #q;dMe,  c13_0928_3
         QQD    97 PHE  HA      7.40       #q;dMe,  c13_0928_3
         QQD    97 PHE  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQD    97 PHE  CZ      9.60       #q;dMe,r;de  c13_0928_3
 24 GLN   
         HN     24 GLN  HA      4.00       #,  n15_0925_2_Filter
         HN     24 GLN  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     24 GLN  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     24 GLN  QE2     6.00       #,m;one  n15_0925_2_Filter
         HN     25 ARG  HN      3.00       #,  n15_0925_2_Filter
         HN     26 GLU  HN      4.00       #,  n15_0925_2_Filter
         HN     26 GLU  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     29 ASP  QB      6.00       #,m;db  c13_0928_3
         HA     24 GLN  QB      4.60       #,i;db  c13_0928_3
         HA     24 GLN  QG      6.00       #,m;dg  c13_0928_3
         HA     24 GLN  QE2     6.00       #,m;one  c13_0928_3
         HA     25 ARG  HN      5.00       #,  c13_0928_3
         HA     27 ILE  HN      4.00       #,  n15_0925_2_Filter
         HA     27 ILE  HB      4.00       #,  c13_0928_3
         HA     27 ILE  QG1     6.00       #,m;one  c13_0928_3
         HA     27 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     29 ASP  QB      6.00       #,m;db  c13_0928_3
         QB     25 ARG  QG      6.60       #i;db,m;dg  c13_0928_3
         QB     29 ASP  QB      6.00       #m;db,m;db  c13_0928_3
         QG     24 GLN  HE21    6.00       #m;dg,both  c13_0928_3
         QG     24 GLN  HE22    6.00       #m;dg,both  c13_0928_3
         QG     27 ILE  QG2     7.00       #m;dg,m;Me  c13_0928_3
         QG     29 ASP  QB      7.00       #m;dg,m;db  c13_0928_3
         QG     35 MET  QB      7.00       #m;dg,m;one  c13_0928_3
         QG     36 THR  HB      6.00       #m;dg,  c13_0928_3
         QG     38 VAL  QQG     8.40       #m;dg,q;dMe  c13_0928_3
         QG     54 VAL  QQG     8.40       #m;dg,q;dMe  c13_0928_3
         QE2    29 ASP  QB      7.00       #m;one,m;db  n15_0925_2_Filter
         QE2    35 MET  QG      7.00       #m;one,m;dg  n15_0925_2_Filter
         QE2    37 THR  QG2     7.00       #m;one,m;Me  n15_0925_2_Filter
 25 ARG   
         HN     25 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN     25 ARG  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     25 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     26 GLU  HN      3.00       #,  n15_0925_2_Filter
         HN     26 GLU  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     26 GLU  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     27 ILE  HN      4.00       #,  n15_0925_2_Filter
         HN     27 ILE  HB      4.00       #,  n15_0925_2_Filter
         HN     29 ASP  QB      6.00       #,m;db  n15_0925_2_Filter
         HA     25 ARG  QB      4.60       #,i;db  c13_0928_3
         HA     25 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     25 ARG  QD      6.00       #,m;dd  c13_0928_3
         HA     26 GLU  HN      5.00       #,  c13_0928_3
         HA     27 ILE  HN      4.00       #,  n15_0925_2_Filter
         QB     25 ARG  QG      6.60       #i;db,m;dg  c13_0928_3
         QB     25 ARG  QD      6.60       #i;db,m;dd  c13_0928_3
         QB     26 GLU  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     27 ILE  HN      5.00       #m;db,  n15_0925_2_Filter
         QG     26 GLU  HN      6.00       #m;dg,  n15_0925_2_Filter
 26 GLU   
         HN     26 GLU  HA      4.00       #,  n15_0925_2_Filter
         HN     26 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     26 GLU  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     27 ILE  HN      3.00       #,  n15_0925_2_Filter
         HA     26 GLU  QB      5.60       #,i;db  c13_0928_3
         HA     26 GLU  QG      6.00       #,m;dg  c13_0928_3
         HA     27 ILE  HN      4.00       #,  n15_0925_2_Filter
         QB     27 ILE  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     79 ILE  QG2     7.00       #m;db,m;Me  c13_0928_3
         QB     82 LEU  QQD     8.40       #m;db,q;dMe  c13_0928_3
         QG     27 ILE  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     27 ILE  HB      6.00       #m;dg,  c13_0928_3
         QG     27 ILE  QG1     7.00       #m;dg,m;one  c13_0928_3
         QG     27 ILE  QD1     7.00       #m;dg,m;Me  c13_0928_3
         QG     82 LEU  QB      7.00       #m;dg,m;one  c13_0928_3
         QG     82 LEU  HG      6.00       #m;dg,  c13_0928_3
         QG     82 LEU  QD1     7.00       #m;dg,m;bothMe  c13_0928_3
         QG     82 LEU  QD2     7.00       #m;dg,m;bothMe  c13_0928_3
 27 ILE   
         HN     27 ILE  HA      4.00       #,  n15_0925_2_Filter
         HN     27 ILE  HB      4.00       #,  c13_0928_3
         HN     27 ILE  HG12    5.00       #,both  n15_0925_2_Filter
         HN     27 ILE  HG13    5.00       #,both  n15_0925_2_Filter
         HN     27 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     27 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     28 LYS  HN      4.00       #,  n15_0925_2_Filter
         HN     82 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HA     27 ILE  HB      4.00       #,  c13_0928_3
         HA     27 ILE  HG12    5.00       #,both  c13_0928_3
         HA     27 ILE  HG13    5.00       #,both  c13_0928_3
         HA     27 ILE  QG2     5.60       #,i;Me  c13_0928_3
         HA     27 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     28 LYS  HN      3.00       #,  n15_0925_2_Filter
         HA     28 LYS  QG      6.00       #,m;one  c13_0928_3
         HA     79 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     27 ILE  HG12    5.00       #,both  c13_0928_3
         HB     27 ILE  HG13    5.00       #,both  c13_0928_3
         HB     27 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     27 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HB     28 LYS  HN      4.00       #,  n15_0925_2_Filter
         HB     28 LYS  QE      6.00       #,m;de  c13_0928_3
         HB     79 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HG12   27 ILE  QG2     6.00       #both,m;Me  c13_0928_3
         HG13   27 ILE  QG2     6.00       #both,m;Me  c13_0928_3
         HG12   27 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         HG13   27 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         QG1    28 LYS  HN      6.00       #m;one,  n15_0925_2_Filter
         QG1    28 LYS  HA      6.00       #m;one,  c13_0928_3
         QG1    29 ASP  HN      6.00       #m;one,  n15_0925_2_Filter
         QG1    56 PHE  CZ      8.20       #m;one,r;de  c13_0928_3
         QG1    56 PHE  HZ      6.00       #m;one,  c13_0928_3
         QG1    72 LEU  HA      6.00       #m;one,  c13_0928_3
         HG12   79 ILE  QG2     6.00       #both,m;Me  c13_0928_3
         HG13   79 ILE  QG2     6.00       #both,m;Me  c13_0928_3
         QG1    79 ILE  QD1     7.00       #m;one,m;Me  c13_0928_3
         QG2    28 LYS  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    28 LYS  HA      6.00       #m;Me,  c13_0928_3
         QG2    28 LYS  QG      7.00       #m;Me,m;one  c13_0928_3
         QG2    29 ASP  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    29 ASP  QB      7.00       #m;Me,m;db  c13_0928_3
         QG2    36 THR  HB      6.00       #m;Me,  c13_0928_3
         QG2    56 PHE  HZ      6.00       #m;Me,  c13_0928_3
         QD1    28 LYS  HN      6.00       #m;Me,  n15_0925_2_Filter
         QD1    28 LYS  QG      7.00       #m;Me,m;one  c13_0928_3
         QD1    29 ASP  HN      6.00       #m;Me,  n15_0925_2_Filter
         QD1    29 ASP  QB      7.00       #m;Me,m;db  c13_0928_3
         QD1    36 THR  HB      6.00       #m;Me,  c13_0928_3
         QD1    54 VAL  HB      6.00       #m;Me,  c13_0928_3
         QD1    72 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
 28 LYS   
         HN     28 LYS  HA      4.00       #,  c13_0928_3
         HN     28 LYS  HB2     4.00       #,both  n15_0925_2_Filter
         HN     28 LYS  HB3     4.00       #,both  n15_0925_2_Filter
         HN     28 LYS  HG2     5.00       #,both  c13_0928_3
         HN     28 LYS  HG3     5.00       #,both  c13_0928_3
         HN     28 LYS  QD      6.00       #,m;dd  n15_0925_2_Filter
         HN     29 ASP  HN      4.00       #,  n15_0925_2_Filter
         HN     72 LEU  QB      6.00       #,m;db  n15_0925_2_Filter
         HA     28 LYS  HB2     4.00       #,both  c13_0928_3
         HA     28 LYS  HB3     4.00       #,both  c13_0928_3
         HA     28 LYS  HG2     5.00       #,both  c13_0928_3
         HA     28 LYS  HG3     5.00       #,both  c13_0928_3
         HA     28 LYS  QD      6.00       #,m;dd  c13_0928_3
         HA     28 LYS  QE      6.00       #,m;de  c13_0928_3
         HA     29 ASP  HN      3.00       #,  n15_0925_2_Filter
         HA     30 PRO  QG      6.00       #,m;dg  c13_0928_3
         HA     30 PRO  QD      6.00       #,m;dd  c13_0928_3
         HA     31 ARG  HN      5.00       #,  n15_0925_2_Filter
         HA     31 ARG  QB      5.00       #,m;one  c13_0928_3
         HA     32 LEU  HN      5.00       #,  n15_0925_2_Filter
         QB     28 LYS  QG      6.60       #i;one,m;one  c13_0928_3
         QB     29 ASP  HN      5.60       #i;one,  n15_0925_2_Filter
         QB     31 ARG  HN      5.00       #m;one,  n15_0925_2_Filter
         QG     28 LYS  QE      7.00       #m;one,m;de  c13_0928_3
         QG     29 ASP  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     32 LEU  HA      6.00       #m;one,  c13_0928_3
         HG2    32 LEU  QB      6.00       #both,m;db  c13_0928_3
         HG3    32 LEU  QB      6.00       #both,m;db  c13_0928_3
         QG     32 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QG     68 GLY  HA2     6.00       #m;one,both  c13_0928_3
         QG     68 GLY  HA1     6.00       #m;one,both  c13_0928_3
         QD     31 ARG  QD      7.00       #m;dd,m;dd  c13_0928_3
         QD     32 LEU  QQD     8.40       #m;dd,q;dMe  c13_0928_3
         QD     71 ALA  HA      6.00       #m;dd,  c13_0928_3
         QD     72 LEU  HA      6.00       #m;dd,  c13_0928_3
         QD     72 LEU  QD1     7.00       #m;dd,m;bothMe  c13_0928_3
         QD     72 LEU  QD2     7.00       #m;dd,m;bothMe  c13_0928_3
         QD     75 ALA  HN      6.00       #m;dd,  n15_0925_2_Filter
         QE     72 LEU  QQD     8.40       #m;de,q;dMe  c13_0928_3
 29 ASP   
         HN     29 ASP  HA      4.00       #,  n15_0925_2_Filter
         HN     29 ASP  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     30 PRO  QG      6.00       #,m;dg  c13_0928_3
         HN     30 PRO  QD      6.00       #,m;dd  n15_0925_2_Filter
         HN     31 ARG  HN      4.00       #,  n15_0925_2_Filter
         HN     31 ARG  QB      6.00       #,m;one  n15_0925_2_Filter
         HN     31 ARG  QD      6.00       #,m;dd  c13_0928_3
         HN     32 LEU  QQD     7.40       #,q;dMe  n15_0925_2_Filter
         HA     29 ASP  QB      4.60       #,i;db  c13_0928_3
         HA     30 PRO  QG      6.00       #,m;dg  c13_0928_3
         HA     30 PRO  QD      6.00       #,m;dd  c13_0928_3
         QB     30 PRO  QB      6.20       #i;db,i;one  c13_0928_3
         QB     30 PRO  QD      6.60       #i;db,m;dd  c13_0928_3
         QB     32 LEU  HN      6.00       #m;db,  c13_0928_3
         QB     32 LEU  QQD     8.40       #m;db,q;dMe  c13_0928_3
 30 PRO   
         HA     30 PRO  HB2     4.00       #,both  c13_0928_3
         HA     30 PRO  HB3     4.00       #,both  c13_0928_3
         HA     30 PRO  QG      6.00       #,m;dg  c13_0928_3
         HA     30 PRO  QD      6.00       #,m;dd  c13_0928_3
         HA     31 ARG  HN      5.00       #,  n15_0925_2_Filter
         HA     32 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     33 GLY  HN      5.00       #,  n15_0925_2_Filter
         HA     34 MET  HN      4.00       #,  n15_0925_2_Filter
         HB2    30 PRO  QD      6.00       #both,m;dd  c13_0928_3
         HB3    30 PRO  QD      6.00       #both,m;dd  c13_0928_3
         HB2    31 ARG  HN      5.00       #both,  n15_0925_2_Filter
         HB3    31 ARG  HN      5.00       #both,  n15_0925_2_Filter
         QG     30 PRO  QD      7.00       #m;dg,m;dd  c13_0928_3
         QG     31 ARG  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     31 ARG  HA      6.00       #m;dg,  c13_0928_3
         QD     31 ARG  HN      6.00       #m;dd,  n15_0925_2_Filter
         QD     31 ARG  HB2     6.00       #m;dd,both  c13_0928_3
         QD     31 ARG  HB3     6.00       #m;dd,both  c13_0928_3
         QD     33 GLY  HN      6.00       #m;dd,  n15_0925_2_Filter
 31 ARG   
         HN     31 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN     31 ARG  HB2     4.00       #,both  c13_0928_3
         HN     31 ARG  HB3     4.00       #,both  c13_0928_3
         HN     32 LEU  HN      4.00       #,  n15_0925_2_Filter
         HN     32 LEU  HA      5.00       #,  n15_0925_2_Filter
         HN     32 LEU  QB      5.60       #,i;db  n15_0925_2_Filter
         HA     31 ARG  QB      4.60       #,i;one  c13_0928_3
         HA     32 LEU  HN      5.00       #,  c13_0928_3
         HA     33 GLY  HN      4.00       #,  n15_0925_2_Filter
         HB2    31 ARG  QD      6.00       #both,m;dd  c13_0928_3
         HB3    31 ARG  QD      6.00       #both,m;dd  c13_0928_3
         HB2    32 LEU  HN      5.00       #both,  c13_0928_3
         HB3    32 LEU  HN      5.00       #both,  c13_0928_3
         QB     32 LEU  QQD     8.00       #i;one,q;dMe  c13_0928_3
         QB     33 GLY  HN      6.00       #m;one,  n15_0925_2_Filter
         QD     71 ALA  QB      7.00       #m;dd,m;Me  c13_0928_3
 32 LEU   
         HN     32 LEU  HA      5.00       #,  n15_0925_2_Filter
         HN     32 LEU  QB      4.60       #,i;db  c13_0928_3
         HN     32 LEU  HG      5.00       #,  n15_0925_2_Filter
         HN     32 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN     33 GLY  HN      4.00       #,  n15_0925_2_Filter
         HN     33 GLY  QA      5.60       #,i;da  n15_0925_2_Filter
         HA     32 LEU  QB      4.60       #,i;db  c13_0928_3
         HA     32 LEU  HG      5.00       #,  c13_0928_3
         HA     32 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA     33 GLY  HN      5.00       #,  n15_0925_2_Filter
         HA     33 GLY  QA      5.60       #,i;da  c13_0928_3
         HA     34 MET  QE      6.00       #,m;Me  c13_0928_3
         QB     32 LEU  HG      5.60       #i;db,  c13_0928_3
         QB     32 LEU  QQD     5.60       #i;db,  c13_0928_3
         QB     33 GLY  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     34 MET  QB      7.00       #m;db,m;one  c13_0928_3
         QB     57 LEU  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     58 ASN  HA      6.00       #m;db,  c13_0928_3
         HG     32 LEU  QQD     5.00       #,  c13_0928_3
         HG     68 GLY  HA2     5.00       #,both  c13_0928_3
         HG     68 GLY  HA1     5.00       #,both  c13_0928_3
         QQD    34 MET  QB      8.40       #q;dMe,m;one  c13_0928_3
         QQD    34 MET  QE      8.40       #q;dMe,m;Me  c13_0928_3
         QQD    36 THR  QG2     8.40       #q;dMe,m;Me  c13_0928_3
         QQD    58 ASN  HA      7.40       #q;dMe,  c13_0928_3
         QQD    68 GLY  HA2     7.40       #q;dMe,both  c13_0928_3
         QQD    68 GLY  HA1     7.40       #q;dMe,both  c13_0928_3
         QQD    71 ALA  QB      8.40       #q;dMe,m;Me  c13_0928_3
         QQD    72 LEU  HA      7.40       #q;dMe,  c13_0928_3
         QQD    72 LEU  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQD    72 LEU  QQD     9.80       #q;dMe,q;dMe  c13_0928_3
 33 GLY   
         HN     33 GLY  QA      4.60       #,i;da  n15_0925_2_Filter
         HN     34 MET  HN      4.00       #,  n15_0925_2_Filter
         QA     34 MET  HN      4.60       #i;da,  n15_0925_2_Filter
 34 MET   
         HN     34 MET  HA      4.00       #,  n15_0925_2_Filter
         HN     34 MET  HB2     4.00       #,both  c13_0928_3
         HN     34 MET  HB3     4.00       #,both  c13_0928_3
         HA     34 MET  QE      6.00       #,m;Me  c13_0928_3
         HA     35 MET  QB      4.60       #,i;one  c13_0928_3
         HA     57 LEU  QB      6.00       #,m;db  c13_0928_3
         HA     57 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB2    34 MET  QE      6.00       #both,m;Me  c13_0928_3
         HB3    34 MET  QE      6.00       #both,m;Me  c13_0928_3
         HB2    35 MET  HA      5.00       #both,  c13_0928_3
         HB3    35 MET  HA      5.00       #both,  c13_0928_3
         QB     57 LEU  QB      7.00       #m;one,m;db  c13_0928_3
         QB     57 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QB     58 ASN  HN      5.00       #m;one,  n15_0925_2_Filter
         QE     56 PHE  HB2     6.00       #m;Me,both  c13_0928_3
         QE     56 PHE  HB3     6.00       #m;Me,both  c13_0928_3
         QE     57 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QE     58 ASN  HN      6.00       #m;Me,  n15_0925_2_Filter
         QE     58 ASN  QB      7.00       #m;Me,m;one  c13_0928_3
         QE     60 LYS  HB2     6.00       #m;Me,both  c13_0928_3
         QE     60 LYS  HB3     6.00       #m;Me,both  c13_0928_3
         QE     60 LYS  QE      7.00       #m;Me,m;de  c13_0928_3
         QE     61 ASP  HN      6.00       #m;Me,  n15_0925_2_Filter
         QE     64 ALA  QB      7.00       #m;Me,m;Me  c13_0928_3
         QE     68 GLY  QA      7.00       #m;Me,m;one  c13_0928_3
 35 MET   
         HA     35 MET  HB2     4.00       #,both  c13_0928_3
         HA     35 MET  HB3     4.00       #,both  c13_0928_3
         HA     35 MET  QG      6.00       #,m;dg  c13_0928_3
         QB     35 MET  QE      6.60       #i;one,m;Me  c13_0928_3
         QB     57 LEU  QB      7.00       #m;one,m;db  c13_0928_3
         QB     57 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QG     35 MET  QE      7.00       #m;dg,m;Me  c13_0928_3
 36 THR   
         HB     36 THR  QG2     6.00       #,m;Me  c13_0928_3
         HB     55 THR  QG2     6.00       #,m;Me  c13_0928_3
         QG2    37 THR  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    56 PHE  HA      6.00       #m;Me,  c13_0928_3
         QG2    72 LEU  QD1     7.00       #m;Me,m;bothMe  c13_0928_3
         QG2    72 LEU  QD2     7.00       #m;Me,m;bothMe  c13_0928_3
 37 THR   
         HN     37 THR  HA      5.00       #,  n15_0925_2_Filter
         HN     37 THR  HB      5.00       #,  n15_0925_2_Filter
         HN     37 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     38 VAL  HA      5.00       #,  n15_0925_2_Filter
         HN     54 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     54 VAL  HB      5.00       #,  n15_0925_2_Filter
         HN     54 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HN     55 THR  HA      5.00       #,  n15_0925_2_Filter
         HN     55 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HA     37 THR  HB      5.00       #,  c13_0928_3
         HA     37 THR  QG2     5.60       #,i;Me  c13_0928_3
         HA     38 VAL  HN      3.00       #,  c13_0928_3
         HA     38 VAL  HB      5.00       #,  c13_0928_3
         HA     38 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     55 THR  HN      5.00       #,  n15_0925_2_Filter
         HA     55 THR  QG2     6.00       #,m;Me  c13_0928_3
         HB     37 THR  QG2     6.00       #,m;Me  c13_0928_3
         HB     38 VAL  HN      4.00       #,  c13_0928_3
         HB     38 VAL  HA      5.00       #,  c13_0928_3
         HB     55 THR  HN      5.00       #,  n15_0925_2_Filter
         QG2    38 VAL  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    38 VAL  HA      6.00       #m;Me,  c13_0928_3
         QG2    38 VAL  HB      6.00       #m;Me,  c13_0928_3
         QG2    39 SER  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    39 SER  HA      6.00       #m;Me,  c13_0928_3
         QG2    39 SER  QB      7.00       #m;Me,m;one  c13_0928_3
         QG2    40 GLY  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    54 VAL  HA      6.00       #m;Me,  c13_0928_3
         QG2    55 THR  HN      6.00       #m;Me,  n15_0925_2_Filter
 38 VAL   
         HN     38 VAL  HB      4.00       #,  c13_0928_3
         HN     38 VAL  QQG     6.70       #,s;dMe  n15_0925_2_Filter
         HA     38 VAL  HB      5.00       #,  c13_0928_3
         HA     38 VAL  QQG     5.60       #,i;dMe  c13_0928_3
         HA     39 SER  HN      4.00       #,  c13_0928_3
         HA     40 GLY  HN      4.00       #,  n15_0925_2_Filter
         HA     53 TYR  CG      7.20       #,r;dd  c13_0928_3
         HA     54 VAL  HA      4.00       #,  c13_0928_3
         HA     54 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     55 THR  HN      5.00       #,  n15_0925_2_Filter
         HB     38 VAL  QQG     5.00       #,  c13_0928_3
         HB     54 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         QQG    39 SER  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    39 SER  HA      7.40       #q;dMe,  c13_0928_3
         QQG    40 GLY  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    41 VAL  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    52 VAL  QQG     9.80       #q;dMe,q;dMe  c13_0928_3
         QQG    53 TYR  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    53 TYR  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    54 VAL  HA      7.40       #q;dMe,  c13_0928_3
 39 SER   
         HN     39 SER  HA      4.00       #,  n15_0925_2_Filter
         HN     39 SER  HB2     4.00       #,both  c13_0928_3
         HN     39 SER  HB3     4.00       #,both  c13_0928_3
         HN     40 GLY  HN      3.00       #,  n15_0925_2_Filter
         HN     53 TYR  CZ      7.20       #,r;de  c13_0928_3
         HN     54 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     54 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HN     55 THR  HN      4.00       #,  n15_0925_2_Filter
         HN     55 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HA     39 SER  HB2     3.00       #,both  c13_0928_3
         HA     39 SER  HB3     3.00       #,both  c13_0928_3
         HA     40 GLY  HN      4.00       #,  n15_0925_2_Filter
         HA     40 GLY  QA      5.60       #,i;da  c13_0928_3
         QB     40 GLY  HN      5.60       #i;one,  c13_0928_3
         QB     53 TYR  CZ      8.20       #m;one,r;de  c13_0928_3
         HB2    55 THR  QG2     6.00       #both,m;Me  c13_0928_3
         HB3    55 THR  QG2     6.00       #both,m;Me  c13_0928_3
         HB2   100 ASP  QB      6.00       #both,m;one  c13_0928_3
         HB3   100 ASP  QB      6.00       #both,m;one  c13_0928_3
 40 GLY   
         HN     40 GLY  QA      4.60       #,i;da  n15_0925_2_Filter
         HN     41 VAL  HN      4.00       #,  n15_0925_2_Filter
         HN     53 TYR  HN      4.00       #,  n15_0925_2_Filter
         HN     53 TYR  QB      6.00       #,m;db  n15_0925_2_Filter
         HN     54 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HN     55 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         QA     41 VAL  HN      4.60       #i;da,  n15_0925_2_Filter
         QA     41 VAL  HB      5.60       #i;da,  c13_0928_3
         QA     41 VAL  QQG     8.00       #i;da,q;dMe  c13_0928_3
         QA     53 TYR  CG      8.20       #m;da,r;dd  c13_0928_3
         QA     53 TYR  CZ      8.20       #m;da,r;de  c13_0928_3
 41 VAL   
         HN     41 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     41 VAL  HB      4.00       #,  n15_0925_2_Filter
         HN     41 VAL  QQG     6.70       #,s;dMe  c13_0928_3
         HN     42 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA     41 VAL  HB      4.00       #,  c13_0928_3
         HA     41 VAL  QQG     5.60       #,i;dMe  c13_0928_3
         HA     42 GLU  HN      3.00       #,  n15_0925_2_Filter
         HA     52 VAL  HA      4.00       #,  c13_0928_3
         HA     52 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HA     52 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HA     53 TYR  HN      4.00       #,  n15_0925_2_Filter
         HB     41 VAL  QQG     5.00       #,  c13_0928_3
         HB     42 GLU  HN      4.00       #,  n15_0925_2_Filter
         QQG    42 GLU  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    43 MET  HA      7.40       #q;dMe,  c13_0928_3
         QQG    43 MET  QG      8.40       #q;dMe,m;dg  c13_0928_3
         QQG    43 MET  QE      8.40       #q;dMe,m;Me  c13_0928_3
         QQG    52 VAL  HA      7.40       #q;dMe,  c13_0928_3
         QQG    52 VAL  QQG     9.80       #q;dMe,q;dMe  c13_0928_3
         QQG    53 TYR  HN      7.40       #q;dMe,  n15_0925_2_Filter
 42 GLU   
         HN     42 GLU  HA      4.00       #,  n15_0925_2_Filter
         HN     42 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     51 LYS  HN      5.00       #,  n15_0925_2_Filter
         HN     52 VAL  HN      5.00       #,  n15_0925_2_Filter
         HN     52 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     53 TYR  HN      5.00       #,  n15_0925_2_Filter
         HA     42 GLU  QB      4.60       #,i;db  c13_0928_3
         HA     43 MET  HN      3.00       #,  n15_0925_2_Filter
         QB     43 MET  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     44 SER  HN      5.00       #m;db,  n15_0925_2_Filter
         QB     51 LYS  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     51 LYS  QG      7.00       #m;db,m;one  c13_0928_3
         QB     51 LYS  QE      7.00       #m;db,m;de  c13_0928_3
 43 MET   
         HN     43 MET  HA      4.00       #,  n15_0925_2_Filter
         HN     43 MET  HB2     4.00       #,both  n15_0925_2_Filter
         HN     43 MET  HB3     4.00       #,both  n15_0925_2_Filter
         HN     43 MET  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     43 MET  QE      6.00       #,m;Me  n15_0925_2_Filter
         HN     44 SER  HN      4.00       #,  n15_0925_2_Filter
         HN     51 LYS  QG      6.00       #,m;one  n15_0925_2_Filter
         HA     43 MET  HB2     4.00       #,both  c13_0928_3
         HA     43 MET  HB3     4.00       #,both  c13_0928_3
         HA     43 MET  QG      6.00       #,m;dg  c13_0928_3
         HA     43 MET  QE      6.00       #,m;Me  c13_0928_3
         HA     44 SER  HN      3.00       #,  n15_0925_2_Filter
         HA     50 ALA  HA      4.00       #,  c13_0928_3
         HA     50 ALA  QB      6.00       #,m;Me  c13_0928_3
         HB2    43 MET  QG      6.00       #both,m;dg  c13_0928_3
         HB3    43 MET  QG      6.00       #both,m;dg  c13_0928_3
         QB     43 MET  QE      6.60       #i;one,m;Me  c13_0928_3
         HB2    44 SER  HN      4.00       #both,  n15_0925_2_Filter
         HB3    44 SER  HN      4.00       #both,  n15_0925_2_Filter
         QB     45 ARG  HN      5.00       #m;one,  n15_0925_2_Filter
         QB     45 ARG  QG      7.00       #m;one,m;dg  c13_0928_3
         QB     45 ARG  QD      7.00       #m;one,m;dd  c13_0928_3
         QG     43 MET  QE      7.00       #m;dg,m;Me  c13_0928_3
         QG     44 SER  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     50 ALA  QB      7.00       #m;dg,m;Me  c13_0928_3
         QG     52 VAL  QQG     8.40       #m;dg,q;dMe  c13_0928_3
 44 SER   
         HN     44 SER  HA      4.00       #,  n15_0925_2_Filter
         HN     44 SER  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     45 ARG  HN      4.00       #,  n15_0925_2_Filter
         HN     49 TYR  HN      4.00       #,  n15_0925_2_Filter
         HA     44 SER  QB      4.60       #,i;db  c13_0928_3
         HA     45 ARG  HN      3.00       #,  n15_0925_2_Filter
         HA     45 ARG  HA      5.00       #,  c13_0928_3
         HA     45 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     45 ARG  QD      6.00       #,m;dd  c13_0928_3
         QB     45 ARG  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     46 ASP  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     47 LEU  QQD     8.40       #m;db,q;dMe  c13_0928_3
         QB     49 TYR  HN      5.00       #m;db,  n15_0925_2_Filter
         QB     49 TYR  QB      7.00       #m;db,m;one  c13_0928_3
         QB     49 TYR  CG      8.20       #m;db,r;dd  c13_0928_3
         QB     51 LYS  HN      6.00       #m;db,  n15_0925_2_Filter
 45 ARG   
         HN     45 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN     45 ARG  QB      4.60       #,i;one  n15_0925_2_Filter
         HN     45 ARG  QG      6.00       #,m;dg  c13_0928_3
         HN     46 ASP  HN      5.00       #,  n15_0925_2_Filter
         HN     47 LEU  HN      5.00       #,  n15_0925_2_Filter
         HN     49 TYR  HN      5.00       #,  n15_0925_2_Filter
         HN     49 TYR  CG      7.20       #,r;dd  c13_0928_3
         HA     45 ARG  HB2     5.00       #,both  c13_0928_3
         HA     45 ARG  HB3     5.00       #,both  c13_0928_3
         HA     45 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     45 ARG  QD      6.00       #,m;dd  c13_0928_3
         HA     46 ASP  HN      5.00       #,  c13_0928_3
         HA     46 ASP  HA      5.00       #,  c13_0928_3
         HA     47 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     49 TYR  HN      5.00       #,  c13_0928_3
         HA     91 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     93 PRO  QB      5.00       #,m;one  c13_0928_3
         HA     93 PRO  HG2     5.00       #,both  c13_0928_3
         HA     93 PRO  HG3     5.00       #,both  c13_0928_3
         QB     45 ARG  QG      6.60       #i;one,m;dg  c13_0928_3
         HB2    45 ARG  QD      6.00       #both,m;dd  c13_0928_3
         HB3    45 ARG  QD      6.00       #both,m;dd  c13_0928_3
         HB2    46 ASP  HN      5.00       #both,  c13_0928_3
         HB3    46 ASP  HN      5.00       #both,  c13_0928_3
         QB     47 LEU  HN      6.00       #m;one,  c13_0928_3
         QB     47 LEU  HN      5.00       #m;one,  n15_0925_2_Filter
         QB     91 ILE  QG2     7.00       #m;one,m;Me  c13_0928_3
         HB2    91 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         HB3    91 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         QG     45 ARG  QD      7.00       #m;dg,m;dd  c13_0928_3
         QG     50 ALA  QB      7.00       #m;dg,m;Me  c13_0928_3
         QG     89 LEU  QQD     8.40       #m;dg,q;dMe  c13_0928_3
         QG     91 ILE  QG1     7.00       #m;dg,m;one  c13_0928_3
         QG     93 PRO  QB      7.00       #m;dg,m;one  c13_0928_3
         QG     93 PRO  QD      7.00       #m;dg,m;one  c13_0928_3
         QD     50 ALA  QB      7.00       #m;dd,m;Me  c13_0928_3
         QD     89 LEU  QQD     8.40       #m;dd,q;dMe  c13_0928_3
         QD     91 ILE  HB      6.00       #m;dd,  c13_0928_3
         QD     91 ILE  QG1     7.00       #m;dd,m;one  c13_0928_3
         QD     93 PRO  HB2     6.00       #m;dd,both  c13_0928_3
         QD     93 PRO  HB3     6.00       #m;dd,both  c13_0928_3
         QD     93 PRO  QG      7.00       #m;dd,m;one  c13_0928_3
 46 ASP   
         HN     46 ASP  HA      4.00       #,  c13_0928_3
         HN     46 ASP  HB2     4.00       #,both  c13_0928_3
         HN     46 ASP  HB3     4.00       #,both  c13_0928_3
         HA     46 ASP  HB2     4.00       #,both  c13_0928_3
         HA     46 ASP  HB3     4.00       #,both  c13_0928_3
         HA     47 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QB     47 LEU  QB      6.20       #i;one,i;one  c13_0928_3
 47 LEU   
         HN     47 LEU  HA      3.00       #,  n15_0925_2_Filter
         HN     47 LEU  HB2     4.00       #,both  n15_0925_2_Filter
         HN     47 LEU  HB3     4.00       #,both  n15_0925_2_Filter
         HN     47 LEU  HG      5.00       #,  c13_0928_3
         HN     47 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN     48 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     48 ALA  HA      5.00       #,  c13_0928_3
         HN     48 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     47 LEU  HB2     4.00       #,both  c13_0928_3
         HA     47 LEU  HB3     4.00       #,both  c13_0928_3
         HA     47 LEU  HG      5.00       #,  c13_0928_3
         HA     47 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA     48 ALA  HN      4.00       #,  n15_0925_2_Filter
         HA     48 ALA  HA      5.00       #,  c13_0928_3
         QB     47 LEU  HG      5.60       #i;one,  c13_0928_3
         HB2    47 LEU  QQD     5.00       #both,  c13_0928_3
         HB3    47 LEU  QQD     5.00       #both,  c13_0928_3
         QB     48 ALA  QB      6.60       #i;one,m;Me  c13_0928_3
         QB     49 TYR  CZ      8.20       #m;one,r;de  c13_0928_3
         HG     47 LEU  QQD     5.00       #,  c13_0928_3
         QQD    48 ALA  QB      8.40       #q;dMe,m;Me  c13_0928_3
 48 ALA   
         HN     48 ALA  HA      4.00       #,  n15_0925_2_Filter
         HN     48 ALA  QB      4.60       #,i;Me  n15_0925_2_Filter
         HN     49 TYR  HN      4.00       #,  n15_0925_2_Filter
         HN     49 TYR  QB      4.60       #,i;one  n15_0925_2_Filter
         HN     49 TYR  CZ      7.20       #,r;de  c13_0928_3
         HA     48 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA     49 TYR  HN      5.00       #,  c13_0928_3
         HA     91 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     93 PRO  HA      4.00       #,  c13_0928_3
         HA     93 PRO  QB      6.00       #,m;one  c13_0928_3
         HA     93 PRO  QG      6.00       #,m;one  c13_0928_3
         HA     94 GLU  HN      5.00       #,  c13_0928_3
         QB     49 TYR  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     49 TYR  HA      6.00       #m;Me,  c13_0928_3
         QB     49 TYR  QB      6.60       #m;Me,i;one  c13_0928_3
         QB     49 TYR  CG      8.20       #m;Me,r;dd  c13_0928_3
         QB     49 TYR  CZ      8.20       #m;Me,r;de  c13_0928_3
         QB     91 ILE  QG2     7.00       #m;Me,m;Me  c13_0928_3
         QB     92 VAL  HB      6.00       #m;Me,  c13_0928_3
         QB     92 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
         QB     93 PRO  HA      6.00       #m;Me,  c13_0928_3
         QB     93 PRO  HB2     6.00       #m;Me,both  c13_0928_3
         QB     93 PRO  HB3     6.00       #m;Me,both  c13_0928_3
         QB     94 GLU  QB      7.00       #m;Me,m;db  c13_0928_3
 49 TYR   
         HN     49 TYR  HA      4.00       #,  n15_0925_2_Filter
         HN     49 TYR  HB2     4.00       #,both  n15_0925_2_Filter
         HN     49 TYR  HB3     4.00       #,both  n15_0925_2_Filter
         HN     49 TYR  CG      6.00       #,m;dd  n15_0925_2_Filter
         HN     50 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     50 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HN     93 PRO  HA      4.00       #,  n15_0925_2_Filter
         HN     93 PRO  QG      6.00       #,m;one  n15_0925_2_Filter
         HN     94 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA     49 TYR  HB2     4.00       #,both  c13_0928_3
         HA     49 TYR  HB3     4.00       #,both  c13_0928_3
         HA     50 ALA  HN      4.00       #,  n15_0925_2_Filter
         HA     50 ALA  HA      5.00       #,  c13_0928_3
         HA     50 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     51 LYS  QG      6.00       #,m;one  c13_0928_3
         HA     93 PRO  HA      4.00       #,  c13_0928_3
         HA     93 PRO  HB2     4.00       #,both  c13_0928_3
         HA     93 PRO  HB3     4.00       #,both  c13_0928_3
         HA     94 GLU  HN      5.00       #,  n15_0925_2_Filter
         HA     94 GLU  HA      5.00       #,  c13_0928_3
         HA     94 GLU  QB      6.00       #,m;db  c13_0928_3
         HA     94 GLU  QG      6.00       #,m;one  c13_0928_3
         HA     95 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     95 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB2    49 TYR  CG      6.00       #both,m;dd  c13_0928_3
         HB3    49 TYR  CG      6.00       #both,m;dd  c13_0928_3
         QB     49 TYR  CZ      6.60       #i;one,m;de  c13_0928_3
         HB2    50 ALA  HN      4.00       #both,  n15_0925_2_Filter
         HB3    50 ALA  HN      4.00       #both,  n15_0925_2_Filter
         QB     50 ALA  HA      5.60       #i;one,  c13_0928_3
         QB     51 LYS  QE      7.00       #m;one,m;de  c13_0928_3
         QB     94 GLU  QB      7.00       #m;one,m;db  c13_0928_3
         CG     49 TYR  CZ      7.00       #m;dd,m;de  c13_0928_3
         CG     50 ALA  HN      7.20       #r;dd,  n15_0925_2_Filter
         CG     94 GLU  HN      7.20       #r;dd,  c13_0928_3
         CG     94 GLU  QG      8.20       #r;dd,m;one  c13_0928_3
         CZ     94 GLU  QB      8.20       #r;de,m;db  c13_0928_3
 50 ALA   
         HN     50 ALA  QB      4.60       #,i;Me  n15_0925_2_Filter
         HN     51 LYS  QG      6.00       #,m;one  n15_0925_2_Filter
         HN     93 PRO  HB2     5.00       #,both  n15_0925_2_Filter
         HN     93 PRO  HB3     5.00       #,both  n15_0925_2_Filter
         HN     93 PRO  QG      6.00       #,m;one  n15_0925_2_Filter
         HN     94 GLU  HN      4.00       #,  n15_0925_2_Filter
         HN     95 LEU  HA      4.00       #,  n15_0925_2_Filter
         HN     95 LEU  QB      6.00       #,m;db  n15_0925_2_Filter
         HN     95 LEU  HG      5.00       #,  n15_0925_2_Filter
         HN     95 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HN     96 THR  HN      5.00       #,  n15_0925_2_Filter
         HN     96 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HA     50 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA     51 LYS  HN      3.00       #,  n15_0925_2_Filter
         HA     51 LYS  QB      5.60       #,i;one  c13_0928_3
         HA     95 LEU  HA      5.00       #,  c13_0928_3
         QB     51 LYS  HN      6.00       #m;Me,  c13_0928_3
         QB     52 VAL  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     52 VAL  HB      6.00       #m;Me,  c13_0928_3
         QB     52 VAL  QQG     8.40       #m;Me,q;dMe  c13_0928_3
         QB     93 PRO  HB2     6.00       #m;Me,both  c13_0928_3
         QB     93 PRO  HB3     6.00       #m;Me,both  c13_0928_3
         QB     93 PRO  HG2     6.00       #m;Me,both  c13_0928_3
         QB     93 PRO  HG3     6.00       #m;Me,both  c13_0928_3
         QB     93 PRO  HD2     6.00       #m;Me,both  c13_0928_3
         QB     93 PRO  HD3     6.00       #m;Me,both  c13_0928_3
         QB     95 LEU  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     95 LEU  HA      6.00       #m;Me,  c13_0928_3
         QB     95 LEU  HG      6.00       #m;Me,  c13_0928_3
         QB     95 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QB     96 THR  HN      6.00       #m;Me,  c13_0928_3
 51 LYS   
         HN     51 LYS  HA      4.00       #,  n15_0925_2_Filter
         HN     51 LYS  HB2     5.00       #,both  c13_0928_3
         HN     51 LYS  HB3     5.00       #,both  c13_0928_3
         HN     51 LYS  HG2     5.00       #,both  c13_0928_3
         HN     51 LYS  HG3     5.00       #,both  c13_0928_3
         HN     52 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     51 LYS  HB2     4.00       #,both  c13_0928_3
         HA     51 LYS  HB3     4.00       #,both  c13_0928_3
         HA     51 LYS  HG2     5.00       #,both  c13_0928_3
         HA     51 LYS  HG3     5.00       #,both  c13_0928_3
         HA     51 LYS  QE      6.00       #,m;de  c13_0928_3
         HA     52 VAL  HN      3.00       #,  n15_0925_2_Filter
         HA     52 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     95 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HA     96 THR  HN      4.00       #,  n15_0925_2_Filter
         HA     96 THR  HB      4.00       #,  c13_0928_3
         HA     96 THR  QG2     6.00       #,m;Me  c13_0928_3
         HA     98 PHE  QB      6.00       #,m;one  c13_0928_3
         HA     98 PHE  CG      7.20       #,r;dd  c13_0928_3
         HB2    51 LYS  QE      6.00       #both,m;de  c13_0928_3
         HB3    51 LYS  QE      6.00       #both,m;de  c13_0928_3
         HB2    52 VAL  HN      5.00       #both,  c13_0928_3
         HB3    52 VAL  HN      5.00       #both,  c13_0928_3
         QB     98 PHE  QB      6.00       #m;one,m;one  c13_0928_3
         HG2    51 LYS  QE      6.00       #both,m;de  c13_0928_3
         HG3    51 LYS  QE      6.00       #both,m;de  c13_0928_3
         QG     52 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QG     95 LEU  HA      6.00       #m;one,  c13_0928_3
         QG     96 THR  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     98 PHE  CZ      8.20       #m;one,r;de  c13_0928_3
         QE     96 THR  HN      6.00       #m;de,  n15_0925_2_Filter
         QE     96 THR  QG2     7.00       #m;de,m;Me  c13_0928_3
 52 VAL   
         HN     52 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     52 VAL  HB      4.00       #,  n15_0925_2_Filter
         HN     52 VAL  QG1     6.00       #,m;bothMe  n15_0925_2_Filter
         HN     52 VAL  QG2     6.00       #,m;bothMe  n15_0925_2_Filter
         HN     53 TYR  HA      5.00       #,  c13_0928_3
         HN     95 LEU  QQD     7.40       #,q;dMe  n15_0925_2_Filter
         HN     96 THR  HN      5.00       #,  n15_0925_2_Filter
         HN     97 PHE  HA      4.00       #,  n15_0925_2_Filter
         HN     98 PHE  HN      4.00       #,  n15_0925_2_Filter
         HN     98 PHE  CG      7.20       #,r;dd  n15_0925_2_Filter
         HA     52 VAL  HB      5.00       #,  c13_0928_3
         HA     52 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HA     52 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HA     53 TYR  HN      4.00       #,  c13_0928_3
         HA     53 TYR  CG      7.20       #,r;dd  c13_0928_3
         HB     52 VAL  QQG     5.00       #,  c13_0928_3
         HB     95 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     97 PHE  CG      7.20       #,r;dd  c13_0928_3
         QQG    52 VAL  QQG     5.00       #,  c13_0928_3
         QQG    53 TYR  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    53 TYR  QB      8.00       #q;dMe,i;db  c13_0928_3
         QQG    54 VAL  QQG     9.80       #q;dMe,q;dMe  c13_0928_3
         QQG    97 PHE  HA      7.40       #q;dMe,  c13_0928_3
         QQG    97 PHE  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    97 PHE  CZ      9.60       #q;dMe,r;de  c13_0928_3
         QQG    53 TYR  HN      7.40       #q;dMe,  c13_0928_3
         QQG    54 VAL  QQG     9.80       #q;dMe,q;dMe  c13_0928_3
         QQG    95 LEU  HA      7.40       #q;dMe,  c13_0928_3
         QQG    95 LEU  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    95 LEU  HG      7.40       #q;dMe,  c13_0928_3
         QQG    97 PHE  HA      7.40       #q;dMe,  c13_0928_3
         QQG    97 PHE  CG      9.60       #q;dMe,r;dd  c13_0928_3
 53 TYR   
         HN     53 TYR  HA      5.00       #,  c13_0928_3
         HN     53 TYR  QB      5.60       #,i;db  c13_0928_3
         HN     53 TYR  CG      6.00       #,m;dd  n15_0925_2_Filter
         HN     54 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HA     53 TYR  QB      5.60       #,i;db  c13_0928_3
         HA     53 TYR  CG      6.00       #,m;dd  c13_0928_3
         HA     53 TYR  CZ      6.00       #,m;de  c13_0928_3
         HA     54 VAL  HN      3.00       #,  n15_0925_2_Filter
         HA     54 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HA     54 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HA     98 PHE  HN      4.00       #,  n15_0925_2_Filter
         HA     98 PHE  HB2     5.00       #,both  c13_0928_3
         HA     98 PHE  HB3     5.00       #,both  c13_0928_3
         HA    100 ASP  QB      6.00       #,m;one  c13_0928_3
         QB     54 VAL  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     54 VAL  QQG     8.00       #i;db,q;dMe  c13_0928_3
         QB     98 PHE  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     98 PHE  QB      7.00       #m;db,m;one  c13_0928_3
         QB    100 ASP  QB      7.00       #m;db,m;one  c13_0928_3
         CG     53 TYR  CZ      7.00       #m;dd,m;de  c13_0928_3
         CG     54 VAL  HN      7.20       #r;dd,  n15_0925_2_Filter
         CG     55 THR  HB      7.20       #r;dd,  c13_0928_3
         CG     98 PHE  QB      8.20       #r;dd,m;one  c13_0928_3
         CG     99 TYR  HA      7.20       #r;dd,  c13_0928_3
         CG    100 ASP  HN      7.20       #r;dd,  n15_0925_2_Filter
         CG    100 ASP  HB2     7.20       #r;dd,both  c13_0928_3
         CG    100 ASP  HB3     7.20       #r;dd,both  c13_0928_3
         CZ     55 THR  HA      7.20       #r;de,  c13_0928_3
         CZ     55 THR  HB      7.20       #r;de,  c13_0928_3
         CZ     98 PHE  HA      7.20       #r;de,  c13_0928_3
         CZ     98 PHE  HB2     7.20       #r;de,both  c13_0928_3
         CZ     98 PHE  HB3     7.20       #r;de,both  c13_0928_3
         CZ     99 TYR  HN      7.20       #r;de,  c13_0928_3
         CZ     99 TYR  HA      7.20       #r;de,  c13_0928_3
         CZ    100 ASP  HN      7.20       #r;de,  c13_0928_3
         CZ    100 ASP  HA      7.20       #r;de,  c13_0928_3
         CZ    108 ARG  QG      8.20       #r;de,m;dg  c13_0928_3
         CZ    108 ARG  QD      8.20       #r;de,m;dd  c13_0928_3
 54 VAL   
         HN     54 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HN     54 VAL  QQG     6.70       #,s;dMe  n15_0925_2_Filter
         HN     55 THR  HN      4.00       #,  n15_0925_2_Filter
         HN     98 PHE  HN      4.00       #,  n15_0925_2_Filter
         HN     99 TYR  HA      4.00       #,  n15_0925_2_Filter
         HN    100 ASP  HN      3.00       #,  n15_0925_2_Filter
         HN    100 ASP  QB      6.00       #,m;one  n15_0925_2_Filter
         HA     54 VAL  HB      4.00       #,  c13_0928_3
         HA     54 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HA     54 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HA     55 THR  HN      4.00       #,  n15_0925_2_Filter
         HA     56 PHE  HZ      5.00       #,  c13_0928_3
         HB     54 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HB     54 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HB     55 THR  HN      5.00       #,  n15_0925_2_Filter
         HB     55 THR  QG2     6.00       #,m;Me  c13_0928_3
         HB     56 PHE  HZ      5.00       #,  c13_0928_3
         HB     72 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QQG    54 VAL  QQG     5.00       #,  c13_0928_3
         QQG    55 THR  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG    56 PHE  HZ      7.40       #q;dMe,  c13_0928_3
         QQG    97 PHE  HA      7.40       #q;dMe,  c13_0928_3
         QQG    97 PHE  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    99 TYR  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    55 THR  HN      7.40       #q;dMe,  c13_0928_3
         QQG    72 LEU  QQD     9.80       #q;dMe,q;dMe  c13_0928_3
         QQG    97 PHE  HA      7.40       #q;dMe,  c13_0928_3
         QQG    97 PHE  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    97 PHE  CG      9.60       #q;dMe,r;dd  c13_0928_3
         QQG    97 PHE  CZ      9.60       #q;dMe,r;de  c13_0928_3
         QQG    99 TYR  HA      7.40       #q;dMe,  c13_0928_3
         QQG    99 TYR  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQG    99 TYR  CG      9.60       #q;dMe,r;dd  c13_0928_3
 55 THR   
         HN     55 THR  HA      5.00       #,  n15_0925_2_Filter
         HN     55 THR  HB      4.00       #,  n15_0925_2_Filter
         HN     55 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HA     55 THR  HB      4.00       #,  c13_0928_3
         HA     55 THR  QG2     5.60       #,i;Me  c13_0928_3
         HA     56 PHE  HN      4.00       #,  n15_0925_2_Filter
         HA    100 ASP  HN      4.00       #,  n15_0925_2_Filter
         HA    101 ASN  HA      4.00       #,  c13_0928_3
         HA    108 ARG  QG      6.00       #,m;dg  c13_0928_3
         HB     55 THR  QG2     6.00       #,m;Me  c13_0928_3
         HB     56 PHE  HN      4.00       #,  n15_0925_2_Filter
         HB    100 ASP  HN      4.00       #,  n15_0925_2_Filter
         HB    108 ARG  HB2     5.00       #,both  c13_0928_3
         HB    108 ARG  HB3     5.00       #,both  c13_0928_3
         HB    108 ARG  QG      6.00       #,m;dg  c13_0928_3
         QG2    56 PHE  HA      6.00       #m;Me,  c13_0928_3
         QG2    56 PHE  CZ      8.20       #m;Me,r;de  c13_0928_3
         QG2   100 ASP  HB2     6.00       #m;Me,both  c13_0928_3
         QG2   100 ASP  HB3     6.00       #m;Me,both  c13_0928_3
         QG2   108 ARG  QG      7.00       #m;Me,m;dg  c13_0928_3
 56 PHE   
         HN     56 PHE  HA      4.00       #,  c13_0928_3
         HA     56 PHE  HB2     4.00       #,both  c13_0928_3
         HA     56 PHE  HB3     4.00       #,both  c13_0928_3
         HA     57 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     57 LEU  HA      5.00       #,  c13_0928_3
         HA     57 LEU  QB      5.60       #,i;db  c13_0928_3
         HB2    57 LEU  HN      5.00       #both,  c13_0928_3
         HB3    57 LEU  HN      5.00       #both,  c13_0928_3
         QB     57 LEU  QB      6.20       #i;one,i;db  c13_0928_3
         QB     58 ASN  HN      6.00       #m;one,  n15_0925_2_Filter
         HB2    58 ASN  HA      5.00       #both,  c13_0928_3
         HB3    58 ASN  HA      5.00       #both,  c13_0928_3
         HB2    58 ASN  HB2     5.00       #both,both  c13_0928_3
         HB3    58 ASN  HB3     5.00       #both,both  c13_0928_3
         QB     58 ASN  HD21    6.00       #m;one,both  n15_0925_2_Filter
         QB     58 ASN  HD22    6.00       #m;one,both  n15_0925_2_Filter
         QB    101 ASN  HA      6.00       #m;one,  c13_0928_3
         QB    102 SER  HN      6.00       #m;one,  n15_0925_2_Filter
         CG     58 ASN  QB      8.20       #r;dd,m;one  c13_0928_3
         CG     99 TYR  QB      8.20       #r;dd,m;db  c13_0928_3
         CG    101 ASN  QB      8.20       #r;dd,m;one  c13_0928_3
         CZ     69 ILE  QD1     8.20       #r;de,m;Me  c13_0928_3
         HZ     99 TYR  HA      5.00       #,  c13_0928_3
         HZ     99 TYR  QB      6.00       #,m;db  c13_0928_3
         HZ     99 TYR  CZ      7.20       #,r;de  c13_0928_3
 57 LEU   
         HN     57 LEU  HA      4.00       #,  c13_0928_3
         HN     57 LEU  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     57 LEU  HG      5.00       #,  n15_0925_2_Filter
         HN     57 LEU  QQD     7.20       #,r;dMe  c13_0928_3
         HN     59 ASP  HN      5.00       #,  n15_0925_2_Filter
         HA     57 LEU  QB      4.60       #,i;db  c13_0928_3
         HA     57 LEU  HG      5.00       #,  c13_0928_3
         HA     57 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA     58 ASN  HN      4.00       #,  n15_0925_2_Filter
         HA     59 ASP  HN      5.00       #,  c13_0928_3
         HA     59 ASP  QB      6.00       #,m;db  c13_0928_3
         HA     60 LYS  HN      4.00       #,  n15_0925_2_Filter
         HA    101 ASN  QB      6.00       #,m;one  c13_0928_3
         HA    102 SER  HN      4.00       #,  n15_0925_2_Filter
         HA    102 SER  QB      6.00       #,m;db  c13_0928_3
         QB     57 LEU  QQD     5.60       #i;db,  c13_0928_3
         QB     58 ASN  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     59 ASP  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     60 LYS  HN      6.00       #m;db,  n15_0925_2_Filter
         QB     60 LYS  QE      7.00       #m;db,m;de  c13_0928_3
         HG     57 LEU  QQD     5.00       #,  c13_0928_3
         HG     58 ASN  HN      5.00       #,  n15_0925_2_Filter
         HG     59 ASP  HN      5.00       #,  n15_0925_2_Filter
         HG     60 LYS  HN      5.00       #,  n15_0925_2_Filter
         HG     60 LYS  HA      5.00       #,  c13_0928_3
         HG     60 LYS  QE      6.00       #,m;de  c13_0928_3
         QQD    58 ASN  HN      7.40       #q;dMe,  c13_0928_3
         QQD    59 ASP  HN      7.40       #q;dMe,  c13_0928_3
 58 ASN   
         HN     58 ASN  HA      4.00       #,  c13_0928_3
         HN     58 ASN  HB2     5.00       #,both  c13_0928_3
         HN     58 ASN  HB3     5.00       #,both  c13_0928_3
         HN     58 ASN  QD2     6.00       #,m;one  n15_0925_2_Filter
         HN     59 ASP  HN      5.00       #,  n15_0925_2_Filter
         HN     59 ASP  QB      5.60       #,i;db  n15_0925_2_Filter
         HN    101 ASN  HA      5.00       #,  c13_0928_3
         HN    101 ASN  HB2     5.00       #,both  n15_0925_2_Filter
         HN    101 ASN  HB3     5.00       #,both  n15_0925_2_Filter
         HA     58 ASN  HB2     5.00       #,both  c13_0928_3
         HA     58 ASN  HB3     5.00       #,both  c13_0928_3
         HA     59 ASP  HN      4.00       #,  c13_0928_3
         HA     60 LYS  HN      4.00       #,  n15_0925_2_Filter
         HA     61 ASP  HN      4.00       #,  n15_0925_2_Filter
         QB     58 ASN  HD21    5.60       #i;one,both  n15_0925_2_Filter
         QB     58 ASN  HD22    5.60       #i;one,both  n15_0925_2_Filter
         QB     58 ASN  HD21    5.60       #i;one,both  n15_0925_2_Filter
         QB     58 ASN  HD22    5.60       #i;one,both  n15_0925_2_Filter
         HB2    59 ASP  HN      5.00       #both,  n15_0925_2_Filter
         HB3    59 ASP  HN      5.00       #both,  n15_0925_2_Filter
         QB     59 ASP  HA      5.60       #i;one,  c13_0928_3
         QB     60 LYS  HN      6.00       #m;one,  n15_0925_2_Filter
         QB     64 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
         HB2    65 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         HB3    65 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         QB     69 ILE  HB      5.00       #m;one,  c13_0928_3
         QB    101 ASN  HA      6.00       #m;one,  c13_0928_3
         QB    101 ASN  QB      6.00       #m;one,m;one  c13_0928_3
         QB    101 ASN  QD2     7.00       #m;one,m;one  n15_0925_2_Filter
         QB    102 SER  HN      6.00       #m;one,  n15_0925_2_Filter
         QD2    61 ASP  HN      6.00       #m;one,  n15_0925_2_Filter
         QD2    61 ASP  HB2     6.00       #m;one,both  n15_0925_2_Filter
         QD2    61 ASP  HB3     6.00       #m;one,both  n15_0925_2_Filter
         HD21   64 ALA  HN      5.00       #both,  n15_0925_2_Filter
         HD22   64 ALA  HN      5.00       #both,  n15_0925_2_Filter
         QD2    64 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
         QD2    65 VAL  HN      6.00       #m;one,  n15_0925_2_Filter
         QD2    65 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QD2    69 ILE  HN      6.00       #m;one,  n15_0925_2_Filter
 59 ASP   
         HN     59 ASP  HA      4.00       #,  n15_0925_2_Filter
         HN     59 ASP  QB      5.60       #,i;db  n15_0925_2_Filter
         HN    101 ASN  HA      5.00       #,  c13_0928_3
         HN    101 ASN  QB      6.00       #,m;one  n15_0925_2_Filter
         HN    101 ASN  QB      6.00       #,m;one  c13_0928_3
         HN    101 ASN  QD2     6.00       #,m;one  n15_0925_2_Filter
         HN    102 SER  HN      5.00       #,  n15_0925_2_Filter
         HA     59 ASP  QB      5.60       #,i;db  c13_0928_3
         HA     60 LYS  HN      4.00       #,  c13_0928_3
         HA     61 ASP  HN      5.00       #,  c13_0928_3
         HA     65 VAL  HA      5.00       #,  c13_0928_3
         HA     65 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA    101 ASN  QB      6.00       #,m;one  c13_0928_3
         HA    102 SER  HN      4.00       #,  n15_0925_2_Filter
         HA    103 LEU  HA      4.00       #,  c13_0928_3
         HA    103 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QB     60 LYS  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     60 LYS  HA      5.60       #i;db,  c13_0928_3
         QB     65 VAL  QG1     7.00       #m;db,m;bothMe  c13_0928_3
         QB     65 VAL  QG2     7.00       #m;db,m;bothMe  c13_0928_3
         QB    101 ASN  HA      6.00       #m;db,  c13_0928_3
         QB    101 ASN  QB      6.00       #m;db,m;one  c13_0928_3
         QB    102 SER  HN      6.00       #m;db,  n15_0925_2_Filter
         QB    103 LEU  HN      6.00       #m;db,  n15_0925_2_Filter
 60 LYS   
         HN     60 LYS  HA      4.00       #,  n15_0925_2_Filter
         HN     60 LYS  QB      4.60       #,i;one  c13_0928_3
         HN     60 LYS  QG      6.00       #,m;dg  c13_0928_3
         HN     61 ASP  HN      3.00       #,  n15_0925_2_Filter
         HA     60 LYS  QG      6.00       #,m;dg  c13_0928_3
         HA     61 ASP  HN      4.00       #,  n15_0925_2_Filter
         QB     60 LYS  QE      6.60       #i;one,m;de  c13_0928_3
         HB2    61 ASP  HN      5.00       #both,  n15_0925_2_Filter
         HB3    61 ASP  HN      5.00       #both,  n15_0925_2_Filter
         HB2    61 ASP  QB      5.60       #both,i;one  c13_0928_3
         HB3    61 ASP  QB      5.60       #both,i;one  c13_0928_3
         QB     64 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
         QG     60 LYS  QE      7.00       #m;dg,m;de  c13_0928_3
 61 ASP   
         HN     61 ASP  HA      4.00       #,  n15_0925_2_Filter
         HN     61 ASP  HB2     4.00       #,both  c13_0928_3
         HN     61 ASP  HB3     4.00       #,both  c13_0928_3
         HN     62 GLU  HN      4.00       #,  n15_0925_2_Filter
         HN     64 ALA  HN      5.00       #,  n15_0925_2_Filter
         HN     64 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HN     65 VAL  HN      5.00       #,  n15_0925_2_Filter
         HN     65 VAL  HB      5.00       #,  n15_0925_2_Filter
         HA     61 ASP  HB2     5.00       #,both  c13_0928_3
         HA     61 ASP  HB3     5.00       #,both  c13_0928_3
         HA     62 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA     62 GLU  HB2     5.00       #,both  c13_0928_3
         HA     62 GLU  HB3     5.00       #,both  c13_0928_3
         HB2    62 GLU  HN      4.00       #both,  n15_0925_2_Filter
         HB3    62 GLU  HN      4.00       #both,  n15_0925_2_Filter
         QB     62 GLU  HA      5.60       #i;one,  c13_0928_3
         QB     63 ASP  HN      5.00       #m;one,  n15_0925_2_Filter
         HB2    63 ASP  HB2     4.00       #both,both  c13_0928_3
         HB3    63 ASP  HB3     4.00       #both,both  c13_0928_3
         HB2    64 ALA  QB      6.00       #both,m;Me  c13_0928_3
         HB3    64 ALA  QB      6.00       #both,m;Me  c13_0928_3
         QB     65 VAL  HB      6.00       #m;one,  c13_0928_3
         QB     65 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
 62 GLU   
         HN     62 GLU  HA      4.00       #,  n15_0925_2_Filter
         HN     62 GLU  HB2     4.00       #,both  n15_0925_2_Filter
         HN     62 GLU  HB3     4.00       #,both  n15_0925_2_Filter
         HN     62 GLU  QG      6.00       #,m;dg  c13_0928_3
         HN     63 ASP  HN      4.00       #,  n15_0925_2_Filter
         HN    103 LEU  QQD     7.40       #,q;dMe  n15_0925_2_Filter
         HA     62 GLU  HB2     4.00       #,both  c13_0928_3
         HA     62 GLU  HB3     4.00       #,both  c13_0928_3
         HA     62 GLU  QG      6.00       #,m;dg  c13_0928_3
         HA     63 ASP  HN      4.00       #,  c13_0928_3
         HA     64 ALA  HN      5.00       #,  c13_0928_3
         HA     65 VAL  HN      5.00       #,  c13_0928_3
         HA     65 VAL  HB      4.00       #,  c13_0928_3
         HA     65 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HA     65 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HA     66 LYS  HN      4.00       #,  n15_0925_2_Filter
         HA     66 LYS  QB      6.00       #,m;db  c13_0928_3
         QB     62 GLU  QG      6.60       #i;one,m;dg  c13_0928_3
         HB2    63 ASP  HN      4.00       #both,  c13_0928_3
         HB3    63 ASP  HN      4.00       #both,  c13_0928_3
         QB     63 ASP  QB      6.20       #i;one,i;one  c13_0928_3
         QB    103 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QG     63 ASP  HN      6.00       #m;dg,  c13_0928_3
         QG     63 ASP  HA      6.00       #m;dg,  c13_0928_3
         QG     65 VAL  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     65 VAL  QQG     8.40       #m;dg,q;dMe  c13_0928_3
         QG     66 LYS  QB      7.00       #m;dg,m;db  c13_0928_3
         QG    103 LEU  QQD     8.40       #m;dg,q;dMe  c13_0928_3
 63 ASP   
         HN     63 ASP  HA      4.00       #,  n15_0925_2_Filter
         HN     63 ASP  HB2     4.00       #,both  n15_0925_2_Filter
         HN     63 ASP  HB3     4.00       #,both  n15_0925_2_Filter
         HN     64 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     64 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HN     65 VAL  HN      4.00       #,  n15_0925_2_Filter
         HA     63 ASP  HB2     4.00       #,both  c13_0928_3
         HA     63 ASP  HB3     4.00       #,both  c13_0928_3
         HA     64 ALA  HN      5.00       #,  c13_0928_3
         HA     65 VAL  HN      5.00       #,  c13_0928_3
         HA     66 LYS  HN      5.00       #,  c13_0928_3
         HA     66 LYS  QB      5.00       #,m;db  c13_0928_3
         HA     67 ALA  HN      5.00       #,  c13_0928_3
         HA     67 ALA  QB      6.00       #,m;Me  c13_0928_3
         HB2    64 ALA  HN      5.00       #both,  c13_0928_3
         HB3    64 ALA  HN      5.00       #both,  c13_0928_3
         HB2    64 ALA  QB      6.00       #both,m;Me  c13_0928_3
         HB3    64 ALA  QB      6.00       #both,m;Me  c13_0928_3
         QB     65 VAL  HN      6.00       #m;one,  c13_0928_3
         QB     65 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QB     67 ALA  QB      7.00       #m;one,m;Me  c13_0928_3
 64 ALA   
         HN     64 ALA  HA      5.00       #,  c13_0928_3
         HN     64 ALA  QB      5.60       #,i;Me  n15_0925_2_Filter
         HN     65 VAL  HA      5.00       #,  c13_0928_3
         HN     65 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HN     67 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HA     64 ALA  QB      5.20       #, ;Me  c13_0928_3
         HA     65 VAL  HN      5.00       #,  c13_0928_3
         HA     67 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     68 GLY  HN      5.00       #,  n15_0925_2_Filter
         QB     65 VAL  HN      5.00       #m;Me,  n15_0925_2_Filter
         QB     65 VAL  HA      6.00       #m;Me,  c13_0928_3
         QB     65 VAL  HB      6.00       #m;Me,  c13_0928_3
         QB     68 GLY  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     68 GLY  HA2     6.00       #m;Me,both  c13_0928_3
         QB     68 GLY  HA1     6.00       #m;Me,both  c13_0928_3
 65 VAL   
         HN     65 VAL  HA      5.00       #,  c13_0928_3
         HN     65 VAL  HB      4.00       #,  n15_0925_2_Filter
         HN     65 VAL  QQG     6.70       #,s;dMe  n15_0925_2_Filter
         HN     65 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HN     66 LYS  QB      5.60       #,i;db  n15_0925_2_Filter
         HA     65 VAL  HB      5.00       #,  c13_0928_3
         HA     65 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HA     65 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HB     65 VAL  QG1     6.00       #,m;bothMe  c13_0928_3
         HB     65 VAL  QG2     6.00       #,m;bothMe  c13_0928_3
         HB     66 LYS  HN      4.00       #,  n15_0925_2_Filter
         QQG    65 VAL  QQG     5.00       #,  c13_0928_3
         QQG    66 LYS  QB      8.00       #q;dMe,i;db  c13_0928_3
         QQG    66 LYS  QG      8.40       #q;dMe,m;one  c13_0928_3
         QQG    69 ILE  QG1     8.40       #q;dMe,m;dg  c13_0928_3
         QQG    69 ILE  QG2     8.40       #q;dMe,m;Me  c13_0928_3
         QQG   101 ASN  QD2     8.40       #q;dMe,m;one  c13_0928_3
         QQG    66 LYS  HN      7.40       #q;dMe,  c13_0928_3
         QQG    66 LYS  HA      7.40       #q;dMe,  c13_0928_3
         QQG    69 ILE  QG1     8.40       #q;dMe,m;dg  c13_0928_3
         QQG   103 LEU  QB      8.40       #q;dMe,m;one  c13_0928_3
         QQG   104 VAL  QQG     9.80       #q;dMe,q;dMe  c13_0928_3
 66 LYS   
         HN     66 LYS  HA      4.00       #,  c13_0928_3
         HN     66 LYS  QB      5.60       #,i;db  c13_0928_3
         HN     66 LYS  HG2     5.00       #,both  n15_0925_2_Filter
         HN     66 LYS  HG3     5.00       #,both  n15_0925_2_Filter
         HN     68 GLY  HN      4.00       #,  n15_0925_2_Filter
         HA     66 LYS  QB      4.60       #,i;db  c13_0928_3
         HA     66 LYS  QG      6.00       #,m;one  c13_0928_3
         HA     67 ALA  HN      4.00       #,  c13_0928_3
         HA     69 ILE  HN      5.00       #,  n15_0925_2_Filter
         HA     69 ILE  HB      5.00       #,  c13_0928_3
         HA     69 ILE  QG1     6.00       #,m;dg  c13_0928_3
         HA     69 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     69 ILE  QD1     6.00       #,m;Me  c13_0928_3
         QB     67 ALA  HN      5.60       #i;db,  c13_0928_3
         QB     67 ALA  QB      6.60       #i;db,m;Me  c13_0928_3
         HG2    67 ALA  HN      5.00       #both,  n15_0925_2_Filter
         HG3    67 ALA  HN      5.00       #both,  n15_0925_2_Filter
         QG     67 ALA  HA      6.00       #m;one,  c13_0928_3
         QG     69 ILE  QG2     7.00       #m;one,m;Me  c13_0928_3
         QG    103 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
 67 ALA   
         HN     67 ALA  QB      5.60       #,i;Me  n15_0925_2_Filter
         HN     68 GLY  HN      4.00       #,  n15_0925_2_Filter
         HN     68 GLY  QA      5.60       #,i;one  n15_0925_2_Filter
         HN     69 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HA     67 ALA  QB      5.20       #, ;Me  c13_0928_3
         HA     68 GLY  HN      5.00       #,  n15_0925_2_Filter
         HA     70 LYS  HN      5.00       #,  c13_0928_3
         QB     68 GLY  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     68 GLY  HA2     6.00       #m;Me,both  c13_0928_3
         QB     68 GLY  HA1     6.00       #m;Me,both  c13_0928_3
 68 GLY   
         HN     68 GLY  HA2     4.00       #,both  n15_0925_2_Filter
         HN     68 GLY  HA1     4.00       #,both  n15_0925_2_Filter
         HN     69 ILE  HN      4.00       #,  n15_0925_2_Filter
         HN     71 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HA2    69 ILE  HN      4.00       #both,  n15_0925_2_Filter
         HA1    69 ILE  HN      4.00       #both,  n15_0925_2_Filter
         HA2    71 ALA  HN      5.00       #both,  n15_0925_2_Filter
         HA1    71 ALA  HN      5.00       #both,  n15_0925_2_Filter
         QA     71 ALA  HA      6.00       #m;one,  c13_0928_3
         HA2    71 ALA  QB      6.00       #both,m;Me  c13_0928_3
         HA1    71 ALA  QB      6.00       #both,m;Me  c13_0928_3
         QA     72 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
         QA     72 LEU  QB      7.00       #m;one,m;db  c13_0928_3
 69 ILE   
         HN     69 ILE  HA      5.00       #,  n15_0925_2_Filter
         HN     69 ILE  HB      4.00       #,  c13_0928_3
         HN     69 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     69 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     70 LYS  HN      4.00       #,  n15_0925_2_Filter
         HN     72 LEU  QQD     7.40       #,q;dMe  n15_0925_2_Filter
         HA     69 ILE  HB      5.00       #,  c13_0928_3
         HA     69 ILE  QG2     5.60       #,i;Me  c13_0928_3
         HA     69 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     71 ALA  HN      4.00       #,  n15_0925_2_Filter
         HA     72 LEU  QB      6.00       #,m;db  c13_0928_3
         HA     72 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     69 ILE  QG1     6.00       #,m;dg  c13_0928_3
         HB     69 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     70 LYS  HN      4.00       #,  n15_0925_2_Filter
         QG1    69 ILE  QG2     7.00       #m;dg,m;Me  c13_0928_3
         QG1    70 LYS  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG1    72 LEU  QD1     7.00       #m;dg,m;bothMe  c13_0928_3
         QG1    72 LEU  QD2     7.00       #m;dg,m;bothMe  c13_0928_3
         QG2    70 LYS  HN      6.00       #m;Me,  c13_0928_3
         QG2    71 ALA  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    73 GLN  QG      7.00       #m;Me,m;dg  c13_0928_3
         QG2    99 TYR  CZ      8.20       #m;Me,r;de  c13_0928_3
         QD1    99 TYR  HN      6.00       #m;Me,  c13_0928_3
         QD1    99 TYR  HA      6.00       #m;Me,  c13_0928_3
         QD1    99 TYR  QB      7.00       #m;Me,m;db  c13_0928_3
         QD1    99 TYR  CG      8.20       #m;Me,r;dd  c13_0928_3
         QD1   101 ASN  QB      7.00       #m;Me,m;one  c13_0928_3
 70 LYS   
         HN     71 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     71 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HN     72 LEU  HN      4.00       #,  n15_0925_2_Filter
         HN     73 GLN  HN      5.00       #,  n15_0925_2_Filter
 71 ALA   
         HN     71 ALA  HA      4.00       #,  c13_0928_3
         HN     71 ALA  QB      4.60       #,i;Me  n15_0925_2_Filter
         HN     72 LEU  HN      4.00       #,  n15_0925_2_Filter
         HN     72 LEU  HA      5.00       #,  n15_0925_2_Filter
         HN     73 GLN  HN      5.00       #,  n15_0925_2_Filter
         HN     74 GLU  QG      6.00       #,m;one  n15_0925_2_Filter
         HA     71 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA     72 LEU  HN      5.00       #,  c13_0928_3
         HA     72 LEU  HA      5.00       #,  c13_0928_3
         HA     73 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     74 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA     74 GLU  QB      6.00       #,m;db  c13_0928_3
         HA     74 GLU  HG2     5.00       #,both  c13_0928_3
         HA     74 GLU  HG3     5.00       #,both  c13_0928_3
         HA     75 ALA  QB      6.00       #,m;Me  c13_0928_3
         QB     72 LEU  HN      5.00       #m;Me,  n15_0925_2_Filter
         QB     72 LEU  HA      6.00       #m;Me,  c13_0928_3
         QB     73 GLN  HN      6.00       #m;Me,  n15_0925_2_Filter
 72 LEU   
         HN     72 LEU  HA      5.00       #,  n15_0925_2_Filter
         HN     72 LEU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     72 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HN     72 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN     73 GLN  HN      4.00       #,  n15_0925_2_Filter
         HA     72 LEU  QB      5.60       #,i;db  c13_0928_3
         HA     72 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HA     72 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HA     75 ALA  HN      4.00       #,  c13_0928_3
         HA     75 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     79 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     97 PHE  CZ      7.20       #,r;de  c13_0928_3
         QB     72 LEU  QD1     6.60       #i;db,m;bothMe  c13_0928_3
         QB     72 LEU  QD2     6.60       #i;db,m;bothMe  c13_0928_3
         QB     73 GLN  HN      4.60       #i;db,  n15_0925_2_Filter
         QQD    72 LEU  QQD     5.00       #,  c13_0928_3
         QQD    75 ALA  QB      8.40       #q;dMe,m;Me  c13_0928_3
         QQD    79 ILE  HB      7.40       #q;dMe,  c13_0928_3
         QQD    79 ILE  QG2     8.40       #q;dMe,m;Me  c13_0928_3
         QQD    79 ILE  QD1     8.40       #q;dMe,m;Me  c13_0928_3
         QQD    97 PHE  CG      9.60       #q;dMe,r;dd  c13_0928_3
         QQD    97 PHE  CZ      9.60       #q;dMe,r;de  c13_0928_3
         QQD    99 TYR  CG      9.60       #q;dMe,r;dd  c13_0928_3
         QQD    79 ILE  HB      7.40       #q;dMe,  c13_0928_3
         QQD    97 PHE  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQD    99 TYR  HA      7.40       #q;dMe,  c13_0928_3
         QQD    99 TYR  CG      9.60       #q;dMe,r;dd  c13_0928_3
         QQD    99 TYR  CZ      9.60       #q;dMe,r;de  c13_0928_3
 73 GLN   
         HN     73 GLN  HA      4.00       #,  n15_0925_2_Filter
         HN     73 GLN  HB2     5.00       #,both  c13_0928_3
         HN     73 GLN  HB3     5.00       #,both  c13_0928_3
         HN     73 GLN  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     74 GLU  HN      4.00       #,  n15_0925_2_Filter
         HN     74 GLU  HA      5.00       #,  c13_0928_3
         HN     75 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HN     76 SER  HN      5.00       #,  n15_0925_2_Filter
         HA     73 GLN  HB2     4.00       #,both  c13_0928_3
         HA     73 GLN  HB3     4.00       #,both  c13_0928_3
         HA     73 GLN  QG      6.00       #,m;dg  c13_0928_3
         HA     73 GLN  QE2     6.00       #,m;one  c13_0928_3
         HA     75 ALA  HN      5.00       #,  n15_0925_2_Filter
         HA     76 SER  HN      5.00       #,  n15_0925_2_Filter
         HA     76 SER  HB2     5.00       #,both  c13_0928_3
         HA     76 SER  HB3     5.00       #,both  c13_0928_3
         HA     97 PHE  CG      7.20       #,r;dd  c13_0928_3
         HA     99 TYR  CG      7.20       #,r;dd  c13_0928_3
         HB2    73 GLN  QG      6.00       #both,m;dg  c13_0928_3
         HB3    73 GLN  QG      6.00       #both,m;dg  c13_0928_3
         QB     74 GLU  HN      3.60       #i;one,  n15_0925_2_Filter
         QB     75 ALA  HN      5.00       #m;one,  n15_0925_2_Filter
         QB     99 TYR  CZ      8.20       #m;one,r;de  c13_0928_3
 74 GLU   
         HN     74 GLU  HA      4.00       #,  n15_0925_2_Filter
         HN     74 GLU  QB      5.60       #,i;db  c13_0928_3
         HN     74 GLU  HG2     5.00       #,both  n15_0925_2_Filter
         HN     74 GLU  HG3     5.00       #,both  n15_0925_2_Filter
         HN     75 ALA  HN      3.00       #,  n15_0925_2_Filter
         HN     76 SER  HN      4.00       #,  n15_0925_2_Filter
         HA     74 GLU  QB      4.60       #,i;db  c13_0928_3
         HA     74 GLU  HG2     5.00       #,both  c13_0928_3
         HA     74 GLU  HG3     5.00       #,both  c13_0928_3
         HA     75 ALA  HN      4.00       #,  n15_0925_2_Filter
         HA     76 SER  HN      4.00       #,  n15_0925_2_Filter
         QB     74 GLU  QG      6.60       #i;db,m;one  c13_0928_3
         QB     75 ALA  HN      5.60       #i;db,  c13_0928_3
         QB     76 SER  HN      6.00       #m;db,  n15_0925_2_Filter
         HG2    75 ALA  QB      6.00       #both,m;Me  c13_0928_3
         HG3    75 ALA  QB      6.00       #both,m;Me  c13_0928_3
 75 ALA   
         HN     75 ALA  HA      4.00       #,  n15_0925_2_Filter
         HN     75 ALA  QB      4.60       #,i;Me  n15_0925_2_Filter
         HN     76 SER  HN      3.00       #,  n15_0925_2_Filter
         HN     76 SER  HA      5.00       #,  n15_0925_2_Filter
         HA     75 ALA  QB      4.20       #, ;Me  c13_0928_3
         HA     78 PHE  HN      4.00       #,  n15_0925_2_Filter
         QB     76 SER  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     78 PHE  HB2     6.00       #m;Me,both  c13_0928_3
         QB     78 PHE  HB3     6.00       #m;Me,both  c13_0928_3
         QB     79 ILE  HN      5.00       #m;Me,  c13_0928_3
         QB     79 ILE  QG2     7.00       #m;Me,m;Me  c13_0928_3
         QB     79 ILE  QD1     7.00       #m;Me,m;Me  c13_0928_3
         QB     97 PHE  CZ      8.20       #m;Me,r;de  c13_0928_3
 76 SER   
         HN     76 SER  HA      5.00       #,  n15_0925_2_Filter
         HN     76 SER  HB2     4.00       #,both  n15_0925_2_Filter
         HN     76 SER  HB3     4.00       #,both  n15_0925_2_Filter
         HN     77 GLY  HN      5.00       #,  n15_0925_2_Filter
         HN     77 GLY  QA      5.60       #,i;one  n15_0925_2_Filter
         HN     78 PHE  HN      4.00       #,  n15_0925_2_Filter
         HN     79 ILE  HN      5.00       #,  n15_0925_2_Filter
         HA     76 SER  HB2     4.00       #,both  c13_0928_3
         HA     76 SER  HB3     4.00       #,both  c13_0928_3
         HA     77 GLY  HN      5.00       #,  c13_0928_3
         HA     79 ILE  HN      5.00       #,  c13_0928_3
         HA     79 ILE  HB      5.00       #,  c13_0928_3
         HA     79 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     79 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     80 ARG  HN      5.00       #,  n15_0925_2_Filter
         HA     80 ARG  QB      6.00       #,m;db  c13_0928_3
         QB     77 GLY  HN      4.60       #i;one,  n15_0925_2_Filter
         QB     78 PHE  HN      5.00       #m;one,  n15_0925_2_Filter
 77 GLY   
         HN     77 GLY  HA2     5.00       #,both  c13_0928_3
         HN     77 GLY  HA1     5.00       #,both  c13_0928_3
         HN     78 PHE  HN      4.00       #,  n15_0925_2_Filter
         HN     78 PHE  QB      5.60       #,i;one  c13_0928_3
         HN     80 ARG  QB      6.00       #,m;db  c13_0928_3
         HA2    78 PHE  HN      5.00       #both,  c13_0928_3
         HA1    78 PHE  HN      5.00       #both,  c13_0928_3
         HA2    79 ILE  HN      5.00       #both,  c13_0928_3
         HA1    79 ILE  HN      5.00       #both,  c13_0928_3
         HA2    80 ARG  HN      5.00       #both,  n15_0925_2_Filter
         HA1    80 ARG  HN      5.00       #both,  n15_0925_2_Filter
         HA2    80 ARG  QB      6.00       #both,m;db  c13_0928_3
         HA1    80 ARG  QB      6.00       #both,m;db  c13_0928_3
         QA     80 ARG  QD      7.00       #m;one,m;one  c13_0928_3
         QA     81 SER  HN      5.00       #m;one,  n15_0925_2_Filter
 78 PHE   
         HN     78 PHE  HA      4.00       #,  n15_0925_2_Filter
         HN     78 PHE  HB2     4.00       #,both  c13_0928_3
         HN     78 PHE  HB3     4.00       #,both  c13_0928_3
         HN     79 ILE  HN      4.00       #,  n15_0925_2_Filter
         HN     79 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     80 ARG  HN      4.00       #,  n15_0925_2_Filter
         HN     80 ARG  QB      6.00       #,m;db  n15_0925_2_Filter
         HN     81 SER  QB      6.00       #,m;db  n15_0925_2_Filter
         HA     78 PHE  HB2     4.00       #,both  c13_0928_3
         HA     78 PHE  HB3     4.00       #,both  c13_0928_3
         HA     81 SER  HN      4.00       #,  n15_0925_2_Filter
         HA     81 SER  QB      5.00       #,m;db  c13_0928_3
         HB2    79 ILE  HN      5.00       #both,  n15_0925_2_Filter
         HB3    79 ILE  HN      5.00       #both,  n15_0925_2_Filter
         QB     79 ILE  HA      4.60       #i;one,  c13_0928_3
         QB     79 ILE  QG2     6.60       #i;one,m;Me  c13_0928_3
         QB     79 ILE  QD1     6.60       #i;one,m;Me  c13_0928_3
         HB2    80 ARG  HN      5.00       #both,  c13_0928_3
         HB3    80 ARG  HN      5.00       #both,  c13_0928_3
         QB     82 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
 79 ILE   
         HN     79 ILE  HA      5.00       #,  n15_0925_2_Filter
         HN     79 ILE  HB      5.00       #,  c13_0928_3
         HN     79 ILE  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HN     79 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     80 ARG  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     81 SER  HN      4.00       #,  n15_0925_2_Filter
         HN     82 LEU  HB2     5.00       #,both  c13_0928_3
         HN     82 LEU  HB3     5.00       #,both  c13_0928_3
         HA     79 ILE  HB      4.00       #,  c13_0928_3
         HA     79 ILE  QG2     5.60       #,i;Me  c13_0928_3
         HA     79 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     80 ARG  HN      5.00       #,  n15_0925_2_Filter
         HA     82 LEU  HN      5.00       #,  n15_0925_2_Filter
         HA     82 LEU  HB2     5.00       #,both  c13_0928_3
         HA     82 LEU  HB3     5.00       #,both  c13_0928_3
         HA     82 LEU  HG      5.00       #,  c13_0928_3
         HA     82 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HA     83 LEU  HN      5.00       #,  c13_0928_3
         HA     83 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     79 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     80 ARG  HN      5.00       #,  c13_0928_3
         HB     82 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HB     83 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HB     83 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         QG2    80 ARG  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    82 LEU  QB      7.00       #m;Me,m;one  c13_0928_3
         QG2    82 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QG2    97 PHE  QB      7.00       #m;Me,m;db  c13_0928_3
         QD1    80 ARG  HN      6.00       #m;Me,  n15_0925_2_Filter
         QD1    80 ARG  HA      6.00       #m;Me,  c13_0928_3
         QD1    95 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QD1    97 PHE  CG      8.20       #m;Me,r;dd  c13_0928_3
         QD1    99 TYR  CG      8.20       #m;Me,r;dd  c13_0928_3
         QD1    99 TYR  CZ      8.20       #m;Me,r;de  c13_0928_3
 80 ARG   
         HN     80 ARG  HA      4.00       #,  c13_0928_3
         HN     80 ARG  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     80 ARG  QD      6.00       #,m;one  n15_0925_2_Filter
         HN     81 SER  HN      4.00       #,  n15_0925_2_Filter
         HN     81 SER  QB      5.60       #,i;db  n15_0925_2_Filter
         HA     80 ARG  QB      4.60       #,i;db  c13_0928_3
         HA     80 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     80 ARG  QD      6.00       #,m;one  c13_0928_3
         HA     81 SER  HN      4.00       #,  n15_0925_2_Filter
         HA     83 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     83 LEU  QB      6.00       #,m;db  c13_0928_3
         HA     83 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         HA     95 LEU  QB      6.00       #,m;db  c13_0928_3
         HA     95 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QB     80 ARG  HD2     5.60       #i;db,both  c13_0928_3
         QB     80 ARG  HD3     5.60       #i;db,both  c13_0928_3
         QB     81 SER  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     81 SER  QB      6.20       #i;db,i;db  c13_0928_3
         QB     94 GLU  QG      7.00       #m;db,m;one  c13_0928_3
         QB     97 PHE  CZ      8.20       #m;db,r;de  c13_0928_3
         QG     80 ARG  HD2     6.00       #m;dg,both  c13_0928_3
         QG     80 ARG  HD3     6.00       #m;dg,both  c13_0928_3
         QD     92 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QD     94 GLU  HA      6.00       #m;one,  c13_0928_3
         HD2    95 LEU  HN      5.00       #both,  c13_0928_3
         HD3    95 LEU  HN      5.00       #both,  c13_0928_3
         QD     95 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
 81 SER   
         HN     81 SER  HA      4.00       #,  c13_0928_3
         HN     81 SER  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     82 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     81 SER  QB      3.60       #,i;db  c13_0928_3
         HA     82 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     84 GLY  HN      4.00       #,  n15_0925_2_Filter
         HA     85 LYS  HN      5.00       #,  n15_0925_2_Filter
         HA     85 LYS  QG      6.00       #,m;dg  c13_0928_3
         QB     82 LEU  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     82 LEU  QB      6.20       #i;db,i;one  c13_0928_3
         QB     82 LEU  QQD     8.00       #i;db,q;dMe  c13_0928_3
         QB     85 LYS  QB      7.00       #m;db,m;db  c13_0928_3
         QB     85 LYS  QE      7.00       #m;db,m;de  c13_0928_3
 82 LEU   
         HN     82 LEU  HA      5.00       #,  c13_0928_3
         HN     82 LEU  HB2     4.00       #,both  n15_0925_2_Filter
         HN     82 LEU  HB3     4.00       #,both  n15_0925_2_Filter
         HN     82 LEU  HG      5.00       #,  n15_0925_2_Filter
         HN     82 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN     82 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HN     83 LEU  HN      4.00       #,  n15_0925_2_Filter
         HN     83 LEU  QB      5.60       #,i;db  c13_0928_3
         HA     82 LEU  QB      4.60       #,i;one  c13_0928_3
         HA     82 LEU  HG      5.00       #,  c13_0928_3
         HA     82 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HA     82 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HA     83 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     85 LYS  HN      4.00       #,  n15_0925_2_Filter
         HA     85 LYS  QB      6.00       #,m;db  c13_0928_3
         HA     85 LYS  QG      6.00       #,m;dg  c13_0928_3
         HA     86 ALA  HN      4.00       #,  n15_0925_2_Filter
         HA     86 ALA  QB      6.00       #,m;Me  c13_0928_3
         QB     82 LEU  HG      5.60       #i;one,  c13_0928_3
         HB2    82 LEU  QQD     5.00       #both,  c13_0928_3
         HB3    82 LEU  QQD     5.00       #both,  c13_0928_3
         HB2    82 LEU  QQD     5.00       #both,  c13_0928_3
         HB3    82 LEU  QQD     5.00       #both,  c13_0928_3
         HB2    83 LEU  HN      5.00       #both,  c13_0928_3
         HB3    83 LEU  HN      5.00       #both,  c13_0928_3
         HB2    83 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         HB3    83 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         QB     85 LYS  QB      7.00       #m;one,m;db  c13_0928_3
         HG     82 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HG     82 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HG     83 LEU  HN      5.00       #,  n15_0925_2_Filter
         QQD    82 LEU  QQD     5.00       #,  c13_0928_3
         QQD    83 LEU  QB      8.00       #q;dMe,i;db  c13_0928_3
         QQD    85 LYS  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQD    85 LYS  QE      8.40       #q;dMe,m;de  c13_0928_3
         QQD    86 ALA  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQD    86 ALA  QB      8.40       #q;dMe,m;Me  c13_0928_3
         QQD    83 LEU  QD1     8.40       #q;dMe,m;bothMe  c13_0928_3
         QQD    83 LEU  QD2     8.40       #q;dMe,m;bothMe  c13_0928_3
 83 LEU   
         HN     83 LEU  HA      5.00       #,  n15_0925_2_Filter
         HN     83 LEU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     83 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HN     83 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HN     84 GLY  HN      4.00       #,  n15_0925_2_Filter
         HN     86 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HA     83 LEU  QB      4.60       #,i;db  c13_0928_3
         HA     83 LEU  QD1     6.00       #,m;bothMe  c13_0928_3
         HA     83 LEU  QD2     6.00       #,m;bothMe  c13_0928_3
         HA     86 ALA  HN      4.00       #,  c13_0928_3
         HA     86 ALA  QB      6.00       #,m;Me  c13_0928_3
         HA     87 MET  HN      4.00       #,  n15_0925_2_Filter
         QB     84 GLY  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     87 MET  HN      5.00       #m;db,  n15_0925_2_Filter
         QB     87 MET  QB      6.00       #m;db,m;one  c13_0928_3
         QB     87 MET  QG      7.00       #m;db,m;dg  c13_0928_3
         QB     87 MET  QE      7.00       #m;db,m;Me  c13_0928_3
         QB     95 LEU  QQD     8.40       #m;db,q;dMe  c13_0928_3
         QQD    84 GLY  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQD    87 MET  QB      8.40       #q;dMe,m;one  c13_0928_3
         QQD    95 LEU  QB      8.40       #q;dMe,m;db  c13_0928_3
         QQD    84 GLY  QA      8.00       #q;dMe,i;one  c13_0928_3
         QQD    86 ALA  QB      8.40       #q;dMe,m;Me  c13_0928_3
         QQD    87 MET  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQD    87 MET  QB      8.40       #q;dMe,m;one  c13_0928_3
         QQD    87 MET  QG      8.40       #q;dMe,m;dg  c13_0928_3
         QQD    95 LEU  QQD     9.80       #q;dMe,q;dMe  c13_0928_3
 84 GLY   
         HN     84 GLY  HA2     4.00       #,both  n15_0925_2_Filter
         HN     84 GLY  HA1     4.00       #,both  n15_0925_2_Filter
         HN     85 LYS  HN      4.00       #,  n15_0925_2_Filter
         HN     86 ALA  HN      4.00       #,  n15_0925_2_Filter
         HN     92 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA2    85 LYS  HN      4.00       #both,  c13_0928_3
         HA1    85 LYS  HN      4.00       #both,  c13_0928_3
         QA     86 ALA  HN      5.00       #m;one,  n15_0925_2_Filter
         QA     88 ARG  HN      5.00       #m;one,  n15_0925_2_Filter
         HA2    89 LEU  HN      4.00       #both,  n15_0925_2_Filter
         HA1    89 LEU  HN      4.00       #both,  n15_0925_2_Filter
         QA     89 LEU  HB2     5.00       #m;one,both  c13_0928_3
         QA     89 LEU  HB3     5.00       #m;one,both  c13_0928_3
         QA     89 LEU  QB      6.00       #m;one,m;one  c13_0928_3
         HA2    89 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         HA1    89 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         QA     91 ILE  QG1     7.00       #m;one,m;one  c13_0928_3
         HA2    92 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         HA1    92 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
 85 LYS   
         HN     85 LYS  HA      5.00       #,  n15_0925_2_Filter
         HN     85 LYS  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     85 LYS  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     85 LYS  QE      6.00       #,m;de  c13_0928_3
         HN     86 ALA  HN      3.00       #,  n15_0925_2_Filter
         HN     86 ALA  QB      6.00       #,m;Me  n15_0925_2_Filter
         HN     87 MET  HN      4.00       #,  n15_0925_2_Filter
         HN     88 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HA     85 LYS  QB      4.60       #,i;db  c13_0928_3
         HA     85 LYS  QG      6.00       #,m;dg  c13_0928_3
         HA     86 ALA  HN      5.00       #,  c13_0928_3
         HA     87 MET  HN      5.00       #,  n15_0925_2_Filter
         HA     88 ARG  HN      5.00       #,  n15_0925_2_Filter
         HA     88 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     89 LEU  HN      4.00       #,  n15_0925_2_Filter
         QB     85 LYS  QG      6.60       #i;db,m;dg  c13_0928_3
         QB     85 LYS  QE      6.60       #i;db,m;de  c13_0928_3
         QB     86 ALA  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     86 ALA  HA      4.60       #i;db,  c13_0928_3
         QB     86 ALA  QB      6.60       #i;db,m;Me  c13_0928_3
         QB     87 MET  HN      5.00       #m;db,  n15_0925_2_Filter
         QG     85 LYS  QE      7.00       #m;dg,m;de  c13_0928_3
         QG     88 ARG  HN      6.00       #m;dg,  n15_0925_2_Filter
         QG     88 ARG  QB      7.00       #m;dg,m;db  c13_0928_3
 86 ALA   
         HN     86 ALA  HA      4.00       #,  n15_0925_2_Filter
         HN     86 ALA  QB      5.60       #,i;Me  n15_0925_2_Filter
         HN     87 MET  HN      4.00       #,  n15_0925_2_Filter
         HN     88 ARG  HN      4.00       #,  n15_0925_2_Filter
         HA     86 ALA  QB      5.20       #, ;Me  c13_0928_3
         HA     87 MET  HN      5.00       #,  n15_0925_2_Filter
         HA     88 ARG  HN      5.00       #,  n15_0925_2_Filter
         QB     87 MET  HN      6.00       #m;Me,  n15_0925_2_Filter
         QB     87 MET  HA      6.00       #m;Me,  c13_0928_3
         QB     87 MET  HB2     6.00       #m;Me,both  c13_0928_3
         QB     87 MET  HB3     6.00       #m;Me,both  c13_0928_3
         QB     87 MET  QG      7.00       #m;Me,m;dg  c13_0928_3
         QB     88 ARG  HN      6.00       #m;Me,  n15_0925_2_Filter
 87 MET   
         HN     87 MET  HA      4.00       #,  n15_0925_2_Filter
         HN     87 MET  HB2     5.00       #,both  n15_0925_2_Filter
         HN     87 MET  HB3     5.00       #,both  n15_0925_2_Filter
         HN     87 MET  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     87 MET  QE      6.00       #,m;Me  n15_0925_2_Filter
         HN     88 ARG  HN      4.00       #,  n15_0925_2_Filter
         HN     88 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN     88 ARG  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     88 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     89 LEU  QB      6.00       #,m;one  n15_0925_2_Filter
         HA     87 MET  HB2     4.00       #,both  c13_0928_3
         HA     87 MET  HB3     4.00       #,both  c13_0928_3
         HA     87 MET  QG      6.00       #,m;dg  c13_0928_3
         HA     87 MET  QE      6.00       #,m;Me  c13_0928_3
         HA     88 ARG  HN      4.00       #,  n15_0925_2_Filter
         HA     89 LEU  QB      6.00       #,m;one  c13_0928_3
         QB     87 MET  QG      6.60       #i;one,m;dg  c13_0928_3
         HB2    88 ARG  HN      5.00       #both,  n15_0925_2_Filter
         HB3    88 ARG  HN      5.00       #both,  n15_0925_2_Filter
         QB     88 ARG  QB      6.20       #i;one,i;db  c13_0928_3
         QB     89 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
         HB2    89 LEU  QB      6.00       #both,m;one  c13_0928_3
         HB3    89 LEU  QB      6.00       #both,m;one  c13_0928_3
         HB2    89 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         HB3    89 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         QG     87 MET  QE      7.00       #m;dg,m;Me  c13_0928_3
         QG     89 LEU  QB      7.00       #m;dg,m;one  c13_0928_3
         QG     89 LEU  QQD     8.40       #m;dg,q;dMe  c13_0928_3
         QE     89 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
         QE     95 LEU  QQD     8.40       #m;Me,q;dMe  c13_0928_3
 88 ARG   
         HN     88 ARG  HA      3.00       #,  n15_0925_2_Filter
         HN     88 ARG  QB      5.60       #,i;db  n15_0925_2_Filter
         HN     88 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN     88 ARG  QD      6.00       #,m;dd  c13_0928_3
         HN     89 LEU  QB      5.60       #,i;one  n15_0925_2_Filter
         HA     88 ARG  QB      5.60       #,i;db  c13_0928_3
         HA     88 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA     88 ARG  QD      6.00       #,m;dd  c13_0928_3
         HA     89 LEU  HN      3.00       #,  n15_0925_2_Filter
         HA     89 LEU  HA      5.00       #,  c13_0928_3
         HA     89 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QB     89 LEU  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     89 LEU  HA      5.60       #i;db,  c13_0928_3
         QB     89 LEU  QQD     8.00       #i;db,q;dMe  c13_0928_3
 89 LEU   
         HN     89 LEU  HA      4.00       #,  n15_0925_2_Filter
         HN     89 LEU  HB2     4.00       #,both  c13_0928_3
         HN     89 LEU  HB3     4.00       #,both  c13_0928_3
         HN     89 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN     90 ARG  HN      4.00       #,  n15_0925_2_Filter
         HN     91 ILE  QG1     6.00       #,m;one  n15_0925_2_Filter
         HN     92 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HA     89 LEU  HB2     4.00       #,both  c13_0928_3
         HA     89 LEU  HB3     4.00       #,both  c13_0928_3
         HA     89 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA     90 ARG  HN      3.00       #,  n15_0925_2_Filter
         HA     90 ARG  HA      5.00       #,  c13_0928_3
         HA     90 ARG  QB      5.60       #,i;db  c13_0928_3
         HB2    89 LEU  QQD     5.00       #both,  c13_0928_3
         HB3    89 LEU  QQD     5.00       #both,  c13_0928_3
         HB2    90 ARG  HN      4.00       #both,  c13_0928_3
         HB3    90 ARG  HN      4.00       #both,  c13_0928_3
         QB     91 ILE  HN      5.00       #m;one,  c13_0928_3
         QB     91 ILE  QG2     7.00       #m;one,m;Me  c13_0928_3
         HB2    92 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         HB3    92 VAL  QQG     7.40       #both,q;dMe  c13_0928_3
         QB     93 PRO  HD2     6.00       #m;one,both  c13_0928_3
         QB     93 PRO  HD3     6.00       #m;one,both  c13_0928_3
         QQD    90 ARG  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQD    90 ARG  HA      7.40       #q;dMe,  c13_0928_3
         QQD    90 ARG  QB      8.00       #q;dMe,i;db  c13_0928_3
         QQD    91 ILE  HN      7.40       #q;dMe,  c13_0928_3
         QQD    91 ILE  HA      7.40       #q;dMe,  c13_0928_3
         QQD    91 ILE  QG2     8.40       #q;dMe,m;Me  c13_0928_3
         QQD    92 VAL  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQD    92 VAL  HA      7.40       #q;dMe,  c13_0928_3
         QQD    93 PRO  QG      8.40       #q;dMe,m;one  c13_0928_3
         QQD    93 PRO  HD2     7.40       #q;dMe,both  c13_0928_3
         QQD    93 PRO  HD3     7.40       #q;dMe,both  c13_0928_3
 90 ARG   
         HN     90 ARG  HA      4.00       #,  n15_0925_2_Filter
         HN     90 ARG  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     90 ARG  QD      6.00       #,m;dd  n15_0925_2_Filter
         HN     91 ILE  HN      4.00       #,  n15_0925_2_Filter
         HN     91 ILE  QG1     6.00       #,m;one  n15_0925_2_Filter
         HN     91 ILE  QD1     6.00       #,m;Me  n15_0925_2_Filter
         HN     92 VAL  HN      4.00       #,  n15_0925_2_Filter
         HN     92 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HN     93 PRO  QD      6.00       #,m;one  n15_0925_2_Filter
         HA     90 ARG  QB      4.60       #,i;db  c13_0928_3
         HA     90 ARG  QD      6.00       #,m;dd  c13_0928_3
         HA     91 ILE  HN      4.00       #,  c13_0928_3
         HA     92 VAL  HN      4.00       #,  n15_0925_2_Filter
         QB     90 ARG  QD      6.60       #i;db,m;dd  c13_0928_3
         QB     91 ILE  HN      5.60       #i;db,  n15_0925_2_Filter
         QG     90 ARG  QD      7.00       #m;dg,m;dd  c13_0928_3
         QG     91 ILE  HG12    6.00       #m;dg,both  c13_0928_3
         QG     91 ILE  HG13    6.00       #m;dg,both  c13_0928_3
         QG     92 VAL  QQG     8.40       #m;dg,q;dMe  c13_0928_3
 91 ILE   
         HN     91 ILE  HA      5.00       #,  c13_0928_3
         HN     91 ILE  HB      4.00       #,  n15_0925_2_Filter
         HN     91 ILE  QG1     6.00       #,m;one  c13_0928_3
         HN     91 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HA     91 ILE  HB      5.00       #,  c13_0928_3
         HA     91 ILE  HG12    5.00       #,both  c13_0928_3
         HA     91 ILE  HG13    5.00       #,both  c13_0928_3
         HA     91 ILE  QG2     5.60       #,i;Me  c13_0928_3
         HA     91 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HA     92 VAL  HN      4.00       #,  c13_0928_3
         HA     92 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         HA     93 PRO  QD      6.00       #,m;one  c13_0928_3
         HB     91 ILE  HG12    5.00       #,both  c13_0928_3
         HB     91 ILE  HG13    5.00       #,both  c13_0928_3
         HB     91 ILE  QG2     6.00       #,m;Me  c13_0928_3
         HB     91 ILE  QD1     6.00       #,m;Me  c13_0928_3
         HB     92 VAL  HN      5.00       #,  c13_0928_3
         HB     93 PRO  HA      5.00       #,  c13_0928_3
         HB     93 PRO  QB      6.00       #,m;one  c13_0928_3
         HB     93 PRO  QD      6.00       #,m;one  c13_0928_3
         HG12   91 ILE  QG2     6.00       #both,m;Me  c13_0928_3
         HG13   91 ILE  QG2     6.00       #both,m;Me  c13_0928_3
         HG12   91 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         HG13   91 ILE  QD1     6.00       #both,m;Me  c13_0928_3
         QG1    92 VAL  HN      6.00       #m;one,  c13_0928_3
         QG1    92 VAL  HN      6.00       #m;one,  n15_0925_2_Filter
         QG1    92 VAL  HA      6.00       #m;one,  c13_0928_3
         QG1    92 VAL  HB      6.00       #m;one,  c13_0928_3
         QG1    92 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QG1    93 PRO  QB      7.00       #m;one,m;one  c13_0928_3
         HG12   93 PRO  HG3     5.00       #both,both  c13_0928_3
         HG13   93 PRO  HG2     5.00       #both,both  c13_0928_3
         QG1    93 PRO  QG      7.00       #m;one,m;one  c13_0928_3
         QG1    93 PRO  HD2     6.00       #m;one,both  c13_0928_3
         QG1    93 PRO  HD3     6.00       #m;one,both  c13_0928_3
         QG2    91 ILE  QD1     7.00       #m;Me,m;Me  c13_0928_3
         QG2    92 VAL  HN      6.00       #m;Me,  c13_0928_3
         QD1    92 VAL  HN      6.00       #m;Me,  n15_0925_2_Filter
         QD1    93 PRO  HG2     6.00       #m;Me,both  c13_0928_3
         QD1    93 PRO  HG3     6.00       #m;Me,both  c13_0928_3
         QD1    93 PRO  QD      7.00       #m;Me,m;one  c13_0928_3
         QD1    95 LEU  QB      7.00       #m;Me,m;db  c13_0928_3
 92 VAL   
         HN     92 VAL  HA      4.00       #,  n15_0925_2_Filter
         HN     92 VAL  HB      4.00       #,  n15_0925_2_Filter
         HN     92 VAL  QQG     6.70       #,s;dMe  n15_0925_2_Filter
         HN     93 PRO  QG      6.00       #,m;one  n15_0925_2_Filter
         HA     92 VAL  QQG     5.60       #,i;dMe  c13_0928_3
         HA     93 PRO  HD2     5.00       #,both  c13_0928_3
         HA     93 PRO  HD3     5.00       #,both  c13_0928_3
         HB     92 VAL  QQG     5.00       #,  c13_0928_3
         HB     93 PRO  QD      6.00       #,m;one  c13_0928_3
         QQG    93 PRO  QB      8.00       #q;dMe,i;one  c13_0928_3
         QQG    93 PRO  HD2     7.40       #q;dMe,both  c13_0928_3
         QQG    93 PRO  HD3     7.40       #q;dMe,both  c13_0928_3
 93 PRO   
         HA     93 PRO  HB2     4.00       #,both  c13_0928_3
         HA     93 PRO  HB3     4.00       #,both  c13_0928_3
         HA     93 PRO  QG      6.00       #,m;one  c13_0928_3
         HA     93 PRO  QD      6.00       #,m;one  c13_0928_3
         HA     94 GLU  HN      3.00       #,  n15_0925_2_Filter
         QB     93 PRO  QG      6.60       #i;one,m;one  c13_0928_3
         QB     93 PRO  HD2     5.60       #i;one,both  c13_0928_3
         QB     93 PRO  HD3     5.60       #i;one,both  c13_0928_3
         HB2    94 GLU  HN      4.00       #both,  n15_0925_2_Filter
         HB3    94 GLU  HN      4.00       #both,  n15_0925_2_Filter
         QB     95 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QG     93 PRO  HD2     6.00       #m;one,both  c13_0928_3
         QG     93 PRO  HD3     6.00       #m;one,both  c13_0928_3
         QG     93 PRO  HD2     6.00       #m;one,both  c13_0928_3
         QG     93 PRO  HD3     6.00       #m;one,both  c13_0928_3
         QG     94 GLU  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     95 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
         QG     95 LEU  HN      6.00       #m;one,  c13_0928_3
         QG     95 LEU  QQD     8.40       #m;one,q;dMe  c13_0928_3
         QD     95 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
         HD2    95 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
         HD3    95 LEU  QQD     7.40       #both,q;dMe  c13_0928_3
 94 GLU   
         HN     94 GLU  HA      4.00       #,  c13_0928_3
         HN     94 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     94 GLU  HG2     5.00       #,both  n15_0925_2_Filter
         HN     94 GLU  HG3     5.00       #,both  n15_0925_2_Filter
         HN     95 LEU  HA      5.00       #,  n15_0925_2_Filter
         HA     94 GLU  QB      4.60       #,i;db  c13_0928_3
         HA     94 GLU  HG2     5.00       #,both  c13_0928_3
         HA     94 GLU  HG3     5.00       #,both  c13_0928_3
         HA     95 LEU  HN      4.00       #,  n15_0925_2_Filter
         HA     95 LEU  HA      5.00       #,  c13_0928_3
         HA     95 LEU  QQD     7.40       #,q;dMe  c13_0928_3
         QB     94 GLU  QG      6.60       #i;db,m;one  c13_0928_3
         QB     95 LEU  HN      4.60       #i;db,  n15_0925_2_Filter
         QB     95 LEU  HA      5.60       #i;db,  c13_0928_3
         QB     96 THR  HN      5.00       #m;db,  n15_0925_2_Filter
         HG2    95 LEU  HN      5.00       #both,  n15_0925_2_Filter
         HG3    95 LEU  HN      5.00       #both,  n15_0925_2_Filter
 95 LEU   
         HN     95 LEU  HA      5.00       #,  n15_0925_2_Filter
         HN     95 LEU  QB      5.60       #,i;db  c13_0928_3
         HN     95 LEU  HG      5.00       #,  c13_0928_3
         HN     95 LEU  QQD     7.20       #,r;dMe  c13_0928_3
         HN     96 THR  HN      4.00       #,  n15_0925_2_Filter
         HA     95 LEU  QB      5.60       #,i;db  c13_0928_3
         HA     95 LEU  HG      5.00       #,  c13_0928_3
         HA     95 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA     96 THR  HN      3.00       #,  n15_0925_2_Filter
         QB     95 LEU  QQD     5.60       #i;db,  c13_0928_3
         QB     96 THR  HN      4.60       #i;db,  n15_0925_2_Filter
         HG     95 LEU  QQD     5.00       #,  c13_0928_3
         HG     96 THR  HN      5.00       #,  n15_0925_2_Filter
         QQD    96 THR  HN      7.40       #q;dMe,  n15_0925_2_Filter
 96 THR   
         HN     96 THR  HB      4.00       #,  n15_0925_2_Filter
         HN     96 THR  QG2     6.00       #,m;Me  n15_0925_2_Filter
         HA     96 THR  HB      4.00       #,  c13_0928_3
         HA     96 THR  QG2     5.60       #,i;Me  c13_0928_3
         HA     97 PHE  HN      4.00       #,  c13_0928_3
         HA     97 PHE  QB      5.60       #,i;db  c13_0928_3
         HB     96 THR  QG2     6.00       #,m;Me  c13_0928_3
         HB     97 PHE  HN      4.00       #,  n15_0925_2_Filter
         QG2    97 PHE  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    97 PHE  HA      6.00       #m;Me,  c13_0928_3
         QG2    98 PHE  HN      6.00       #m;Me,  n15_0925_2_Filter
         QG2    98 PHE  HA      6.00       #m;Me,  c13_0928_3
         QG2    98 PHE  QB      7.00       #m;Me,m;one  c13_0928_3
         QG2    98 PHE  CG      8.20       #m;Me,r;dd  c13_0928_3
         QG2    99 TYR  CZ      8.20       #m;Me,r;de  c13_0928_3
 97 PHE   
         HN     97 PHE  HA      4.00       #,  c13_0928_3
         HN     97 PHE  QB      4.60       #,i;db  n15_0925_2_Filter
         HN     98 PHE  HN      4.00       #,  n15_0925_2_Filter
         HN     99 TYR  CG      7.20       #,r;dd  n15_0925_2_Filter
         HA     97 PHE  QB      5.60       #,i;db  c13_0928_3
         HA     97 PHE  CG      6.00       #,m;dd  c13_0928_3
         HA     97 PHE  CZ      6.00       #,m;de  c13_0928_3
         HA     98 PHE  HN      3.00       #,  n15_0925_2_Filter
         HA     98 PHE  QB      4.60       #,i;one  c13_0928_3
         HA     99 TYR  CG      7.20       #,r;dd  c13_0928_3
         HA     99 TYR  CZ      7.20       #,r;de  c13_0928_3
         QB     97 PHE  CZ      6.60       #i;db,m;de  c13_0928_3
         QB     98 PHE  HN      5.60       #i;db,  n15_0925_2_Filter
         QB     99 TYR  HN      6.00       #m;db,  c13_0928_3
         QB     99 TYR  CG      8.20       #m;db,r;dd  c13_0928_3
         QB     99 TYR  CZ      8.20       #m;db,r;de  c13_0928_3
         CG     97 PHE  CZ      7.00       #m;dd,m;de  c13_0928_3
         CG     99 TYR  HA      7.20       #r;dd,  c13_0928_3
         CZ     99 TYR  HA      7.20       #r;de,  c13_0928_3
         CZ     99 TYR  QB      8.20       #r;de,m;db  c13_0928_3
 98 PHE   
         HN     98 PHE  HA      4.00       #,  n15_0925_2_Filter
         HN     98 PHE  HB2     4.00       #,both  n15_0925_2_Filter
         HN     98 PHE  HB3     4.00       #,both  n15_0925_2_Filter
         HN     98 PHE  CG      6.00       #,m;dd  c13_0928_3
         HN     99 TYR  CG      7.20       #,r;dd  n15_0925_2_Filter
         HA     98 PHE  HB2     4.00       #,both  c13_0928_3
         HA     98 PHE  HB3     4.00       #,both  c13_0928_3
         HA     99 TYR  HN      4.00       #,  n15_0925_2_Filter
         QB     99 TYR  HN      5.60       #i;one,  c13_0928_3
         QB     99 TYR  HA      5.60       #i;one,  c13_0928_3
         QB    100 ASP  HN      6.00       #m;one,  n15_0925_2_Filter
         QB    100 ASP  QB      7.00       #m;one,m;one  c13_0928_3
 99 TYR   
         HN     99 TYR  HA      4.00       #,  n15_0925_2_Filter
         HN     99 TYR  QB      5.60       #,i;db  n15_0925_2_Filter
         HA     99 TYR  QB      5.60       #,i;db  c13_0928_3
         HA     99 TYR  CG      6.00       #,m;dd  c13_0928_3
         HA     99 TYR  CZ      6.00       #,m;de  c13_0928_3
         HA    100 ASP  HN      4.00       #,  c13_0928_3
         HA    100 ASP  QB      4.60       #,i;one  c13_0928_3
         QB     99 TYR  CG      6.60       #i;db,m;dd  c13_0928_3
         QB     99 TYR  CZ      6.60       #i;db,m;de  c13_0928_3
         QB    100 ASP  HN      5.60       #i;db,  n15_0925_2_Filter
         QB    101 ASN  QD2     7.00       #m;db,m;one  n15_0925_2_Filter
         CG    100 ASP  HN      7.20       #r;dd,  n15_0925_2_Filter
         CZ    101 ASN  QD2     8.20       #r;de,m;one  n15_0925_2_Filter
100 ASP   
         HN    100 ASP  HA      4.00       #,  n15_0925_2_Filter
         HN    100 ASP  HB2     4.00       #,both  n15_0925_2_Filter
         HN    100 ASP  HB3     4.00       #,both  n15_0925_2_Filter
         HN    101 ASN  HN      4.00       #,  n15_0925_2_Filter
         HA    100 ASP  HB2     4.00       #,both  c13_0928_3
         HA    100 ASP  HB3     4.00       #,both  c13_0928_3
         HA    101 ASN  HN      3.00       #,  n15_0925_2_Filter
         HA    104 VAL  HB      4.00       #,  c13_0928_3
         HA    108 ARG  QB      6.00       #,m;one  c13_0928_3
101 ASN   
         HN    101 ASN  HA      5.00       #,  c13_0928_3
         HN    101 ASN  HB2     5.00       #,both  n15_0925_2_Filter
         HN    101 ASN  HB3     5.00       #,both  n15_0925_2_Filter
         HN    101 ASN  QD2     6.00       #,m;one  n15_0925_2_Filter
         HN    102 SER  HN      4.00       #,  n15_0925_2_Filter
         HN    104 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HA    101 ASN  HB2     4.00       #,both  c13_0928_3
         HA    101 ASN  HB3     4.00       #,both  c13_0928_3
         HA    102 SER  HN      5.00       #,  c13_0928_3
         HA    103 LEU  HN      5.00       #,  c13_0928_3
         QB    101 ASN  HD21    5.60       #i;one,both  c13_0928_3
         QB    101 ASN  HD22    5.60       #i;one,both  c13_0928_3
         HB3   101 ASN  QD2     6.00       #both,m;one  n15_0925_2_Filter
         HB2   102 SER  HN      5.00       #both,  n15_0925_2_Filter
         HB3   102 SER  HN      5.00       #both,  n15_0925_2_Filter
         HB2   103 LEU  HN      5.00       #both,  n15_0925_2_Filter
         HB3   103 LEU  HN      5.00       #both,  n15_0925_2_Filter
         QB    103 LEU  QB      5.00       #m;one,m;one  c13_0928_3
         QB    104 VAL  QQG     8.40       #m;one,q;dMe  c13_0928_3
         QD2   103 LEU  HN      6.00       #m;one,  n15_0925_2_Filter
102 SER   
         HN    102 SER  HA      4.00       #,  c13_0928_3
         HN    102 SER  QB      4.60       #,i;db  n15_0925_2_Filter
         HN    103 LEU  HN      4.00       #,  n15_0925_2_Filter
         HN    103 LEU  QB      5.60       #,i;one  n15_0925_2_Filter
         HN    106 GLY  QA      6.00       #,m;da  n15_0925_2_Filter
         HN    108 ARG  QB      5.00       #,m;one  n15_0925_2_Filter
         HN    108 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN    108 ARG  QD      6.00       #,m;dd  n15_0925_2_Filter
         HA    102 SER  QB      5.60       #,i;db  c13_0928_3
         HA    103 LEU  HN      3.00       #,  n15_0925_2_Filter
         HA    104 VAL  HN      4.00       #,  n15_0925_2_Filter
         HA    105 GLU  QB      6.00       #,m;db  c13_0928_3
         HA    106 GLY  QA      6.00       #,m;da  c13_0928_3
         HA    108 ARG  HN      5.00       #,  n15_0925_2_Filter
         HA    108 ARG  HB2     5.00       #,both  c13_0928_3
         HA    108 ARG  HB3     5.00       #,both  c13_0928_3
         HA    108 ARG  QG      6.00       #,m;dg  c13_0928_3
         QB    103 LEU  HN      4.60       #i;db,  n15_0925_2_Filter
         QB    103 LEU  HA      5.60       #i;db,  c13_0928_3
         QB    106 GLY  HN      5.00       #m;db,  n15_0925_2_Filter
         QB    107 MET  HN      5.00       #m;db,  n15_0925_2_Filter
         QB    107 MET  QE      7.00       #m;db,m;Me  c13_0928_3
         QB    108 ARG  HA      6.00       #m;db,  c13_0928_3
103 LEU   
         HN    103 LEU  HA      4.00       #,  c13_0928_3
         HN    103 LEU  HB2     4.00       #,both  n15_0925_2_Filter
         HN    103 LEU  HB3     4.00       #,both  n15_0925_2_Filter
         HN    103 LEU  HG      5.00       #,  n15_0925_2_Filter
         HN    103 LEU  QQD     7.20       #,r;dMe  n15_0925_2_Filter
         HN    104 VAL  HN      3.00       #,  n15_0925_2_Filter
         HN    104 VAL  QQG     7.40       #,q;dMe  n15_0925_2_Filter
         HN    106 GLY  HN      4.00       #,  n15_0925_2_Filter
         HA    103 LEU  HB2     4.00       #,both  c13_0928_3
         HA    103 LEU  HB3     4.00       #,both  c13_0928_3
         HA    103 LEU  HG      5.00       #,  c13_0928_3
         HA    103 LEU  QQD     6.70       #,s;dMe  c13_0928_3
         HA    104 VAL  HN      3.00       #,  n15_0925_2_Filter
         HA    105 GLU  HN      4.00       #,  n15_0925_2_Filter
         HA    106 GLY  HN      4.00       #,  n15_0925_2_Filter
         HB2   103 LEU  QQD     5.00       #both,  c13_0928_3
         HB3   103 LEU  QQD     5.00       #both,  c13_0928_3
         HB2   104 VAL  HN      5.00       #both,  c13_0928_3
         HB3   104 VAL  HN      5.00       #both,  c13_0928_3
         QB    104 VAL  HB      5.60       #i;one,  c13_0928_3
         HG    103 LEU  QQD     5.00       #,  c13_0928_3
         HG    104 VAL  HN      5.00       #,  c13_0928_3
         HG    104 VAL  HA      5.00       #,  c13_0928_3
         HG    104 VAL  QQG     7.40       #,q;dMe  c13_0928_3
         QQD   104 VAL  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQD   105 GLU  HN      7.40       #q;dMe,  n15_0925_2_Filter
104 VAL   
         HN    104 VAL  HA      4.00       #,  c13_0928_3
         HN    104 VAL  HB      4.00       #,  c13_0928_3
         HN    104 VAL  QQG     6.70       #,s;dMe  n15_0925_2_Filter
         HN    105 GLU  HN      3.00       #,  n15_0925_2_Filter
         HN    105 GLU  QB      4.60       #,i;db  n15_0925_2_Filter
         HN    106 GLY  QA      5.00       #,m;da  n15_0925_2_Filter
         HN    108 ARG  QB      5.00       #,m;one  n15_0925_2_Filter
         HA    104 VAL  HB      3.00       #,  c13_0928_3
         HA    104 VAL  QQG     5.60       #,i;dMe  c13_0928_3
         HA    105 GLU  HN      3.00       #,  n15_0925_2_Filter
         HA    105 GLU  QG      6.00       #,m;dg  c13_0928_3
         HB    104 VAL  QQG     5.00       #,  c13_0928_3
         HB    105 GLU  HN      4.00       #,  n15_0925_2_Filter
         HB    105 GLU  QG      6.00       #,m;dg  c13_0928_3
         QQG   105 GLU  HN      7.40       #q;dMe,  n15_0925_2_Filter
         QQG   105 GLU  QG      8.40       #q;dMe,m;dg  c13_0928_3
         QQG   106 GLY  HN      7.40       #q;dMe,  c13_0928_3
         QQG   107 MET  QE      8.40       #q;dMe,m;Me  c13_0928_3
         QQG   108 ARG  QB      8.40       #q;dMe,m;one  c13_0928_3
105 GLU   
         HN    105 GLU  HA      4.00       #,  c13_0928_3
         HN    105 GLU  QB      5.60       #,i;db  c13_0928_3
         HN    105 GLU  QG      6.00       #,m;dg  n15_0925_2_Filter
         HN    106 GLY  QA      4.60       #,i;da  c13_0928_3
         HN    107 MET  QE      6.00       #,m;Me  n15_0925_2_Filter
         HN    108 ARG  QB      5.00       #,m;one  n15_0925_2_Filter
         HA    105 GLU  QB      5.60       #,i;db  c13_0928_3
         HA    105 GLU  QG      6.00       #,m;dg  c13_0928_3
         HA    106 GLY  HN      4.00       #,  c13_0928_3
         HA    106 GLY  QA      5.60       #,i;da  c13_0928_3
         HA    107 MET  HN      5.00       #,  c13_0928_3
         QB    106 GLY  HN      5.60       #i;db,  c13_0928_3
         QB    106 GLY  QA      6.20       #i;db,i;da  c13_0928_3
         QB    107 MET  HN      6.00       #m;db,  c13_0928_3
         QB    107 MET  HA      6.00       #m;db,  c13_0928_3
         QB    108 ARG  HN      5.00       #m;db,  n15_0925_2_Filter
         QB    108 ARG  QB      7.00       #m;db,m;one  c13_0928_3
         QG    106 GLY  QA      6.60       #m;dg,i;da  c13_0928_3
         QG    107 MET  QE      7.00       #m;dg,m;Me  c13_0928_3
         QG    108 ARG  QB      7.00       #m;dg,m;one  c13_0928_3
         QG    108 ARG  QD      7.00       #m;dg,m;dd  c13_0928_3
106 GLY   
         HN    106 GLY  QA      4.60       #,i;da  n15_0925_2_Filter
         HN    107 MET  HN      4.00       #,  n15_0925_2_Filter
         HN    107 MET  QE      6.00       #,m;Me  n15_0925_2_Filter
         QA    107 MET  HN      4.60       #i;da,  n15_0925_2_Filter
         QA    107 MET  HA      5.60       #i;da,  c13_0928_3
         QA    107 MET  QB      6.20       #i;da,i;one  c13_0928_3
         QA    107 MET  QE      6.60       #i;da,m;Me  c13_0928_3
107 MET   
         HN    107 MET  HA      4.00       #,  c13_0928_3
         HN    107 MET  HB2     4.00       #,both  n15_0925_2_Filter
         HN    107 MET  HB3     4.00       #,both  n15_0925_2_Filter
         HN    107 MET  QE      6.00       #,m;Me  n15_0925_2_Filter
         HN    108 ARG  HN      3.00       #,  n15_0925_2_Filter
         HN    108 ARG  HA      5.00       #,  c13_0928_3
         HA    107 MET  QB      4.60       #,i;one  c13_0928_3
         HA    107 MET  QE      6.00       #,m;Me  c13_0928_3
         HA    108 ARG  HN      3.00       #,  n15_0925_2_Filter
         HB2   108 ARG  QD      6.00       #both,m;dd  c13_0928_3
         HB3   108 ARG  QD      6.00       #both,m;dd  c13_0928_3
         QE    108 ARG  HN      6.00       #m;Me,  n15_0925_2_Filter
         QE    108 ARG  QB      6.60       #m;Me,i;one  c13_0928_3
         QE    108 ARG  QG      7.00       #m;Me,m;dg  c13_0928_3
         QE    108 ARG  QD      7.00       #m;Me,m;dd  c13_0928_3
108 ARG   
         HN    108 ARG  HA      5.00       #,  n15_0925_2_Filter
         HN    108 ARG  HB2     4.00       #,both  n15_0925_2_Filter
         HN    108 ARG  HB3     4.00       #,both  n15_0925_2_Filter
         HN    108 ARG  QG      6.00       #,m;dg  n15_0925_2_Filter
         HA    108 ARG  HB2     5.00       #,both  c13_0928_3
         HA    108 ARG  HB3     5.00       #,both  c13_0928_3
         HA    108 ARG  QG      6.00       #,m;dg  c13_0928_3
         HA    108 ARG  QD      6.00       #,m;dd  c13_0928_3
         HB2   108 ARG  QG      6.00       #both,m;dg  c13_0928_3
         HB3   108 ARG  QG      6.00       #both,m;dg  c13_0928_3
         HB2   108 ARG  QD      6.00       #both,m;dd  c13_0928_3
         HB3   108 ARG  QD      6.00       #both,m;dd  c13_0928_3
         QG    108 ARG  QD      7.00       #m;dg,m;dd  c13_0928_3

# dihedral angle constraints derived
# from HYPER, TALOS, Ramachandran plot and  secondary structures

   1 MET   PHI    -200.0    20.0
   2 ALA   PHI    -200.0    20.0
   3 LYS   PHI    -165.0    95.0
   3 LYS   PHI    -147.2   -67.2
   3 LYS   PHI    -200.0    20.0
   3 LYS   PSI      88.1   168.1
   4 GLU   PHI    -136.0   -56.0
   4 GLU   PHI    -200.0    20.0
   4 GLU   PSI      86.8   166.8
   5 PHE   PHI    -180.0   110.0
   5 PHE   PHI    -200.0    20.0
   7 ARG   PHI    -180.0   110.0
   7 ARG   PHI    -117.2   -37.2
   7 ARG   PHI    -200.0    20.0
   7 ARG   PSI      97.2   177.2
   8 PRO   PSI     -77.7     2.3
   9 GLN   PHI     -85.0   -30.0
   9 GLN   PHI    -103.2   -23.1
   9 GLN   PHI    -200.0    20.0
   9 GLN   PSI     -75.0   -20.0
   9 GLN   PSI     -79.9     0.1
  10 ARG   PHI     -85.0   -30.0
  10 ARG   PHI    -105.1   -25.1
  10 ARG   PHI    -200.0    20.0
  10 ARG   PSI     -75.0   -20.0
  10 ARG   PSI     -81.7    -1.7
  11 VAL   PHI     -85.0   -30.0
  11 VAL   PHI    -105.0   -25.0
  11 VAL   PHI    -200.0    20.0
  11 VAL   PSI     -75.0   -20.0
  11 VAL   PSI     -81.7    -1.7
  12 ALA   PHI     -85.0   -30.0
  12 ALA   PHI     -99.7   -19.7
  12 ALA   PHI    -200.0    20.0
  12 ALA   PSI     -75.0   -20.0
  12 ALA   PSI     -81.9    -1.9
  13 GLN   PHI     -80.0   -30.0
  13 GLN   PHI    -101.9   -21.9
  13 GLN   PHI    -200.0    20.0
  13 GLN   PSI     -75.0   -20.0
  13 GLN   PSI     -85.0    -5.0
  14 GLU   PHI     -75.0   -30.0
  14 GLU   PHI    -105.2   -25.2
  14 GLU   PHI    -200.0    20.0
  14 GLU   PSI     -75.0   -20.0
  14 GLU   PSI     -81.0    -1.0
  15 MET   PHI     -85.0   -30.0
  15 MET   PHI    -102.8   -22.8
  15 MET   PHI    -200.0    20.0
  15 MET   PSI     -75.0   -20.0
  15 MET   PSI     -84.1    -4.1
  16 GLN   PHI     -75.0   -30.0
  16 GLN   PHI    -100.6   -20.6
  16 GLN   PHI    -200.0    20.0
  16 GLN   PSI     -75.0   -20.0
  16 GLN   PSI     -82.9    -2.9
  17 LYS   PHI     -75.0   -60.0
  17 LYS   PHI    -100.2   -20.2
  17 LYS   PHI    -200.0    20.0
  17 LYS   PSI     -75.0   -20.0
  17 LYS   PSI     -83.4    -3.4
  18 GLU   PHI     -80.0   -70.0
  18 GLU   PHI    -104.3   -24.3
  18 GLU   PHI    -200.0    20.0
  18 GLU   PSI     -75.0   -20.0
  18 GLU   PSI     -83.9    -3.9
  19 ILE   PHI     -85.0   -30.0
  19 ILE   PHI    -102.2   -22.2
  19 ILE   PHI    -200.0    20.0
  19 ILE   PSI     -75.0   -20.0
  19 ILE   PSI     -86.3    -6.3
  20 ALA   PHI     -75.0   -30.0
  20 ALA   PHI    -100.8   -20.8
  20 ALA   PHI    -200.0    20.0
  20 ALA   PSI     -75.0   -20.0
  20 ALA   PSI     -78.6     1.4
  21 LEU   PHI     -75.0   -30.0
  21 LEU   PHI    -106.8   -26.8
  21 LEU   PHI    -200.0    20.0
  21 LEU   PSI     -75.0   -20.0
  21 LEU   PSI     -83.0    -3.0
  22 ILE   PHI     -80.0   -60.0
  22 ILE   PHI    -102.7   -22.7
  22 ILE   PHI    -200.0    20.0
  22 ILE   PSI     -75.0   -20.0
  22 ILE   PSI     -82.4    -2.4
  23 LEU   PHI     -85.0   -30.0
  23 LEU   PHI    -104.1   -24.1
  23 LEU   PHI    -200.0    20.0
  23 LEU   PSI     -75.0   -20.0
  23 LEU   PSI     -81.6    -1.6
  24 GLN   PHI    -270.0    30.0
  24 GLN   PHI    -110.7   -30.7
  24 GLN   PHI    -200.0    20.0
  24 GLN   PSI     -72.1     7.9
  25 ARG   PHI    -165.0    95.0
  25 ARG   PHI    -113.7   -33.7
  25 ARG   PHI    -200.0    20.0
  25 ARG   PSI     -66.6    13.4
  26 GLU   PHI    -165.0    95.0
  26 GLU   PHI    -135.4   -55.4
  26 GLU   PHI    -200.0    20.0
  26 GLU   PSI     -47.4    32.6
  27 ILE   PHI    -165.0    95.0
  27 ILE   PHI    -122.5   -42.5
  27 ILE   PHI    -200.0    20.0
  27 ILE   PSI      99.1   179.1
  28 LYS   PHI    -165.0    95.0
  28 LYS   PHI    -127.9   -47.9
  28 LYS   PHI    -200.0    20.0
  28 LYS   PSI      79.0   159.0
  29 ASP   PHI    -270.0    30.0
  29 ASP   PHI    -200.0    20.0
  31 ARG   PHI    -111.6   -31.6
  31 ARG   PHI    -200.0    20.0
  31 ARG   PSI     -61.8    18.2
  32 LEU   PHI    -170.0   105.0
  32 LEU   PHI    -132.6   -52.6
  32 LEU   PHI    -200.0    20.0
  32 LEU   PSI     -42.6    37.4
  33 GLY   PHI    -275.0    35.0
  33 GLY   PHI      36.0   116.0
  33 GLY   PSI     -21.8    58.2
  34 MET   PHI    -170.0   105.0
  34 MET   PHI    -200.0    20.0
  35 MET   PHI    -200.0    20.0
  36 THR   PHI    -200.0    20.0
  37 THR   PHI    -154.6   -74.6
  37 THR   PHI    -200.0    20.0
  37 THR   PSI      93.6   173.6
  38 VAL   PHI    -148.9   -68.9
  38 VAL   PHI    -200.0    20.0
  38 VAL   PSI      73.2   153.2
  39 SER   PHI     -95.0   215.0
  39 SER   PHI    -200.0    20.0
  40 GLY   PHI    -270.0    30.0
  41 VAL   PHI    -160.0   -80.0
  41 VAL   PHI    -160.3   -80.3
  41 VAL   PHI    -200.0    20.0
  41 VAL   PSI      60.0   180.0
  41 VAL   PSI      91.4   171.4
  42 GLU   PHI    -180.0   -70.0
  42 GLU   PHI    -164.0   -84.0
  42 GLU   PHI    -200.0    20.0
  42 GLU   PSI      60.0   180.0
  42 GLU   PSI      96.6   176.6
  43 MET   PHI    -180.0   -70.0
  43 MET   PHI    -142.2   -62.2
  43 MET   PHI    -200.0    20.0
  43 MET   PSI      60.0   180.0
  43 MET   PSI      98.2   178.2
  44 SER   PHI    -180.0   -70.0
  44 SER   PHI    -116.6   -36.6
  44 SER   PHI    -200.0    20.0
  44 SER   PSI      60.0   180.0
  44 SER   PSI     113.4   193.4
  45 ARG   PHI    -100.1   -20.0
  45 ARG   PHI    -200.0    20.0
  45 ARG   PSI     -69.3    10.7
  46 ASP   PHI     -95.0   215.0
  46 ASP   PHI    -129.6   -49.6
  46 ASP   PHI    -200.0    20.0
  46 ASP   PSI     -37.6    42.4
  47 LEU   PHI     -95.0   215.0
  47 LEU   PHI    -200.0    20.0
  48 ALA   PHI     -95.0   215.0
  48 ALA   PHI    -200.0    20.0
  49 TYR   PHI    -180.0   -70.0
  49 TYR   PHI    -162.6   -82.7
  49 TYR   PHI    -200.0    20.0
  49 TYR   PSI      60.0   180.0
  49 TYR   PSI     103.4   183.4
  50 ALA   PHI    -180.0   -70.0
  50 ALA   PHI    -161.5   -81.5
  50 ALA   PHI    -200.0    20.0
  50 ALA   PSI      60.0   180.0
  50 ALA   PSI      96.1   176.1
  51 LYS   PHI    -180.0   -70.0
  51 LYS   PHI    -152.8   -72.8
  51 LYS   PHI    -200.0    20.0
  51 LYS   PSI      60.0   180.0
  51 LYS   PSI      84.1   164.1
  52 VAL   PHI    -180.0   -75.0
  52 VAL   PHI    -149.3   -69.3
  52 VAL   PHI    -200.0    20.0
  52 VAL   PSI      65.0   175.0
  52 VAL   PSI      78.6   158.6
  53 TYR   PHI    -180.0   -70.0
  53 TYR   PHI    -149.1   -69.1
  53 TYR   PHI    -200.0    20.0
  53 TYR   PSI      60.0   180.0
  53 TYR   PSI      99.4   179.4
  54 VAL   PHI    -160.0   -80.0
  54 VAL   PHI    -170.3   -90.3
  54 VAL   PHI    -200.0    20.0
  54 VAL   PSI      60.0   180.0
  54 VAL   PSI     116.0   196.0
  55 THR   PHI    -180.0   -75.0
  55 THR   PHI    -170.1   -90.1
  55 THR   PHI    -200.0    20.0
  55 THR   PSI      65.0   175.0
  55 THR   PSI     103.7   183.7
  56 PHE   PHI    -152.2   -72.2
  56 PHE   PHI    -200.0    20.0
  56 PHE   PSI      97.5   177.5
  57 LEU   PHI    -165.0    95.0
  57 LEU   PHI    -200.0    20.0
  58 ASN   PHI    -170.0   105.0
  58 ASN   PHI    -128.4   -48.4
  58 ASN   PHI    -200.0    20.0
  58 ASN   PSI     -50.8    29.2
  59 ASP   PHI    -165.0    95.0
  59 ASP   PHI    -200.0    20.0
  60 LYS   PHI     -95.0   215.0
  60 LYS   PHI    -200.0    20.0
  61 ASP   PHI    -165.0    95.0
  61 ASP   PHI    -127.3   -47.3
  61 ASP   PHI    -200.0    20.0
  61 ASP   PSI      77.6   157.6
  62 GLU   PHI     -85.0   -70.0
  62 GLU   PHI     -99.8   -19.8
  62 GLU   PHI    -200.0    20.0
  62 GLU   PSI     -75.0   -20.0
  62 GLU   PSI     -78.3     1.7
  63 ASP   PHI     -80.0   -60.0
  63 ASP   PHI    -104.9   -24.9
  63 ASP   PHI    -200.0    20.0
  63 ASP   PSI     -75.0   -20.0
  63 ASP   PSI     -76.1     3.9
  64 ALA   PHI     -80.0   -60.0
  64 ALA   PHI    -105.6   -25.7
  64 ALA   PHI    -200.0    20.0
  64 ALA   PSI     -75.0   -20.0
  64 ALA   PSI     -79.9     0.2
  65 VAL   PHI     -85.0   -75.0
  65 VAL   PHI    -104.6   -24.6
  65 VAL   PHI    -200.0    20.0
  65 VAL   PSI     -75.0   -20.0
  65 VAL   PSI     -83.8    -3.8
  66 LYS   PHI     -80.0   -30.0
  66 LYS   PHI     -99.0   -19.0
  66 LYS   PHI    -200.0    20.0
  66 LYS   PSI     -75.0   -20.0
  66 LYS   PSI     -80.5    -0.5
  67 ALA   PHI     -75.0   -55.0
  67 ALA   PHI    -101.2   -21.2
  67 ALA   PHI    -200.0    20.0
  67 ALA   PSI     -75.0   -20.0
  67 ALA   PSI     -82.2    -2.2
  68 GLY   PHI     -85.0   -30.0
  68 GLY   PHI    -121.0   -41.0
  68 GLY   PSI     -75.0   -20.0
  68 GLY   PSI     -60.3    19.7
  69 ILE   PHI     -85.0   -30.0
  69 ILE   PHI    -200.0    20.0
  69 ILE   PSI     -75.0   -20.0
  70 LYS   PHI     -85.0   -30.0
  70 LYS   PHI    -105.5   -25.5
  70 LYS   PHI    -200.0    20.0
  70 LYS   PSI     -75.0   -20.0
  70 LYS   PSI     -77.6     2.4
  71 ALA   PHI     -80.0   -30.0
  71 ALA   PHI    -108.6   -28.6
  71 ALA   PHI    -200.0    20.0
  71 ALA   PSI     -75.0   -20.0
  71 ALA   PSI     -76.4     3.6
  72 LEU   PHI     -85.0   -30.0
  72 LEU   PHI    -106.4   -26.4
  72 LEU   PHI    -200.0    20.0
  72 LEU   PSI     -75.0   -20.0
  72 LEU   PSI     -83.3    -3.3
  73 GLN   PHI     -85.0   -30.0
  73 GLN   PHI     -98.7   -18.7
  73 GLN   PHI    -200.0    20.0
  73 GLN   PSI     -75.0   -20.0
  73 GLN   PSI     -83.3    -3.3
  74 GLU   PHI     -75.0   -55.0
  74 GLU   PHI    -102.9   -22.9
  74 GLU   PHI    -200.0    20.0
  74 GLU   PSI     -75.0   -20.0
  74 GLU   PSI     -67.5    12.5
  75 ALA   PHI    -165.0    95.0
  75 ALA   PHI    -200.0    20.0
  76 SER   PHI     -65.0   -55.0
  76 SER   PHI    -103.4   -23.4
  76 SER   PHI    -200.0    20.0
  76 SER   PSI     -75.0   -20.0
  76 SER   PSI     -74.5     5.5
  77 GLY   PHI     -85.0   -30.0
  77 GLY   PHI    -103.9   -23.9
  77 GLY   PSI     -75.0   -20.0
  77 GLY   PSI     -78.6     1.4
  78 PHE   PHI     -85.0   -30.0
  78 PHE   PHI    -103.0   -23.0
  78 PHE   PHI    -200.0    20.0
  78 PHE   PSI     -75.0   -20.0
  78 PHE   PSI     -82.1    -2.1
  79 ILE   PHI     -85.0   -30.0
  79 ILE   PHI    -102.8   -22.8
  79 ILE   PHI    -200.0    20.0
  79 ILE   PSI     -75.0   -20.0
  79 ILE   PSI     -85.9    -5.9
  80 ARG   PHI     -80.0   -30.0
  80 ARG   PHI     -97.3   -17.3
  80 ARG   PHI    -200.0    20.0
  80 ARG   PSI     -75.0   -20.0
  80 ARG   PSI     -81.8    -1.8
  81 SER   PHI     -75.0   -55.0
  81 SER   PHI    -102.1   -22.1
  81 SER   PHI    -200.0    20.0
  81 SER   PSI     -75.0   -20.0
  81 SER   PSI     -80.9    -0.9
  82 LEU   PHI     -80.0   -30.0
  82 LEU   PHI    -104.8   -24.8
  82 LEU   PHI    -200.0    20.0
  82 LEU   PSI     -75.0   -20.0
  82 LEU   PSI     -79.4     0.6
  83 LEU   PHI     -85.0   -60.0
  83 LEU   PHI    -100.9   -20.9
  83 LEU   PHI    -200.0    20.0
  83 LEU   PSI     -75.0   -20.0
  83 LEU   PSI     -81.4    -1.4
  84 GLY   PHI     -80.0   -30.0
  84 GLY   PHI    -104.9   -24.9
  84 GLY   PSI     -75.0   -20.0
  84 GLY   PSI     -73.7     6.3
  85 LYS   PHI     -80.0   -30.0
  85 LYS   PHI    -103.9   -23.9
  85 LYS   PHI    -200.0    20.0
  85 LYS   PSI     -75.0   -20.0
  85 LYS   PSI     -75.2     4.8
  86 ALA   PHI     -80.0   -60.0
  86 ALA   PHI    -104.3   -24.3
  86 ALA   PHI    -200.0    20.0
  86 ALA   PSI     -75.0   -20.0
  86 ALA   PSI     -69.0    11.0
  87 MET   PHI    -155.0    80.0
  87 MET   PHI    -134.4   -54.4
  87 MET   PHI    -200.0    20.0
  87 MET   PSI     -44.3    35.7
  88 ARG   PHI     -95.0   215.0
  88 ARG   PHI    -200.0    20.0
  89 LEU   PHI    -165.0    95.0
  89 LEU   PHI    -200.0    20.0
  90 ARG   PHI    -165.0    95.0
  90 ARG   PHI    -200.0    20.0
  91 ILE   PHI    -200.0    20.0
  92 VAL   PHI    -170.0   105.0
  92 VAL   PHI    -200.0    20.0
  94 GLU   PHI    -180.0   -70.0
  94 GLU   PHI    -200.0    20.0
  94 GLU   PSI      60.0   180.0
  95 LEU   PHI    -170.0   -70.0
  95 LEU   PHI    -142.4   -62.4
  95 LEU   PHI    -200.0    20.0
  95 LEU   PSI      60.0   180.0
  95 LEU   PSI      91.1   171.1
  96 THR   PHI    -180.0   -70.0
  96 THR   PHI    -147.4   -67.4
  96 THR   PHI    -200.0    20.0
  96 THR   PSI      60.0   180.0
  96 THR   PSI      97.3   177.3
  97 PHE   PHI    -165.0   -75.0
  97 PHE   PHI    -137.4   -57.4
  97 PHE   PHI    -200.0    20.0
  97 PHE   PSI      60.0   180.0
  97 PHE   PSI      98.7   178.7
  98 PHE   PHI    -180.0   -70.0
  98 PHE   PHI    -173.0   -93.0
  98 PHE   PHI    -200.0    20.0
  98 PHE   PSI      60.0   180.0
  98 PHE   PSI     112.6   192.6
  99 TYR   PHI    -180.0   -70.0
  99 TYR   PHI    -139.1   -59.1
  99 TYR   PHI    -200.0    20.0
  99 TYR   PSI      60.0   180.0
  99 TYR   PSI      81.6   161.6
 100 ASP   PHI    -180.0   -70.0
 100 ASP   PHI    -129.7   -49.7
 100 ASP   PHI    -200.0    20.0
 100 ASP   PSI      60.0   180.0
 100 ASP   PSI      87.4   167.4
 101 ASN   PHI    -255.0    15.0
 101 ASN   PHI    -123.8   -43.8
 101 ASN   PHI    -200.0    20.0
 101 ASN   PSI     106.1   186.1
 102 SER   PHI    -180.0   110.0
 102 SER   PHI    -200.0    20.0
 103 LEU   PHI    -165.0    95.0
 103 LEU   PHI    -119.7   -39.7
 103 LEU   PHI    -200.0    20.0
 103 LEU   PSI     -52.2    27.8
 104 VAL   PHI    -165.0    95.0
 104 VAL   PHI    -200.0    20.0
 105 GLU   PHI    -170.0   105.0
 105 GLU   PHI    -200.0    20.0
 106 GLY   PHI      49.9   129.9
 106 GLY   PSI     -38.1    41.9
 107 MET   PHI    -155.0    80.0
 107 MET   PHI    -200.0    20.0
 108 ARG   PHI    -155.0    80.0
 108 ARG   PHI    -200.0    20.0

# hbond upper-limit distance constraints 

  9 GLN   O      13 GLN   N       3.00 # hbond
  9 GLN   O      13 GLN   HN      2.00 # hbond
 10 ARG   O      14 GLU   N       3.00 # hbond
 10 ARG   O      14 GLU   HN      2.00 # hbond
 11 VAL   O      15 MET   N       3.00 # hbond
 11 VAL   O      15 MET   HN      2.00 # hbond
 12 ALA   O      16 GLN   N       3.00 # hbond
 12 ALA   O      16 GLN   HN      2.00 # hbond
 13 GLN   O      17 LYS   N       3.00 # hbond
 13 GLN   O      17 LYS   HN      2.00 # hbond
 14 GLU   O      18 GLU   N       3.00 # hbond
 14 GLU   O      18 GLU   HN      2.00 # hbond
 15 MET   O      19 ILE   N       3.00 # hbond
 15 MET   O      19 ILE   HN      2.00 # hbond
 16 GLN   O      20 ALA   N       3.00 # hbond
 16 GLN   O      20 ALA   HN      2.00 # hbond
 17 LYS   O      21 LEU   N       3.00 # hbond
 17 LYS   O      21 LEU   HN      2.00 # hbond
 18 GLU   O      22 ILE   N       3.00 # hbond
 18 GLU   O      22 ILE   HN      2.00 # hbond
 19 ILE   O      23 LEU   N       3.00 # hbond
 19 ILE   O      23 LEU   HN      2.00 # hbond
 37 THR   O      55 THR   N       3.00 # hbond
 37 THR   O      55 THR   HN      2.00 # hbond
 40 GLY   O      53 TYR   N       3.00 # hbond
 40 GLY   O      53 TYR   HN      2.00 # hbond
 42 GLU   O      51 LYS   N       3.00 # hbond
 42 GLU   O      51 LYS   HN      2.00 # hbond
 44 SER   O      49 TYR   N       3.00 # hbond
 44 SER   O      49 TYR   HN      2.00 # hbond
 48 ALA   O      94 GLU   N       3.00 # hbond
 48 ALA   O      94 GLU   HN      2.00 # hbond
 49 TYR   O      44 SER   N       3.00 # hbond
 49 TYR   O      44 SER   HN      2.00 # hbond
 50 ALA   O      96 THR   N       3.00 # hbond
 50 ALA   O      96 THR   HN      2.00 # hbond
 51 LYS   O      42 GLU   N       3.00 # hbond
 51 LYS   O      42 GLU   HN      2.00 # hbond
 52 VAL   O      98 PHE   N       3.00 # hbond
 52 VAL   O      98 PHE   HN      2.00 # hbond
 54 VAL   O     100 ASP   N       3.00 # hbond
 54 VAL   O     100 ASP   HN      2.00 # hbond
 55 THR   O      37 THR   N       3.00 # hbond
 55 THR   O      37 THR   HN      2.00 # hbond
 61 ASP   O      65 VAL   N       3.00 # hbond
 61 ASP   O      65 VAL   HN      2.00 # hbond
 62 GLU   O      66 LYS   N       3.00 # hbond
 62 GLU   O      66 LYS   HN      2.00 # hbond
 63 ASP   O      67 ALA   N       3.00 # hbond
 63 ASP   O      67 ALA   HN      2.00 # hbond
 64 ALA   O      68 GLY   N       3.00 # hbond
 64 ALA   O      68 GLY   HN      2.00 # hbond
 65 VAL   O      69 ILE   N       3.00 # hbond
 65 VAL   O      69 ILE   HN      2.00 # hbond
 66 LYS   O      70 LYS   N       3.00 # hbond
 66 LYS   O      70 LYS   HN      2.00 # hbond
 67 ALA   O      71 ALA   N       3.00 # hbond
 67 ALA   O      71 ALA   HN      2.00 # hbond
 68 GLY   O      72 LEU   N       3.00 # hbond
 68 GLY   O      72 LEU   HN      2.00 # hbond
 69 ILE   O      73 GLN   N       3.00 # hbond
 69 ILE   O      73 GLN   HN      2.00 # hbond
 70 LYS   O      74 GLU   N       3.00 # hbond
 70 LYS   O      74 GLU   HN      2.00 # hbond
 71 ALA   O      75 ALA   N       3.00 # hbond
 71 ALA   O      75 ALA   HN      2.00 # hbond
 75 ALA   O      79 ILE   N       3.00 # hbond
 75 ALA   O      79 ILE   HN      2.00 # hbond
 76 SER   O      80 ARG   N       3.00 # hbond
 76 SER   O      80 ARG   HN      2.00 # hbond
 77 GLY   O      81 SER   N       3.00 # hbond
 77 GLY   O      81 SER   HN      2.00 # hbond
 78 PHE   O      82 LEU   N       3.00 # hbond
 78 PHE   O      82 LEU   HN      2.00 # hbond
 79 ILE   O      83 LEU   N       3.00 # hbond
 79 ILE   O      83 LEU   HN      2.00 # hbond
 80 ARG   O      84 GLY   N       3.00 # hbond
 80 ARG   O      84 GLY   HN      2.00 # hbond
 81 SER   O      85 LYS   N       3.00 # hbond
 81 SER   O      85 LYS   HN      2.00 # hbond
 82 LEU   O      86 ALA   N       3.00 # hbond
 82 LEU   O      86 ALA   HN      2.00 # hbond
 94 GLU   O      50 ALA   N       3.00 # hbond
 94 GLU   O      50 ALA   HN      2.00 # hbond
 96 THR   O      52 VAL   N       3.00 # hbond
 96 THR   O      52 VAL   HN      2.00 # hbond
 98 PHE   O      54 VAL   N       3.00 # hbond
 98 PHE   O      54 VAL   HN      2.00 # hbond

# hbond lower-limit distance constraints 

  9 GLN   O      13 GLN   N       2.70 # hbond
  9 GLN   O      13 GLN   HN      1.80 # hbond
 10 ARG   O      14 GLU   N       2.70 # hbond
 10 ARG   O      14 GLU   HN      1.80 # hbond
 11 VAL   O      15 MET   N       2.70 # hbond
 11 VAL   O      15 MET   HN      1.80 # hbond
 12 ALA   O      16 GLN   N       2.70 # hbond
 12 ALA   O      16 GLN   HN      1.80 # hbond
 13 GLN   O      17 LYS   N       2.70 # hbond
 13 GLN   O      17 LYS   HN      1.80 # hbond
 14 GLU   O      18 GLU   N       2.70 # hbond
 14 GLU   O      18 GLU   HN      1.80 # hbond
 15 MET   O      19 ILE   N       2.70 # hbond
 15 MET   O      19 ILE   HN      1.80 # hbond
 16 GLN   O      20 ALA   N       2.70 # hbond
 16 GLN   O      20 ALA   HN      1.80 # hbond
 17 LYS   O      21 LEU   N       2.70 # hbond
 17 LYS   O      21 LEU   HN      1.80 # hbond
 18 GLU   O      22 ILE   N       2.70 # hbond
 18 GLU   O      22 ILE   HN      1.80 # hbond
 19 ILE   O      23 LEU   N       2.70 # hbond
 19 ILE   O      23 LEU   HN      1.80 # hbond
 37 THR   O      55 THR   N       2.70 # hbond
 37 THR   O      55 THR   HN      1.80 # hbond
 40 GLY   O      53 TYR   N       2.70 # hbond
 40 GLY   O      53 TYR   HN      1.80 # hbond
 42 GLU   O      51 LYS   N       2.70 # hbond
 42 GLU   O      51 LYS   HN      1.80 # hbond
 44 SER   O      49 TYR   N       2.70 # hbond
 44 SER   O      49 TYR   HN      1.80 # hbond
 48 ALA   O      94 GLU   N       2.70 # hbond
 48 ALA   O      94 GLU   HN      1.80 # hbond
 49 TYR   O      44 SER   N       2.70 # hbond
 49 TYR   O      44 SER   HN      1.80 # hbond
 50 ALA   O      96 THR   N       2.70 # hbond
 50 ALA   O      96 THR   HN      1.80 # hbond
 51 LYS   O      42 GLU   N       2.70 # hbond
 51 LYS   O      42 GLU   HN      1.80 # hbond
 52 VAL   O      98 PHE   N       2.70 # hbond
 52 VAL   O      98 PHE   HN      1.80 # hbond
 54 VAL   O     100 ASP   N       2.70 # hbond
 54 VAL   O     100 ASP   HN      1.80 # hbond
 55 THR   O      37 THR   N       2.70 # hbond
 55 THR   O      37 THR   HN      1.80 # hbond
 61 ASP   O      65 VAL   N       2.70 # hbond
 61 ASP   O      65 VAL   HN      1.80 # hbond
 62 GLU   O      66 LYS   N       2.70 # hbond
 62 GLU   O      66 LYS   HN      1.80 # hbond
 63 ASP   O      67 ALA   N       2.70 # hbond
 63 ASP   O      67 ALA   HN      1.80 # hbond
 64 ALA   O      68 GLY   N       2.70 # hbond
 64 ALA   O      68 GLY   HN      1.80 # hbond
 65 VAL   O      69 ILE   N       2.70 # hbond
 65 VAL   O      69 ILE   HN      1.80 # hbond
 66 LYS   O      70 LYS   N       2.70 # hbond
 66 LYS   O      70 LYS   HN      1.80 # hbond
 67 ALA   O      71 ALA   N       2.70 # hbond
 67 ALA   O      71 ALA   HN      1.80 # hbond
 68 GLY   O      72 LEU   N       2.70 # hbond
 68 GLY   O      72 LEU   HN      1.80 # hbond
 69 ILE   O      73 GLN   N       2.70 # hbond
 69 ILE   O      73 GLN   HN      1.80 # hbond
 70 LYS   O      74 GLU   N       2.70 # hbond
 70 LYS   O      74 GLU   HN      1.80 # hbond
 71 ALA   O      75 ALA   N       2.70 # hbond
 71 ALA   O      75 ALA   HN      1.80 # hbond
 75 ALA   O      79 ILE   N       2.70 # hbond
 75 ALA   O      79 ILE   HN      1.80 # hbond
 76 SER   O      80 ARG   N       2.70 # hbond
 76 SER   O      80 ARG   HN      1.80 # hbond
 77 GLY   O      81 SER   N       2.70 # hbond
 77 GLY   O      81 SER   HN      1.80 # hbond
 78 PHE   O      82 LEU   N       2.70 # hbond
 78 PHE   O      82 LEU   HN      1.80 # hbond
 79 ILE   O      83 LEU   N       2.70 # hbond
 79 ILE   O      83 LEU   HN      1.80 # hbond
 80 ARG   O      84 GLY   N       2.70 # hbond
 80 ARG   O      84 GLY   HN      1.80 # hbond
 81 SER   O      85 LYS   N       2.70 # hbond
 81 SER   O      85 LYS   HN      1.80 # hbond
 82 LEU   O      86 ALA   N       2.70 # hbond
 82 LEU   O      86 ALA   HN      1.80 # hbond
 94 GLU   O      50 ALA   N       2.70 # hbond
 94 GLU   O      50 ALA   HN      1.80 # hbond
 96 THR   O      52 VAL   N       2.70 # hbond
 96 THR   O      52 VAL   HN      1.80 # hbond
 98 PHE   O      54 VAL   N       2.70 # hbond
 98 PHE   O      54 VAL   HN      1.80 # hbond




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1  -7.646  -9.415  -2.900
    2    HA   MET   1           HA       MET   1  -8.125 -10.712  -1.096
    3   1HB   MET   1          1HB       MET   1  -9.394  -9.196   0.478
    4   2HB   MET   1          2HB       MET   1  -8.217  -8.313  -0.475
    5   1HG   MET   1          1HG       MET   1  -9.867  -6.973  -1.269
    6   2HG   MET   1          2HG       MET   1 -10.637  -8.360  -2.015
    7   1HE   MET   1          1HE       MET   1 -13.438  -7.063  -1.151
    8   2HE   MET   1          2HE       MET   1 -12.667  -8.472  -1.918
    9   3HE   MET   1          3HE       MET   1 -13.733  -8.698  -0.511
   10    H    ALA   2           H        ALA   2  -9.233 -12.564  -2.178
   11    HA   ALA   2           HA       ALA   2 -11.426 -13.448  -0.937
   12   1HB   ALA   2          1HB       ALA   2 -12.161 -11.405  -2.946
   13   2HB   ALA   2          2HB       ALA   2 -13.053 -12.937  -3.097
   14   3HB   ALA   2          3HB       ALA   2 -13.087 -12.034  -1.563
   15    H    LYS   3           H        LYS   3  -9.058 -14.474  -1.956
   16    HA   LYS   3           HA       LYS   3 -10.119 -16.362  -3.921
   17   1HB   LYS   3          1HB       LYS   3  -8.301 -14.357  -4.591
   18   2HB   LYS   3          2HB       LYS   3  -7.291 -15.766  -4.344
   19   1HG   LYS   3          1HG       LYS   3  -8.944 -17.069  -5.829
   20   2HG   LYS   3          2HG       LYS   3  -9.687 -15.530  -6.216
   21   1HD   LYS   3          1HD       LYS   3  -8.086 -15.110  -7.763
   22   2HD   LYS   3          2HD       LYS   3  -6.838 -15.222  -6.539
   23   1HE   LYS   3          1HE       LYS   3  -6.274 -17.382  -7.114
   24   2HE   LYS   3          2HE       LYS   3  -7.936 -17.853  -7.405
   25   1HZ   LYS   3          1HZ       LYS   3  -6.091 -17.284  -9.342
   26   2HZ   LYS   3          2HZ       LYS   3  -7.696 -17.407  -9.589
   27    H    GLU   4           H        GLU   4 -10.459 -17.810  -2.149
   28    HA   GLU   4           HA       GLU   4  -8.151 -18.458  -0.570
   29   1HB   GLU   4          1HB       GLU   4 -10.809 -18.396   0.021
   30   2HB   GLU   4          2HB       GLU   4 -10.650 -20.095  -0.379
   31   1HG   GLU   4          1HG       GLU   4  -8.843 -20.367   1.275
   32   2HG   GLU   4          2HG       GLU   4  -8.829 -18.645   1.599
   33    HE2  GLU   4           HE       GLU   4 -10.246 -21.133   3.530
   34    H    PHE   5           H        PHE   5  -6.731 -19.333  -2.211
   35    HA   PHE   5           HA       PHE   5  -7.506 -22.051  -2.963
   36   1HB   PHE   5          1HB       PHE   5  -7.461 -19.890  -4.710
   37   2HB   PHE   5          2HB       PHE   5  -5.789 -20.402  -4.817
   38    HD1  PHE   5           HD1      PHE   5  -7.304 -20.471  -7.221
   39    HD2  PHE   5           HD2      PHE   5  -7.152 -23.381  -4.135
   40    HE1  PHE   5           HE1      PHE   5  -7.954 -22.251  -8.867
   41    HE2  PHE   5           HE2      PHE   5  -7.803 -25.161  -5.781
   42    HZ   PHE   5           HZ       PHE   5  -8.195 -24.574  -8.128
   43    H    GLY   6           H        GLY   6  -5.309 -23.054  -4.089
   44   1HA   GLY   6          1HA       GLY   6  -3.303 -22.797  -1.973
   45   2HA   GLY   6          2HA       GLY   6  -3.461 -24.095  -3.139
   46    H    ARG   7           H        ARG   7  -3.959 -21.310  -4.922
   47    HA   ARG   7           HA       ARG   7  -1.363 -21.517  -6.034
   48   1HB   ARG   7          1HB       ARG   7  -3.959 -20.439  -6.795
   49   2HB   ARG   7          2HB       ARG   7  -2.733 -19.219  -7.080
   50   1HG   ARG   7          1HG       ARG   7  -2.955 -20.603  -9.088
   51   2HG   ARG   7          2HG       ARG   7  -1.380 -20.887  -8.374
   52   1HD   ARG   7          1HD       ARG   7  -1.997 -23.025  -7.534
   53   2HD   ARG   7          2HD       ARG   7  -3.712 -22.670  -7.605
   54    HE   ARG   7           HE       ARG   7  -3.726 -23.175  -9.918
   55   1HH1  ARG   7          2HH2      ARG   7  -0.402 -23.137  -8.693
   56   2HH1  ARG   7          1HH2      ARG   7   0.262 -23.871 -10.114
   57   1HH2  ARG   7          1HH       ARG   7  -1.196 -24.455 -11.923
   58    HA   PRO   8           HA       PRO   8   0.407 -17.901  -4.320
   59   1HB   PRO   8          1HB       PRO   8   1.405 -16.419  -6.388
   60   2HB   PRO   8          2HB       PRO   8   2.197 -17.854  -5.768
   61   1HG   PRO   8          1HG       PRO   8   0.652 -17.523  -8.267
   62   2HG   PRO   8          2HG       PRO   8   1.786 -18.787  -7.837
   63   1HD   PRO   8          1HD       PRO   8  -1.075 -18.981  -7.848
   64   2HD   PRO   8          2HD       PRO   8   0.056 -20.205  -7.308
   65    H    GLN   9           H        GLN   9  -2.431 -17.654  -5.815
   66    HA   GLN   9           HA       GLN   9  -2.578 -14.796  -5.725
   67   1HB   GLN   9          1HB       GLN   9  -3.940 -16.826  -7.112
   68   2HB   GLN   9          2HB       GLN   9  -5.136 -16.222  -5.983
   69   1HG   GLN   9          1HG       GLN   9  -5.165 -14.968  -8.146
   70   2HG   GLN   9          2HG       GLN   9  -4.823 -13.922  -6.783
   71   1HE2  GLN   9          1HE2      GLN   9  -4.085 -12.691  -8.788
   72   2HE2  GLN   9          2HE2      GLN   9  -2.409 -12.808  -9.208
   73    H    ARG  10           H        ARG  10  -3.643 -17.639  -3.816
   74    HA   ARG  10           HA       ARG  10  -5.417 -16.375  -2.173
   75   1HB   ARG  10          1HB       ARG  10  -4.845 -18.884  -2.332
   76   2HB   ARG  10          2HB       ARG  10  -3.471 -18.561  -1.293
   77   1HG   ARG  10          1HG       ARG  10  -6.036 -17.444  -0.281
   78   2HG   ARG  10          2HG       ARG  10  -6.022 -19.192  -0.404
   79   1HD   ARG  10          1HD       ARG  10  -3.530 -18.687   0.730
   80   2HD   ARG  10          2HD       ARG  10  -4.511 -17.422   1.442
   81    HE   ARG  10           HE       ARG  10  -6.113 -19.643   1.743
   82   1HH1  ARG  10          2HH2      ARG  10  -2.732 -18.994   2.577
   83   2HH1  ARG  10          1HH2      ARG  10  -2.725 -20.085   3.923
   84   1HH2  ARG  10          1HH       ARG  10  -4.720 -21.302   4.457
   85    H    VAL  11           H        VAL  11  -1.932 -17.165  -1.431
   86    HA   VAL  11           HA       VAL  11  -1.764 -15.732   0.910
   87    HB   VAL  11           HB       VAL  11  -0.140 -17.330  -0.533
   88   1HG1  VAL  11          1HG1      VAL  11   1.874 -16.101  -1.183
   89   2HG1  VAL  11          2HG1      VAL  11   0.465 -15.536  -2.110
   90   3HG1  VAL  11          3HG1      VAL  11   1.090 -14.561  -0.758
   91   1HG2  VAL  11          1HG2      VAL  11   0.834 -15.402   1.602
   92   2HG2  VAL  11          2HG2      VAL  11  -0.099 -16.884   1.917
   93   3HG2  VAL  11          3HG2      VAL  11   1.525 -16.991   1.195
   94    H    ALA  12           H        ALA  12  -1.382 -14.661  -2.503
   95    HA   ALA  12           HA       ALA  12  -0.409 -12.116  -1.980
   96   1HB   ALA  12          1HB       ALA  12  -2.060 -11.934  -4.247
   97   2HB   ALA  12          2HB       ALA  12  -0.326 -12.335  -4.219
   98   3HB   ALA  12          3HB       ALA  12  -1.540 -13.636  -4.197
   99    H    GLN  13           H        GLN  13  -3.718 -13.480  -1.877
  100    HA   GLN  13           HA       GLN  13  -4.983 -10.984  -1.709
  101   1HB   GLN  13          1HB       GLN  13  -5.864 -13.796  -0.936
  102   2HB   GLN  13          2HB       GLN  13  -6.929 -12.408  -0.835
  103   1HG   GLN  13          1HG       GLN  13  -5.952 -13.871  -3.234
  104   2HG   GLN  13          2HG       GLN  13  -7.455 -13.003  -2.994
  105   1HE2  GLN  13          1HE2      GLN  13  -4.031 -12.708  -3.710
  106   2HE2  GLN  13          2HE2      GLN  13  -4.079 -11.162  -4.489
  107    H    GLU  14           H        GLU  14  -4.533 -13.555   0.837
  108    HA   GLU  14           HA       GLU  14  -5.375 -12.194   2.963
  109   1HB   GLU  14          1HB       GLU  14  -3.061 -14.137   2.670
  110   2HB   GLU  14          2HB       GLU  14  -3.518 -13.512   4.242
  111   1HG   GLU  14          1HG       GLU  14  -5.782 -14.530   2.578
  112   2HG   GLU  14          2HG       GLU  14  -4.631 -15.748   3.090
  113    HE2  GLU  14           HE       GLU  14  -4.051 -15.440   5.445
  114    H    MET  15           H        MET  15  -2.227 -11.810   1.286
  115    HA   MET  15           HA       MET  15  -1.187 -10.086   3.272
  116   1HB   MET  15          1HB       MET  15  -0.214 -11.521   1.056
  117   2HB   MET  15          2HB       MET  15  -0.084  -9.859   0.517
  118   1HG   MET  15          1HG       MET  15   1.780  -9.589   1.783
  119   2HG   MET  15          2HG       MET  15   0.853  -9.920   3.232
  120   1HE   MET  15          1HE       MET  15   3.967 -10.640   2.151
  121   2HE   MET  15          2HE       MET  15   3.504 -10.781   3.864
  122   3HE   MET  15          3HE       MET  15   4.241 -12.167   3.025
  123    H    GLN  16           H        GLN  16  -2.900  -9.690   0.139
  124    HA   GLN  16           HA       GLN  16  -2.448  -6.953  -0.076
  125   1HB   GLN  16          1HB       GLN  16  -3.332  -8.689  -1.824
  126   2HB   GLN  16          2HB       GLN  16  -4.914  -8.354  -1.153
  127   1HG   GLN  16          1HG       GLN  16  -3.252  -5.953  -1.821
  128   2HG   GLN  16          2HG       GLN  16  -3.795  -6.906  -3.188
  129   1HE2  GLN  16          1HE2      GLN  16  -5.259  -5.506  -3.987
  130   2HE2  GLN  16          2HE2      GLN  16  -6.727  -5.041  -3.196
  131    H    LYS  17           H        LYS  17  -4.889  -8.914   1.645
  132    HA   LYS  17           HA       LYS  17  -6.555  -6.668   2.230
  133   1HB   LYS  17          1HB       LYS  17  -7.931  -8.199   3.355
  134   2HB   LYS  17          2HB       LYS  17  -7.275  -9.099   2.003
  135   1HG   LYS  17          1HG       LYS  17  -5.744 -10.306   3.383
  136   2HG   LYS  17          2HG       LYS  17  -5.869  -9.149   4.693
  137   1HD   LYS  17          1HD       LYS  17  -8.512 -10.216   4.104
  138   2HD   LYS  17          2HD       LYS  17  -7.390 -11.544   4.323
  139   1HE   LYS  17          1HE       LYS  17  -6.885  -9.513   6.351
  140   2HE   LYS  17          2HE       LYS  17  -8.590  -9.922   6.351
  141   1HZ   LYS  17          1HZ       LYS  17  -7.665 -12.353   6.274
  142   2HZ   LYS  17          2HZ       LYS  17  -6.302 -11.692   6.870
  143    H    GLU  18           H        GLU  18  -3.885  -8.456   3.817
  144    HA   GLU  18           HA       GLU  18  -4.219  -7.191   6.292
  145   1HB   GLU  18          1HB       GLU  18  -2.927  -9.361   5.716
  146   2HB   GLU  18          2HB       GLU  18  -1.608  -8.321   5.218
  147   1HG   GLU  18          1HG       GLU  18  -1.281  -8.992   7.559
  148   2HG   GLU  18          2HG       GLU  18  -1.575  -7.266   7.482
  149    HE2  GLU  18           HE       GLU  18  -2.405  -7.316   9.579
  150    H    ILE  19           H        ILE  19  -2.203  -6.516   3.377
  151    HA   ILE  19           HA       ILE  19  -0.893  -4.300   4.604
  152    HB   ILE  19           HB       ILE  19   0.199  -4.027   2.553
  153   1HG1  ILE  19          1HG1      ILE  19  -2.097  -5.544   1.292
  154   2HG1  ILE  19          2HG1      ILE  19  -1.656  -3.868   1.037
  155   1HG2  ILE  19          1HG2      ILE  19   1.318  -5.884   3.028
  156   2HG2  ILE  19          2HG2      ILE  19  -0.145  -6.678   3.657
  157   3HG2  ILE  19          3HG2      ILE  19   0.231  -6.754   1.919
  158   1HD1  ILE  19          1HD1      ILE  19  -0.480  -4.637  -0.757
  159   2HD1  ILE  19          2HD1      ILE  19   0.721  -5.182   0.438
  160   3HD1  ILE  19          3HD1      ILE  19  -0.513  -6.315  -0.164
  161    H    ALA  20           H        ALA  20  -3.792  -4.827   2.573
  162    HA   ALA  20           HA       ALA  20  -4.216  -2.140   1.910
  163   1HB   ALA  20          1HB       ALA  20  -5.989  -4.591   2.132
  164   2HB   ALA  20          2HB       ALA  20  -6.622  -3.010   1.616
  165   3HB   ALA  20          3HB       ALA  20  -5.351  -3.813   0.664
  166    H    LEU  21           H        LEU  21  -4.965  -4.116   4.794
  167    HA   LEU  21           HA       LEU  21  -6.714  -2.183   5.929
  168   1HB   LEU  21          1HB       LEU  21  -7.017  -4.427   6.552
  169   2HB   LEU  21          2HB       LEU  21  -5.322  -4.651   6.934
  170    HG   LEU  21           HG       LEU  21  -6.379  -2.562   8.605
  171   1HD1  LEU  21          1HD1      LEU  21  -8.521  -3.212   8.786
  172   2HD1  LEU  21          2HD1      LEU  21  -8.199  -4.837   8.133
  173   3HD1  LEU  21          3HD1      LEU  21  -7.855  -4.479   9.844
  174   1HD2  LEU  21          1HD2      LEU  21  -4.953  -5.147   8.865
  175   2HD2  LEU  21          2HD2      LEU  21  -4.597  -3.554   9.574
  176   3HD2  LEU  21          3HD2      LEU  21  -5.849  -4.590  10.299
  177    H    ILE  22           H        ILE  22  -3.320  -3.224   6.729
  178    HA   ILE  22           HA       ILE  22  -2.896  -1.148   8.546
  179    HB   ILE  22           HB       ILE  22  -0.900  -2.709   6.902
  180   1HG1  ILE  22          1HG1      ILE  22  -1.660  -3.373   9.729
  181   2HG1  ILE  22          2HG1      ILE  22  -2.689  -3.913   8.418
  182   1HG2  ILE  22          1HG2      ILE  22   0.760  -2.072   8.434
  183   2HG2  ILE  22          2HG2      ILE  22  -0.123  -0.569   8.069
  184   3HG2  ILE  22          3HG2      ILE  22  -0.428  -1.433   9.596
  185   1HD1  ILE  22          1HD1      ILE  22   0.204  -4.623   8.967
  186   2HD1  ILE  22          2HD1      ILE  22  -1.175  -5.705   8.653
  187   3HD1  ILE  22          3HD1      ILE  22  -0.454  -4.771   7.320
  188    H    LEU  23           H        LEU  23  -3.112  -1.185   5.078
  189    HA   LEU  23           HA       LEU  23  -1.503   1.195   4.772
  190   1HB   LEU  23          1HB       LEU  23  -1.359  -0.469   3.067
  191   2HB   LEU  23          2HB       LEU  23  -3.099  -0.514   2.868
  192    HG   LEU  23           HG       LEU  23  -1.700   2.084   2.376
  193   1HD1  LEU  23          1HD1      LEU  23  -0.597  -0.098   1.218
  194   2HD1  LEU  23          2HD1      LEU  23  -1.860   0.294   0.028
  195   3HD1  LEU  23          3HD1      LEU  23  -0.644   1.516   0.470
  196   1HD2  LEU  23          1HD2      LEU  23  -3.584   2.653   1.295
  197   2HD2  LEU  23          2HD2      LEU  23  -3.743   1.060   0.514
  198   3HD2  LEU  23          3HD2      LEU  23  -4.297   1.290   2.190
  199    H    GLN  24           H        GLN  24  -4.768   0.317   5.564
  200    HA   GLN  24           HA       GLN  24  -5.604   3.026   4.876
  201   1HB   GLN  24          1HB       GLN  24  -7.045   0.384   4.922
  202   2HB   GLN  24          2HB       GLN  24  -7.970   1.820   5.315
  203   1HG   GLN  24          1HG       GLN  24  -7.852   2.659   3.168
  204   2HG   GLN  24          2HG       GLN  24  -6.213   2.090   2.918
  205   1HE2  GLN  24          1HE2      GLN  24  -9.586   1.395   2.674
  206   2HE2  GLN  24          2HE2      GLN  24  -9.488  -0.101   1.804
  207    H    ARG  25           H        ARG  25  -4.596   1.022   7.412
  208    HA   ARG  25           HA       ARG  25  -6.255   2.474   9.306
  209   1HB   ARG  25          1HB       ARG  25  -4.960  -0.245   9.313
  210   2HB   ARG  25          2HB       ARG  25  -5.061   0.579  10.857
  211   1HG   ARG  25          1HG       ARG  25  -7.609   0.918   9.591
  212   2HG   ARG  25          2HG       ARG  25  -7.168  -0.764   9.371
  213   1HD   ARG  25          1HD       ARG  25  -6.667   0.348  12.107
  214   2HD   ARG  25          2HD       ARG  25  -8.353   0.212  11.646
  215    HE   ARG  25           HE       ARG  25  -6.910  -2.213  10.986
  216   1HH1  ARG  25          2HH2      ARG  25  -8.375  -0.477  13.704
  217   2HH1  ARG  25          1HH2      ARG  25  -8.646  -1.911  14.636
  218   1HH2  ARG  25          1HH       ARG  25  -7.985  -4.035  13.741
  219    H    GLU  26           H        GLU  26  -2.908   1.041   9.048
  220    HA   GLU  26           HA       GLU  26  -1.856   2.717  11.003
  221   1HB   GLU  26          1HB       GLU  26  -0.056   1.368  10.750
  222   2HB   GLU  26          2HB       GLU  26  -0.994   0.496   9.553
  223   1HG   GLU  26          1HG       GLU  26   0.995   1.046   8.389
  224   2HG   GLU  26          2HG       GLU  26  -0.140   2.264   7.842
  225    HE2  GLU  26           HE       GLU  26   1.276   3.508  11.037
  226    H    ILE  27           H        ILE  27  -2.663   3.228   7.651
  227    HA   ILE  27           HA       ILE  27  -0.766   5.336   7.237
  228    HB   ILE  27           HB       ILE  27  -2.074   3.672   5.590
  229   1HG1  ILE  27          1HG1      ILE  27  -0.858   6.387   5.132
  230   2HG1  ILE  27          2HG1      ILE  27  -0.179   4.802   4.816
  231   1HG2  ILE  27          1HG2      ILE  27  -3.746   4.965   4.306
  232   2HG2  ILE  27          2HG2      ILE  27  -4.271   4.602   5.968
  233   3HG2  ILE  27          3HG2      ILE  27  -3.691   6.234   5.553
  234   1HD1  ILE  27          1HD1      ILE  27  -2.254   6.327   3.230
  235   2HD1  ILE  27          2HD1      ILE  27  -0.785   5.498   2.659
  236   3HD1  ILE  27          3HD1      ILE  27  -2.213   4.550   3.140
  237    H    LYS  28           H        LYS  28  -1.966   7.488   6.246
  238    HA   LYS  28           HA       LYS  28  -3.585   8.408   8.505
  239   1HB   LYS  28          1HB       LYS  28  -2.843  10.649   7.891
  240   2HB   LYS  28          2HB       LYS  28  -1.477   9.588   8.169
  241   1HG   LYS  28          1HG       LYS  28  -2.314   9.473   5.363
  242   2HG   LYS  28          2HG       LYS  28  -1.998  11.129   5.844
  243   1HD   LYS  28          1HD       LYS  28   0.260  10.672   6.425
  244   2HD   LYS  28          2HD       LYS  28  -0.026   8.951   6.596
  245   1HE   LYS  28          1HE       LYS  28   1.127   9.136   4.522
  246   2HE   LYS  28          2HE       LYS  28  -0.551   8.937   4.054
  247   1HZ   LYS  28          1HZ       LYS  28  -0.222  10.838   2.905
  248   2HZ   LYS  28          2HZ       LYS  28  -0.299  11.635   4.322
  249    H    ASP  29           H        ASP  29  -5.440   7.186   7.512
  250    HA   ASP  29           HA       ASP  29  -6.391   8.241   5.038
  251   1HB   ASP  29          1HB       ASP  29  -7.213   6.116   5.092
  252   2HB   ASP  29          2HB       ASP  29  -6.979   5.986   6.823
  253    HD2  ASP  29           HD       ASP  29  -9.093   7.696   4.677
  254    HA   PRO  30           HA       PRO  30  -9.479   9.959   8.274
  255   1HB   PRO  30          1HB       PRO  30  -8.781   9.919  10.916
  256   2HB   PRO  30          2HB       PRO  30  -9.795   8.699  10.174
  257   1HG   PRO  30          1HG       PRO  30  -6.958   8.510  10.980
  258   2HG   PRO  30          2HG       PRO  30  -8.091   7.217  10.642
  259   1HD   PRO  30          1HD       PRO  30  -5.995   8.154   8.923
  260   2HD   PRO  30          2HD       PRO  30  -7.201   6.942   8.541
  261    H    ARG  31           H        ARG  31  -6.109  10.443   8.499
  262    HA   ARG  31           HA       ARG  31  -6.411  13.068   9.545
  263   1HB   ARG  31          1HB       ARG  31  -3.873  12.251   8.155
  264   2HB   ARG  31          2HB       ARG  31  -4.078  13.081   9.684
  265   1HG   ARG  31          1HG       ARG  31  -5.091  10.796  10.524
  266   2HG   ARG  31          2HG       ARG  31  -4.317  10.110   9.110
  267   1HD   ARG  31          1HD       ARG  31  -2.182  10.413   9.952
  268   2HD   ARG  31          2HD       ARG  31  -2.587  11.926  10.738
  269    HE   ARG  31           HE       ARG  31  -4.016  10.074  12.211
  270   1HH1  ARG  31          2HH2      ARG  31  -0.608  10.312  11.271
  271   2HH1  ARG  31          1HH2      ARG  31  -0.035   9.475  12.675
  272   1HH2  ARG  31          1HH       ARG  31  -1.611   8.694  14.302
  273    H    LEU  32           H        LEU  32  -6.691  11.545   6.460
  274    HA   LEU  32           HA       LEU  32  -6.191  14.099   5.101
  275   1HB   LEU  32          1HB       LEU  32  -5.909  11.240   4.234
  276   2HB   LEU  32          2HB       LEU  32  -6.160  12.507   3.051
  277    HG   LEU  32           HG       LEU  32  -4.096  13.512   3.476
  278   1HD1  LEU  32          1HD1      LEU  32  -3.980  11.971   6.083
  279   2HD1  LEU  32          2HD1      LEU  32  -2.666  12.980   5.432
  280   3HD1  LEU  32          3HD1      LEU  32  -4.222  13.723   5.875
  281   1HD2  LEU  32          1HD2      LEU  32  -2.655  11.911   2.781
  282   2HD2  LEU  32          2HD2      LEU  32  -3.118  10.770   4.067
  283   3HD2  LEU  32          3HD2      LEU  32  -4.156  10.965   2.634
  284    H    GLY  33           H        GLY  33  -8.616  12.854   6.671
  285   1HA   GLY  33          1HA       GLY  33 -10.850  12.547   6.352
  286   2HA   GLY  33          2HA       GLY  33 -10.686  14.113   5.582
  287    H    MET  34           H        MET  34  -9.311  11.002   4.387
  288    HA   MET  34           HA       MET  34 -11.393  10.828   2.415
  289   1HB   MET  34          1HB       MET  34  -8.457  11.421   1.781
  290   2HB   MET  34          2HB       MET  34  -9.516  10.692   0.590
  291   1HG   MET  34          1HG       MET  34 -11.099  12.653   0.857
  292   2HG   MET  34          2HG       MET  34  -9.953  13.392   1.958
  293   1HE   MET  34          1HE       MET  34  -6.795  13.027  -0.015
  294   2HE   MET  34          2HE       MET  34  -7.263  14.696   0.388
  295   3HE   MET  34          3HE       MET  34  -7.597  13.377   1.535
  296    H    MET  35           H        MET  35 -11.308   8.757   1.193
  297    HA   MET  35           HA       MET  35  -9.919   6.768   2.795
  298   1HB   MET  35          1HB       MET  35 -12.570   6.976   1.892
  299   2HB   MET  35          2HB       MET  35 -11.872   5.868   0.728
  300   1HG   MET  35          1HG       MET  35 -10.931   5.071   3.333
  301   2HG   MET  35          2HG       MET  35 -12.658   5.339   3.464
  302   1HE   MET  35          1HE       MET  35 -13.882   3.199   3.518
  303   2HE   MET  35          2HE       MET  35 -13.210   1.678   2.883
  304   3HE   MET  35          3HE       MET  35 -12.302   2.616   4.092
  305    H    THR  36           H        THR  36  -8.272   5.537   1.946
  306    HA   THR  36           HA       THR  36  -7.556   6.069  -0.832
  307    HB   THR  36           HB       THR  36  -5.365   5.391  -0.140
  308    HG1  THR  36           HG1      THR  36  -5.207   4.055   1.821
  309   1HG2  THR  36          1HG2      THR  36  -4.885   6.587   1.890
  310   2HG2  THR  36          2HG2      THR  36  -6.281   7.443   1.191
  311   3HG2  THR  36          3HG2      THR  36  -6.518   6.299   2.535
  312    H    THR  37           H        THR  37  -6.669   4.186  -2.131
  313    HA   THR  37           HA       THR  37  -8.147   1.722  -1.548
  314    HB   THR  37           HB       THR  37  -8.342   3.527  -3.988
  315    HG1  THR  37           HG1      THR  37 -10.054   3.621  -2.459
  316   1HG2  THR  37          1HG2      THR  37  -9.521   1.627  -5.130
  317   2HG2  THR  37          2HG2      THR  37  -7.791   1.276  -4.902
  318   3HG2  THR  37          3HG2      THR  37  -8.998   0.538  -3.822
  319    H    VAL  38           H        VAL  38  -7.379  -0.126  -2.955
  320    HA   VAL  38           HA       VAL  38  -4.538   0.253  -3.595
  321    HB   VAL  38           HB       VAL  38  -5.817  -2.065  -2.130
  322   1HG1  VAL  38          1HG1      VAL  38  -3.931  -3.284  -2.395
  323   2HG1  VAL  38          2HG1      VAL  38  -3.697  -2.252  -3.826
  324   3HG1  VAL  38          3HG1      VAL  38  -2.868  -1.860  -2.300
  325   1HG2  VAL  38          1HG2      VAL  38  -4.986   0.387  -1.112
  326   2HG2  VAL  38          2HG2      VAL  38  -5.214  -1.119  -0.192
  327   3HG2  VAL  38          3HG2      VAL  38  -3.601  -0.690  -0.812
  328    H    SER  39           H        SER  39  -5.287   0.575  -5.814
  329    HA   SER  39           HA       SER  39  -6.602  -1.702  -6.986
  330   1HB   SER  39          1HB       SER  39  -6.571   1.085  -7.505
  331   2HB   SER  39          2HB       SER  39  -5.758   0.360  -8.877
  332    HG   SER  39           HG       SER  39  -8.428   0.391  -8.290
  333    H    GLY  40           H        GLY  40  -3.906  -2.079  -5.910
  334   1HA   GLY  40          1HA       GLY  40  -2.695  -3.422  -8.059
  335   2HA   GLY  40          2HA       GLY  40  -1.895  -1.877  -7.852
  336    H    VAL  41           H        VAL  41  -1.242  -4.896  -7.220
  337    HA   VAL  41           HA       VAL  41   0.181  -4.276  -4.801
  338    HB   VAL  41           HB       VAL  41  -1.861  -4.936  -3.792
  339   1HG1  VAL  41          1HG1      VAL  41  -2.015  -6.790  -6.057
  340   2HG1  VAL  41          2HG1      VAL  41  -2.440  -7.549  -4.504
  341   3HG1  VAL  41          3HG1      VAL  41  -3.310  -6.095  -5.051
  342   1HG2  VAL  41          1HG2      VAL  41  -1.150  -7.325  -2.896
  343   2HG2  VAL  41          2HG2      VAL  41   0.358  -6.951  -3.764
  344   3HG2  VAL  41          3HG2      VAL  41  -0.219  -5.867  -2.476
  345    H    GLU  42           H        GLU  42   2.139  -5.321  -4.802
  346    HA   GLU  42           HA       GLU  42   2.359  -7.688  -6.448
  347   1HB   GLU  42          1HB       GLU  42   4.162  -5.249  -6.779
  348   2HB   GLU  42          2HB       GLU  42   4.427  -6.800  -7.548
  349   1HG   GLU  42          1HG       GLU  42   1.814  -5.277  -7.899
  350   2HG   GLU  42          2HG       GLU  42   3.199  -4.967  -8.927
  351    HE2  GLU  42           HE       GLU  42   3.133  -6.158 -10.698
  352    H    MET  43           H        MET  43   3.570  -9.240  -5.421
  353    HA   MET  43           HA       MET  43   5.445  -8.287  -3.408
  354   1HB   MET  43          1HB       MET  43   4.002 -10.860  -2.852
  355   2HB   MET  43          2HB       MET  43   4.475  -9.598  -1.732
  356   1HG   MET  43          1HG       MET  43   2.140  -9.347  -1.738
  357   2HG   MET  43          2HG       MET  43   2.609  -8.162  -2.941
  358   1HE   MET  43          1HE       MET  43  -0.706 -10.349  -3.528
  359   2HE   MET  43          2HE       MET  43   0.015  -9.077  -2.514
  360   3HE   MET  43          3HE       MET  43  -0.330  -8.757  -4.230
  361    H    SER  44           H        SER  44   7.417  -8.881  -4.227
  362    HA   SER  44           HA       SER  44   7.546 -11.522  -5.452
  363   1HB   SER  44          1HB       SER  44   8.482  -8.975  -6.332
  364   2HB   SER  44          2HB       SER  44   9.914  -9.898  -5.915
  365    HG   SER  44           HG       SER  44   8.462 -11.647  -7.235
  366    H    ARG  45           H        ARG  45   8.267 -13.010  -3.964
  367    HA   ARG  45           HA       ARG  45  10.176 -12.065  -2.004
  368   1HB   ARG  45          1HB       ARG  45   8.287 -14.439  -2.157
  369   2HB   ARG  45          2HB       ARG  45   9.652 -14.496  -1.059
  370   1HG   ARG  45          1HG       ARG  45   8.361 -13.365   0.431
  371   2HG   ARG  45          2HG       ARG  45   8.574 -11.953  -0.583
  372   1HD   ARG  45          1HD       ARG  45   6.167 -12.364  -0.172
  373   2HD   ARG  45          2HD       ARG  45   6.532 -12.541  -1.877
  374    HE   ARG  45           HE       ARG  45   5.962 -14.762   0.029
  375   1HH1  ARG  45          2HH2      ARG  45   6.627 -13.714  -3.289
  376   2HH1  ARG  45          1HH2      ARG  45   6.124 -15.213  -3.996
  377   1HH2  ARG  45          1HH       ARG  45   5.347 -16.978  -2.573
  378    H    ASP  46           H        ASP  46  10.112 -13.511  -5.042
  379    HA   ASP  46           HA       ASP  46  11.727 -15.686  -4.862
  380   1HB   ASP  46          1HB       ASP  46  10.940 -13.731  -6.910
  381   2HB   ASP  46          2HB       ASP  46  12.573 -14.301  -7.186
  382    HD2  ASP  46           HD       ASP  46  10.611 -14.869  -8.930
  383    H    LEU  47           H        LEU  47  12.406 -12.325  -4.217
  384    HA   LEU  47           HA       LEU  47  15.210 -12.974  -3.811
  385   1HB   LEU  47          1HB       LEU  47  14.207 -11.288  -5.956
  386   2HB   LEU  47          2HB       LEU  47  15.285 -10.410  -4.891
  387    HG   LEU  47           HG       LEU  47  16.596 -12.842  -5.352
  388   1HD1  LEU  47          1HD1      LEU  47  16.707 -12.830  -7.887
  389   2HD1  LEU  47          2HD1      LEU  47  15.227 -13.499  -7.161
  390   3HD1  LEU  47          3HD1      LEU  47  15.216 -11.859  -7.853
  391   1HD2  LEU  47          1HD2      LEU  47  16.943 -10.031  -6.382
  392   2HD2  LEU  47          2HD2      LEU  47  17.858 -10.892  -5.120
  393   3HD2  LEU  47          3HD2      LEU  47  18.066 -11.337  -6.831
  394    H    ALA  48           H        ALA  48  13.125  -9.998  -3.838
  395    HA   ALA  48           HA       ALA  48  12.409  -9.783  -1.293
  396   1HB   ALA  48          1HB       ALA  48  14.470  -8.315  -0.430
  397   2HB   ALA  48          2HB       ALA  48  14.421 -10.080  -0.202
  398   3HB   ALA  48          3HB       ALA  48  15.372  -9.381  -1.534
  399    H    TYR  49           H        TYR  49  11.192  -8.818  -3.346
  400    HA   TYR  49           HA       TYR  49  11.403  -5.961  -3.034
  401   1HB   TYR  49          1HB       TYR  49  11.719  -5.634  -5.491
  402   2HB   TYR  49          2HB       TYR  49  13.039  -6.612  -4.879
  403    HD1  TYR  49           HD1      TYR  49   9.997  -6.602  -6.941
  404    HD2  TYR  49           HD2      TYR  49  13.224  -8.985  -5.455
  405    HE1  TYR  49           HE1      TYR  49   9.462  -8.405  -8.652
  406    HE2  TYR  49           HE2      TYR  49  12.680 -10.779  -7.171
  407    HH   TYR  49           HH       TYR  49   9.830 -10.499  -9.230
  408    H    ALA  50           H        ALA  50   9.400  -5.017  -3.194
  409    HA   ALA  50           HA       ALA  50   7.327  -6.497  -4.621
  410   1HB   ALA  50          1HB       ALA  50   7.287  -5.677  -1.698
  411   2HB   ALA  50          2HB       ALA  50   5.802  -6.007  -2.623
  412   3HB   ALA  50          3HB       ALA  50   7.011  -7.292  -2.394
  413    H    LYS  51           H        LYS  51   5.318  -5.066  -4.885
  414    HA   LYS  51           HA       LYS  51   5.920  -2.233  -4.682
  415   1HB   LYS  51          1HB       LYS  51   4.856  -2.805  -7.322
  416   2HB   LYS  51          2HB       LYS  51   6.228  -1.820  -6.853
  417   1HG   LYS  51          1HG       LYS  51   7.624  -3.894  -6.620
  418   2HG   LYS  51          2HG       LYS  51   6.253  -4.865  -7.117
  419   1HD   LYS  51          1HD       LYS  51   7.105  -4.608  -9.224
  420   2HD   LYS  51          2HD       LYS  51   6.326  -3.039  -9.173
  421   1HE   LYS  51          1HE       LYS  51   8.320  -1.926  -9.090
  422   2HE   LYS  51          2HE       LYS  51   8.961  -2.990  -7.853
  423   1HZ   LYS  51          1HZ       LYS  51   8.938  -3.500 -10.774
  424   2HZ   LYS  51          2HZ       LYS  51  10.245  -3.333  -9.818
  425    H    VAL  52           H        VAL  52   4.210  -1.430  -3.597
  426    HA   VAL  52           HA       VAL  52   1.608  -2.683  -4.123
  427    HB   VAL  52           HB       VAL  52   2.593  -2.819  -1.821
  428   1HG1  VAL  52          1HG1      VAL  52   1.991  -0.430  -0.636
  429   2HG1  VAL  52          2HG1      VAL  52   3.625  -0.935  -1.130
  430   3HG1  VAL  52          3HG1      VAL  52   2.656   0.110  -2.197
  431   1HG2  VAL  52          1HG2      VAL  52   0.504  -2.316  -0.685
  432   2HG2  VAL  52          2HG2      VAL  52  -0.009  -1.268  -2.029
  433   3HG2  VAL  52          3HG2      VAL  52   0.164  -3.021  -2.283
  434    H    TYR  53           H        TYR  53  -0.213  -1.348  -4.548
  435    HA   TYR  53           HA       TYR  53   0.537   1.385  -5.338
  436   1HB   TYR  53          1HB       TYR  53  -0.629  -0.852  -6.689
  437   2HB   TYR  53          2HB       TYR  53  -1.995   0.190  -6.344
  438    HD1  TYR  53           HD1      TYR  53  -0.176   2.794  -6.534
  439    HD2  TYR  53           HD2      TYR  53  -0.888  -0.553  -9.101
  440    HE1  TYR  53           HE1      TYR  53   0.401   4.216  -8.561
  441    HE2  TYR  53           HE2      TYR  53  -0.308   0.880 -11.119
  442    HH   TYR  53           HH       TYR  53   1.267   3.801 -10.861
  443    H    VAL  54           H        VAL  54  -0.757   3.125  -4.702
  444    HA   VAL  54           HA       VAL  54  -3.164   2.513  -3.188
  445    HB   VAL  54           HB       VAL  54  -1.703   4.530  -1.783
  446   1HG1  VAL  54          1HG1      VAL  54  -2.667   1.743  -1.064
  447   2HG1  VAL  54          2HG1      VAL  54  -2.007   2.906   0.111
  448   3HG1  VAL  54          3HG1      VAL  54  -3.499   3.291  -0.778
  449   1HG2  VAL  54          1HG2      VAL  54   0.111   3.003  -0.872
  450   2HG2  VAL  54          2HG2      VAL  54  -0.187   1.954  -2.279
  451   3HG2  VAL  54          3HG2      VAL  54   0.372   3.626  -2.519
  452    H    THR  55           H        THR  55  -4.763   3.827  -3.897
  453    HA   THR  55           HA       THR  55  -3.931   6.333  -5.202
  454    HB   THR  55           HB       THR  55  -5.006   5.230  -6.933
  455    HG1  THR  55           HG1      THR  55  -7.322   5.768  -5.226
  456   1HG2  THR  55          1HG2      THR  55  -6.501   3.707  -4.743
  457   2HG2  THR  55          2HG2      THR  55  -6.943   3.592  -6.464
  458   3HG2  THR  55          3HG2      THR  55  -5.338   3.048  -5.918
  459    H    PHE  56           H        PHE  56  -4.623   8.249  -4.434
  460    HA   PHE  56           HA       PHE  56  -6.688   8.111  -2.351
  461   1HB   PHE  56          1HB       PHE  56  -4.370  10.109  -2.587
  462   2HB   PHE  56          2HB       PHE  56  -5.383   9.844  -1.182
  463    HD1  PHE  56           HD1      PHE  56  -4.654   8.429   0.509
  464    HD2  PHE  56           HD2      PHE  56  -2.909   8.088  -3.344
  465    HE1  PHE  56           HE1      PHE  56  -2.976   6.795   1.413
  466    HE2  PHE  56           HE2      PHE  56  -1.231   6.456  -2.440
  467    HZ   PHE  56           HZ       PHE  56  -1.284   5.829  -0.072
  468    H    LEU  57           H        LEU  57  -7.711  10.378  -1.974
  469    HA   LEU  57           HA       LEU  57  -8.226  11.510  -4.627
  470   1HB   LEU  57          1HB       LEU  57 -10.093  10.445  -3.355
  471   2HB   LEU  57          2HB       LEU  57  -9.906  11.677  -2.122
  472    HG   LEU  57           HG       LEU  57 -10.261  13.358  -4.095
  473   1HD1  LEU  57          1HD1      LEU  57 -10.121  11.787  -5.926
  474   2HD1  LEU  57          2HD1      LEU  57 -11.461  10.828  -5.253
  475   3HD1  LEU  57          3HD1      LEU  57 -11.762  12.476  -5.855
  476   1HD2  LEU  57          1HD2      LEU  57 -12.870  12.172  -3.659
  477   2HD2  LEU  57          2HD2      LEU  57 -11.919  12.218  -2.156
  478   3HD2  LEU  57          3HD2      LEU  57 -12.202  13.715  -3.076
  479    H    ASN  58           H        ASN  58  -5.939  12.025  -2.579
  480    HA   ASN  58           HA       ASN  58  -6.316  14.454  -1.392
  481   1HB   ASN  58          1HB       ASN  58  -4.062  12.727  -2.136
  482   2HB   ASN  58          2HB       ASN  58  -3.618  14.412  -2.321
  483   1HD2  ASN  58          1HD2      ASN  58  -5.109  15.637  -0.384
  484   2HD2  ASN  58          2HD2      ASN  58  -4.598  15.143   1.195
  485    H    ASP  59           H        ASP  59  -5.769  13.534  -4.773
  486    HA   ASP  59           HA       ASP  59  -4.604  15.598  -5.926
  487   1HB   ASP  59          1HB       ASP  59  -5.420  13.855  -7.327
  488   2HB   ASP  59          2HB       ASP  59  -7.058  14.011  -6.727
  489    HD2  ASP  59           HD       ASP  59  -4.869  16.331  -8.190
  490    H    LYS  60           H        LYS  60  -7.903  15.485  -4.517
  491    HA   LYS  60           HA       LYS  60  -9.138  17.630  -5.554
  492   1HB   LYS  60          1HB       LYS  60  -9.159  16.244  -2.949
  493   2HB   LYS  60          2HB       LYS  60  -9.772  17.885  -2.896
  494   1HG   LYS  60          1HG       LYS  60 -10.893  16.798  -5.254
  495   2HG   LYS  60          2HG       LYS  60 -10.981  15.489  -4.091
  496   1HD   LYS  60          1HD       LYS  60 -11.922  18.321  -3.453
  497   2HD   LYS  60          2HD       LYS  60 -12.984  17.102  -4.131
  498   1HE   LYS  60          1HE       LYS  60 -12.566  15.614  -2.188
  499   2HE   LYS  60          2HE       LYS  60 -11.424  16.764  -1.524
  500   1HZ   LYS  60          1HZ       LYS  60 -13.581  18.320  -1.834
  501   2HZ   LYS  60          2HZ       LYS  60 -14.323  16.900  -1.544
  502    H    ASP  61           H        ASP  61  -6.498  17.657  -3.100
  503    HA   ASP  61           HA       ASP  61  -6.268  20.506  -3.671
  504   1HB   ASP  61          1HB       ASP  61  -5.303  19.458  -1.031
  505   2HB   ASP  61          2HB       ASP  61  -5.975  21.028  -1.419
  506    HD2  ASP  61           HD       ASP  61  -7.989  18.206   0.242
  507    H    GLU  62           H        GLU  62  -4.251  20.920  -4.588
  508    HA   GLU  62           HA       GLU  62  -2.354  18.882  -4.787
  509   1HB   GLU  62          1HB       GLU  62  -2.828  20.964  -6.320
  510   2HB   GLU  62          2HB       GLU  62  -1.730  21.810  -5.251
  511   1HG   GLU  62          1HG       GLU  62  -0.481  19.308  -5.884
  512   2HG   GLU  62          2HG       GLU  62  -1.106  19.948  -7.391
  513    HE2  GLU  62           HE       GLU  62   2.213  21.430  -6.173
  514    H    ASP  63           H        ASP  63  -3.063  21.200  -2.311
  515    HA   ASP  63           HA       ASP  63  -0.410  21.427  -1.350
  516   1HB   ASP  63          1HB       ASP  63  -2.872  22.714  -0.903
  517   2HB   ASP  63          2HB       ASP  63  -2.571  21.885   0.610
  518    HD2  ASP  63           HD       ASP  63  -1.704  23.195   1.938
  519    H    ALA  64           H        ALA  64  -3.375  19.496  -0.649
  520    HA   ALA  64           HA       ALA  64  -2.179  18.204   1.625
  521   1HB   ALA  64          1HB       ALA  64  -4.301  17.031   1.749
  522   2HB   ALA  64          2HB       ALA  64  -4.623  18.750   1.411
  523   3HB   ALA  64          3HB       ALA  64  -4.731  17.549   0.101
  524    H    VAL  65           H        VAL  65  -2.345  17.785  -1.859
  525    HA   VAL  65           HA       VAL  65  -1.830  14.974  -1.797
  526    HB   VAL  65           HB       VAL  65  -2.874  16.658  -3.609
  527   1HG1  VAL  65          1HG1      VAL  65  -1.378  17.073  -5.443
  528   2HG1  VAL  65          2HG1      VAL  65  -0.634  17.736  -3.968
  529   3HG1  VAL  65          3HG1      VAL  65  -0.058  16.191  -4.638
  530   1HG2  VAL  65          1HG2      VAL  65  -3.359  14.616  -4.370
  531   2HG2  VAL  65          2HG2      VAL  65  -1.784  14.610  -5.200
  532   3HG2  VAL  65          3HG2      VAL  65  -1.933  13.917  -3.566
  533    H    LYS  66           H        LYS  66   0.080  18.006  -2.189
  534    HA   LYS  66           HA       LYS  66   2.508  16.613  -2.665
  535   1HB   LYS  66          1HB       LYS  66   1.827  19.016  -3.330
  536   2HB   LYS  66          2HB       LYS  66   2.267  19.460  -1.694
  537   1HG   LYS  66          1HG       LYS  66   4.549  18.734  -1.994
  538   2HG   LYS  66          2HG       LYS  66   4.163  17.872  -3.470
  539   1HD   LYS  66          1HD       LYS  66   3.527  20.113  -4.520
  540   2HD   LYS  66          2HD       LYS  66   4.127  20.900  -3.073
  541   1HE   LYS  66          1HE       LYS  66   6.343  19.567  -3.505
  542   2HE   LYS  66          2HE       LYS  66   5.700  19.277  -5.109
  543   1HZ   LYS  66          1HZ       LYS  66   5.392  21.795  -5.211
  544   2HZ   LYS  66          2HZ       LYS  66   6.339  21.896  -3.891
  545    H    ALA  67           H        ALA  67   1.188  18.435   0.191
  546    HA   ALA  67           HA       ALA  67   3.288  17.684   1.890
  547   1HB   ALA  67          1HB       ALA  67   1.395  19.539   2.021
  548   2HB   ALA  67          2HB       ALA  67   0.517  18.268   2.906
  549   3HB   ALA  67          3HB       ALA  67   2.091  18.845   3.504
  550    H    GLY  68           H        GLY  68  -0.092  16.402   1.511
  551   1HA   GLY  68          1HA       GLY  68  -0.067  14.415   3.378
  552   2HA   GLY  68          2HA       GLY  68  -0.908  14.328   1.844
  553    H    ILE  69           H        ILE  69   0.784  13.940  -0.133
  554    HA   ILE  69           HA       ILE  69   1.676  11.355   0.130
  555    HB   ILE  69           HB       ILE  69   1.215  12.855  -1.930
  556   1HG1  ILE  69          1HG1      ILE  69   3.424  10.777  -1.916
  557   2HG1  ILE  69          2HG1      ILE  69   1.704  10.453  -2.005
  558   1HG2  ILE  69          1HG2      ILE  69   2.824  14.567  -1.678
  559   2HG2  ILE  69          2HG2      ILE  69   4.143  13.400  -1.423
  560   3HG2  ILE  69          3HG2      ILE  69   3.390  13.554  -3.029
  561   1HD1  ILE  69          1HD1      ILE  69   1.691  11.978  -4.110
  562   2HD1  ILE  69          2HD1      ILE  69   3.464  11.817  -4.074
  563   3HD1  ILE  69          3HD1      ILE  69   2.442  10.371  -4.267
  564    H    LYS  70           H        LYS  70   3.343  14.453   0.786
  565    HA   LYS  70           HA       LYS  70   5.921  13.412   1.000
  566   1HB   LYS  70          1HB       LYS  70   4.606  15.908   1.346
  567   2HB   LYS  70          2HB       LYS  70   5.513  15.606   2.815
  568   1HG   LYS  70          1HG       LYS  70   7.313  16.392   1.653
  569   2HG   LYS  70          2HG       LYS  70   7.340  14.813   0.895
  570   1HD   LYS  70          1HD       LYS  70   5.499  15.965  -0.713
  571   2HD   LYS  70          2HD       LYS  70   6.312  17.426  -0.192
  572   1HE   LYS  70          1HE       LYS  70   8.195  15.265  -0.944
  573   2HE   LYS  70          2HE       LYS  70   7.149  15.749  -2.265
  574   1HZ   LYS  70          1HZ       LYS  70   8.724  17.673  -0.638
  575   2HZ   LYS  70          2HZ       LYS  70   9.202  17.109  -2.090
  576    H    ALA  71           H        ALA  71   3.149  13.502   3.252
  577    HA   ALA  71           HA       ALA  71   4.679  12.697   5.508
  578   1HB   ALA  71          1HB       ALA  71   1.713  12.239   5.211
  579   2HB   ALA  71          2HB       ALA  71   2.640  12.767   6.636
  580   3HB   ALA  71          3HB       ALA  71   2.345  13.901   5.295
  581    H    LEU  72           H        LEU  72   2.833  11.064   2.904
  582    HA   LEU  72           HA       LEU  72   2.990   8.505   4.142
  583   1HB   LEU  72          1HB       LEU  72   1.266   9.354   2.482
  584   2HB   LEU  72          2HB       LEU  72   2.476   9.122   1.237
  585    HG   LEU  72           HG       LEU  72   2.610   6.701   1.918
  586   1HD1  LEU  72          1HD1      LEU  72   0.017   7.162   3.389
  587   2HD1  LEU  72          2HD1      LEU  72   1.050   5.712   3.361
  588   3HD1  LEU  72          3HD1      LEU  72   1.592   7.175   4.218
  589   1HD2  LEU  72          1HD2      LEU  72   1.393   7.335  -0.059
  590   2HD2  LEU  72          2HD2      LEU  72   0.481   6.074   0.805
  591   3HD2  LEU  72          3HD2      LEU  72  -0.036   7.774   0.909
  592    H    GLN  73           H        GLN  73   5.125  10.522   2.222
  593    HA   GLN  73           HA       GLN  73   6.669   8.361   1.245
  594   1HB   GLN  73          1HB       GLN  73   6.569  11.248   0.948
  595   2HB   GLN  73          2HB       GLN  73   8.222  10.759   1.265
  596   1HG   GLN  73          1HG       GLN  73   8.038   9.039  -0.571
  597   2HG   GLN  73          2HG       GLN  73   6.413   9.600  -0.909
  598   1HE2  GLN  73          1HE2      GLN  73   7.834   9.729  -2.999
  599   2HE2  GLN  73          2HE2      GLN  73   8.456  11.301  -3.378
  600    H    GLU  74           H        GLU  74   6.917  10.714   3.975
  601    HA   GLU  74           HA       GLU  74   9.425   9.781   4.805
  602   1HB   GLU  74          1HB       GLU  74   9.077  11.175   6.761
  603   2HB   GLU  74          2HB       GLU  74   8.449  12.029   5.365
  604   1HG   GLU  74          1HG       GLU  74   6.154  11.431   5.926
  605   2HG   GLU  74          2HG       GLU  74   6.685  10.312   7.166
  606    HE2  GLU  74           HE       GLU  74   5.446  12.884   8.799
  607    H    ALA  75           H        ALA  75   6.056   8.822   5.452
  608    HA   ALA  75           HA       ALA  75   6.848   7.085   7.623
  609   1HB   ALA  75          1HB       ALA  75   4.670   7.245   8.179
  610   2HB   ALA  75          2HB       ALA  75   4.517   8.448   6.876
  611   3HB   ALA  75          3HB       ALA  75   4.148   6.737   6.555
  612    H    SER  76           H        SER  76   7.585   6.928   4.509
  613    HA   SER  76           HA       SER  76   6.436   4.674   3.487
  614   1HB   SER  76          1HB       SER  76   7.849   6.129   2.140
  615   2HB   SER  76          2HB       SER  76   9.247   5.798   3.145
  616    HG   SER  76           HG       SER  76   9.561   3.879   2.173
  617    H    GLY  77           H        GLY  77   9.834   4.745   4.787
  618   1HA   GLY  77          1HA       GLY  77  10.160   2.037   5.110
  619   2HA   GLY  77          2HA       GLY  77  10.981   3.273   6.043
  620    H    PHE  78           H        PHE  78   8.107   4.225   6.933
  621    HA   PHE  78           HA       PHE  78   8.128   2.709   9.340
  622   1HB   PHE  78          1HB       PHE  78   6.976   5.140   8.151
  623   2HB   PHE  78          2HB       PHE  78   5.714   4.253   8.982
  624    HD1  PHE  78           HD1      PHE  78   7.680   6.905   9.449
  625    HD2  PHE  78           HD2      PHE  78   6.927   3.179  11.335
  626    HE1  PHE  78           HE1      PHE  78   8.450   7.858  11.638
  627    HE2  PHE  78           HE2      PHE  78   7.697   4.132  13.525
  628    HZ   PHE  78           HZ       PHE  78   8.449   6.460  13.651
  629    H    ILE  79           H        ILE  79   5.987   2.944   6.440
  630    HA   ILE  79           HA       ILE  79   4.067   1.143   7.504
  631    HB   ILE  79           HB       ILE  79   3.273   1.136   5.106
  632   1HG1  ILE  79          1HG1      ILE  79   5.278   3.361   4.703
  633   2HG1  ILE  79          2HG1      ILE  79   5.616   1.708   4.226
  634   1HG2  ILE  79          1HG2      ILE  79   1.948   2.705   5.939
  635   2HG2  ILE  79          2HG2      ILE  79   3.191   3.171   7.125
  636   3HG2  ILE  79          3HG2      ILE  79   3.164   3.934   5.517
  637   1HD1  ILE  79          1HD1      ILE  79   4.572   2.223   2.271
  638   2HD1  ILE  79          2HD1      ILE  79   3.054   2.121   3.194
  639   3HD1  ILE  79          3HD1      ILE  79   3.847   3.696   2.958
  640    H    ARG  80           H        ARG  80   6.980   0.883   5.424
  641    HA   ARG  80           HA       ARG  80   6.504  -1.754   4.683
  642   1HB   ARG  80          1HB       ARG  80   8.090  -0.545   3.371
  643   2HB   ARG  80          2HB       ARG  80   8.962   0.028   4.779
  644   1HG   ARG  80          1HG       ARG  80   9.780  -2.273   5.240
  645   2HG   ARG  80          2HG       ARG  80   8.856  -2.892   3.886
  646   1HD   ARG  80          1HD       ARG  80  10.746  -2.544   2.651
  647   2HD   ARG  80          2HD       ARG  80  10.301  -0.849   2.679
  648    HE   ARG  80           HE       ARG  80  11.749  -1.558   5.084
  649   1HH1  ARG  80          2HH2      ARG  80  12.222  -0.838   1.647
  650   2HH1  ARG  80          1HH2      ARG  80  13.852  -0.292   1.857
  651   1HH2  ARG  80          1HH       ARG  80  14.818  -0.299   4.050
  652    H    SER  81           H        SER  81   8.453  -0.227   7.330
  653    HA   SER  81           HA       SER  81   9.391  -2.693   8.297
  654   1HB   SER  81          1HB       SER  81  10.529  -0.497   8.672
  655   2HB   SER  81          2HB       SER  81   9.199   0.013   9.693
  656    HG   SER  81           HG       SER  81  10.834  -0.786  11.049
  657    H    LEU  82           H        LEU  82   6.587  -0.566   8.978
  658    HA   LEU  82           HA       LEU  82   5.799  -1.826  11.361
  659   1HB   LEU  82          1HB       LEU  82   5.083   0.397  10.748
  660   2HB   LEU  82          2HB       LEU  82   4.266  -0.211   9.322
  661    HG   LEU  82           HG       LEU  82   3.187  -1.629  11.530
  662   1HD1  LEU  82          1HD1      LEU  82   2.910   1.316  12.072
  663   2HD1  LEU  82          2HD1      LEU  82   2.556  -0.072  13.129
  664   3HD1  LEU  82          3HD1      LEU  82   4.244   0.378  12.787
  665   1HD2  LEU  82          1HD2      LEU  82   1.168  -0.957  10.667
  666   2HD2  LEU  82          2HD2      LEU  82   1.757   0.671  10.252
  667   3HD2  LEU  82          3HD2      LEU  82   2.229  -0.726   9.255
  668    H    LEU  83           H        LEU  83   5.346  -2.561   7.906
  669    HA   LEU  83           HA       LEU  83   3.271  -4.447   8.334
  670   1HB   LEU  83          1HB       LEU  83   5.128  -3.839   6.042
  671   2HB   LEU  83          2HB       LEU  83   3.971  -5.153   5.980
  672    HG   LEU  83           HG       LEU  83   3.019  -2.387   6.663
  673   1HD1  LEU  83          1HD1      LEU  83   3.476  -3.369   3.832
  674   2HD1  LEU  83          2HD1      LEU  83   2.731  -1.829   4.325
  675   3HD1  LEU  83          3HD1      LEU  83   4.451  -2.136   4.666
  676   1HD2  LEU  83          1HD2      LEU  83   1.133  -3.474   5.078
  677   2HD2  LEU  83          2HD2      LEU  83   1.845  -4.956   5.759
  678   3HD2  LEU  83          3HD2      LEU  83   1.192  -3.702   6.842
  679    H    GLY  84           H        GLY  84   6.778  -4.855   7.447
  680   1HA   GLY  84          1HA       GLY  84   7.017  -7.544   7.633
  681   2HA   GLY  84          2HA       GLY  84   8.265  -6.415   8.123
  682    H    LYS  85           H        LYS  85   7.095  -5.179  10.386
  683    HA   LYS  85           HA       LYS  85   7.488  -7.254  12.301
  684   1HB   LYS  85          1HB       LYS  85   7.335  -4.318  12.257
  685   2HB   LYS  85          2HB       LYS  85   6.634  -5.031  13.695
  686   1HG   LYS  85          1HG       LYS  85   8.805  -6.490  13.796
  687   2HG   LYS  85          2HG       LYS  85   9.468  -5.352  12.640
  688   1HD   LYS  85          1HD       LYS  85   8.132  -4.241  15.107
  689   2HD   LYS  85          2HD       LYS  85   9.714  -4.972  15.291
  690   1HE   LYS  85          1HE       LYS  85   9.985  -3.355  12.996
  691   2HE   LYS  85          2HE       LYS  85   8.983  -2.395  14.067
  692   1HZ   LYS  85          1HZ       LYS  85  10.961  -1.869  15.009
  693   2HZ   LYS  85          2HZ       LYS  85  10.882  -3.315  15.753
  694    H    ALA  86           H        ALA  86   4.712  -5.382  11.001
  695    HA   ALA  86           HA       ALA  86   2.827  -6.247  12.865
  696   1HB   ALA  86          1HB       ALA  86   1.229  -5.698  10.922
  697   2HB   ALA  86          2HB       ALA  86   2.303  -4.392  11.477
  698   3HB   ALA  86          3HB       ALA  86   2.690  -5.290   9.990
  699    H    MET  87           H        MET  87   4.273  -7.777   9.991
  700    HA   MET  87           HA       MET  87   2.490 -10.042  10.449
  701   1HB   MET  87          1HB       MET  87   4.177  -9.506   7.953
  702   2HB   MET  87          2HB       MET  87   2.815 -10.599   8.095
  703   1HG   MET  87          1HG       MET  87   1.357  -8.939   7.565
  704   2HG   MET  87          2HG       MET  87   1.952  -7.938   8.874
  705   1HE   MET  87          1HE       MET  87   0.933  -7.117   5.830
  706   2HE   MET  87          2HE       MET  87   2.252  -6.914   4.652
  707   3HE   MET  87          3HE       MET  87   1.759  -8.547   5.163
  708    H    ARG  88           H        ARG  88   5.247  -9.115  11.666
  709    HA   ARG  88           HA       ARG  88   7.338  -9.939  11.807
  710   1HB   ARG  88          1HB       ARG  88   5.349 -11.915  12.972
  711   2HB   ARG  88          2HB       ARG  88   7.065 -12.235  13.125
  712   1HG   ARG  88          1HG       ARG  88   7.254  -9.801  14.050
  713   2HG   ARG  88          2HG       ARG  88   5.510  -9.850  14.200
  714   1HD   ARG  88          1HD       ARG  88   5.659 -11.848  15.666
  715   2HD   ARG  88          2HD       ARG  88   7.397 -11.900  15.458
  716    HE   ARG  88           HE       ARG  88   6.642  -9.295  16.410
  717   1HH1  ARG  88          2HH2      ARG  88   6.913 -12.644  17.535
  718   2HH1  ARG  88          1HH2      ARG  88   7.175 -12.199  19.187
  719   1HH2  ARG  88          1HH       ARG  88   7.216  -9.879  19.786
  720    H    LEU  89           H        LEU  89   7.882 -10.246   9.481
  721    HA   LEU  89           HA       LEU  89   7.886 -13.094   8.756
  722   1HB   LEU  89          1HB       LEU  89   6.578 -11.086   7.433
  723   2HB   LEU  89          2HB       LEU  89   8.107 -11.135   6.578
  724    HG   LEU  89           HG       LEU  89   7.775 -13.577   6.189
  725   1HD1  LEU  89          1HD1      LEU  89   5.536 -14.545   6.535
  726   2HD1  LEU  89          2HD1      LEU  89   6.328 -14.100   8.066
  727   3HD1  LEU  89          3HD1      LEU  89   5.041 -13.069   7.397
  728   1HD2  LEU  89          1HD2      LEU  89   6.973 -11.580   4.681
  729   2HD2  LEU  89          2HD2      LEU  89   6.530 -13.259   4.287
  730   3HD2  LEU  89          3HD2      LEU  89   5.354 -12.195   5.093
  731    H    ARG  90           H        ARG  90   9.623 -12.354   6.392
  732    HA   ARG  90           HA       ARG  90  11.982 -11.401   7.725
  733   1HB   ARG  90          1HB       ARG  90  13.296 -13.420   6.800
  734   2HB   ARG  90          2HB       ARG  90  12.270 -13.742   8.184
  735   1HG   ARG  90          1HG       ARG  90  10.437 -14.311   6.344
  736   2HG   ARG  90          2HG       ARG  90  11.820 -14.485   5.281
  737   1HD   ARG  90          1HD       ARG  90  12.633 -15.907   7.542
  738   2HD   ARG  90          2HD       ARG  90  10.913 -16.242   7.493
  739    HE   ARG  90           HE       ARG  90  12.915 -17.187   5.602
  740   1HH1  ARG  90          2HH2      ARG  90   9.488 -16.349   5.923
  741   2HH1  ARG  90          1HH2      ARG  90   8.989 -17.362   4.610
  742   1HH2  ARG  90          1HH       ARG  90  10.635 -18.631   3.416
  743    H    ILE  91           H        ILE  91  10.440 -12.787   4.761
  744    HA   ILE  91           HA       ILE  91  12.163 -12.221   2.816
  745    HB   ILE  91           HB       ILE  91  10.065 -11.512   1.480
  746   1HG1  ILE  91          1HG1      ILE  91   8.365 -12.762   3.518
  747   2HG1  ILE  91          2HG1      ILE  91   8.993 -11.204   4.014
  748   1HG2  ILE  91          1HG2      ILE  91  11.072 -14.024   2.429
  749   2HG2  ILE  91          2HG2      ILE  91   9.300 -14.114   2.284
  750   3HG2  ILE  91          3HG2      ILE  91  10.284 -13.634   0.881
  751   1HD1  ILE  91          1HD1      ILE  91   7.704 -10.075   2.511
  752   2HD1  ILE  91          2HD1      ILE  91   8.079 -11.223   1.202
  753   3HD1  ILE  91          3HD1      ILE  91   6.788 -11.594   2.371
  754    H    VAL  92           H        VAL  92  10.316  -9.834   4.735
  755    HA   VAL  92           HA       VAL  92  10.157  -7.574   4.348
  756    HB   VAL  92           HB       VAL  92  13.058  -8.099   5.026
  757   1HG1  VAL  92          1HG1      VAL  92  12.510  -5.872   6.385
  758   2HG1  VAL  92          2HG1      VAL  92  13.094  -5.832   4.704
  759   3HG1  VAL  92          3HG1      VAL  92  11.359  -5.641   5.049
  760   1HG2  VAL  92          1HG2      VAL  92  12.469  -8.563   7.172
  761   2HG2  VAL  92          2HG2      VAL  92  11.059  -7.478   7.138
  762   3HG2  VAL  92          3HG2      VAL  92  10.957  -9.092   6.396
  763    HA   PRO  93           HA       PRO  93  12.014  -7.496   0.170
  764   1HB   PRO  93          1HB       PRO  93   9.727  -7.511  -1.325
  765   2HB   PRO  93          2HB       PRO  93  10.658  -8.956  -0.984
  766   1HG   PRO  93          1HG       PRO  93   8.087  -8.089   0.189
  767   2HG   PRO  93          2HG       PRO  93   8.810  -9.684   0.187
  768   1HD   PRO  93          1HD       PRO  93   8.728  -7.840   2.382
  769   2HD   PRO  93          2HD       PRO  93   9.552  -9.387   2.343
  770    H    GLU  94           H        GLU  94  12.148  -5.766  -1.387
  771    HA   GLU  94           HA       GLU  94  11.662  -3.346  -0.076
  772   1HB   GLU  94          1HB       GLU  94  13.234  -4.212  -2.207
  773   2HB   GLU  94          2HB       GLU  94  12.061  -3.182  -3.003
  774   1HG   GLU  94          1HG       GLU  94  12.600  -1.310  -1.500
  775   2HG   GLU  94          2HG       GLU  94  13.649  -2.330  -0.537
  776    HE2  GLU  94           HE       GLU  94  15.017  -0.431  -1.338
  777    H    LEU  95           H        LEU  95   9.249  -3.939   0.306
  778    HA   LEU  95           HA       LEU  95   7.510  -3.723  -1.935
  779   1HB   LEU  95          1HB       LEU  95   7.285  -4.814   0.495
  780   2HB   LEU  95          2HB       LEU  95   6.553  -3.260   0.841
  781    HG   LEU  95           HG       LEU  95   5.466  -4.340  -1.615
  782   1HD1  LEU  95          1HD1      LEU  95   4.680  -6.410  -1.069
  783   2HD1  LEU  95          2HD1      LEU  95   6.224  -6.443  -0.183
  784   3HD1  LEU  95          3HD1      LEU  95   4.708  -6.089   0.681
  785   1HD2  LEU  95          1HD2      LEU  95   3.334  -4.033  -0.400
  786   2HD2  LEU  95          2HD2      LEU  95   4.253  -3.673   1.081
  787   3HD2  LEU  95          3HD2      LEU  95   4.386  -2.599  -0.333
  788    H    THR  96           H        THR  96   8.002  -1.795  -3.045
  789    HA   THR  96           HA       THR  96   8.191   0.693  -1.691
  790    HB   THR  96           HB       THR  96   9.195  -0.010  -3.961
  791    HG1  THR  96           HG1      THR  96   7.392   2.298  -3.963
  792   1HG2  THR  96          1HG2      THR  96   7.749  -0.608  -5.626
  793   2HG2  THR  96          2HG2      THR  96   6.352  -0.250  -4.582
  794   3HG2  THR  96          3HG2      THR  96   7.081   1.040  -5.569
  795    H    PHE  97           H        PHE  97   6.730   2.572  -2.084
  796    HA   PHE  97           HA       PHE  97   3.949   1.628  -2.037
  797   1HB   PHE  97          1HB       PHE  97   5.519   2.955  -0.092
  798   2HB   PHE  97          2HB       PHE  97   4.658   4.279  -0.853
  799    HD1  PHE  97           HD1      PHE  97   3.684   0.795   0.105
  800    HD2  PHE  97           HD2      PHE  97   2.883   4.950   0.443
  801    HE1  PHE  97           HE1      PHE  97   1.667   0.292   1.510
  802    HE2  PHE  97           HE2      PHE  97   0.865   4.446   1.848
  803    HZ   PHE  97           HZ       PHE  97   0.281   2.123   2.366
  804    H    PHE  98           H        PHE  98   3.153   2.056  -4.068
  805    HA   PHE  98           HA       PHE  98   3.960   4.527  -5.358
  806   1HB   PHE  98          1HB       PHE  98   2.976   1.834  -6.035
  807   2HB   PHE  98          2HB       PHE  98   1.965   3.035  -6.812
  808    HD1  PHE  98           HD1      PHE  98   4.574   0.979  -7.443
  809    HD2  PHE  98           HD2      PHE  98   3.609   5.100  -7.750
  810    HE1  PHE  98           HE1      PHE  98   6.286   1.246  -9.259
  811    HE2  PHE  98           HE2      PHE  98   5.320   5.367  -9.565
  812    HZ   PHE  98           HZ       PHE  98   6.639   3.437 -10.299
  813    H    TYR  99           H        TYR  99   2.770   6.366  -5.212
  814    HA   TYR  99           HA       TYR  99   0.022   6.099  -4.236
  815   1HB   TYR  99          1HB       TYR  99   1.246   8.788  -4.577
  816   2HB   TYR  99          2HB       TYR  99   0.576   8.081  -3.121
  817    HD1  TYR  99           HD1      TYR  99   2.026   6.517  -1.732
  818    HD2  TYR  99           HD2      TYR  99   3.596   8.898  -4.921
  819    HE1  TYR  99           HE1      TYR  99   4.373   6.230  -0.801
  820    HE2  TYR  99           HE2      TYR  99   5.938   8.603  -3.978
  821    HH   TYR  99           HH       TYR  99   6.512   7.512  -0.890
  822    H    ASP 100           H        ASP 100  -1.358   5.832  -5.958
  823    HA   ASP 100           HA       ASP 100  -0.877   7.550  -8.251
  824   1HB   ASP 100          1HB       ASP 100  -1.415   4.866  -8.155
  825   2HB   ASP 100          2HB       ASP 100  -3.049   5.485  -8.285
  826    HD2  ASP 100           HD       ASP 100  -0.881   7.415 -10.414
  827    H    ASN 101           H        ASN 101  -1.828   9.508  -7.333
  828    HA   ASN 101           HA       ASN 101  -4.532   9.281  -6.367
  829   1HB   ASN 101          1HB       ASN 101  -3.110  11.933  -6.687
  830   2HB   ASN 101          2HB       ASN 101  -4.210  11.423  -5.420
  831   1HD2  ASN 101          1HD2      ASN 101  -1.495  12.601  -5.368
  832   2HD2  ASN 101          2HD2      ASN 101  -0.517  11.551  -4.397
  833    H    SER 102           H        SER 102  -5.615  11.770  -7.154
  834    HA   SER 102           HA       SER 102  -5.959  11.286  -9.972
  835   1HB   SER 102          1HB       SER 102  -7.555  13.491  -9.031
  836   2HB   SER 102          2HB       SER 102  -8.088  11.905  -9.548
  837    HG   SER 102           HG       SER 102  -7.553  11.144  -7.333
  838    H    LEU 103           H        LEU 103  -3.546  12.682  -8.527
  839    HA   LEU 103           HA       LEU 103  -3.720  15.272  -9.878
  840   1HB   LEU 103          1HB       LEU 103  -3.206  15.260  -7.479
  841   2HB   LEU 103          2HB       LEU 103  -1.798  14.261  -7.778
  842    HG   LEU 103           HG       LEU 103  -1.414  16.443  -9.466
  843   1HD1  LEU 103          1HD1      LEU 103  -3.237  17.237  -7.403
  844   2HD1  LEU 103          2HD1      LEU 103  -1.674  18.050  -7.150
  845   3HD1  LEU 103          3HD1      LEU 103  -2.518  18.209  -8.709
  846   1HD2  LEU 103          1HD2      LEU 103   0.431  15.510  -8.394
  847   2HD2  LEU 103          2HD2      LEU 103   0.267  17.107  -7.627
  848   3HD2  LEU 103          3HD2      LEU 103  -0.307  15.651  -6.780
  849    H    VAL 104           H        VAL 104  -2.948  12.182 -10.654
  850    HA   VAL 104           HA       VAL 104  -0.833  13.101 -12.463
  851    HB   VAL 104           HB       VAL 104  -0.752  10.967 -10.435
  852   1HG1  VAL 104          1HG1      VAL 104   0.312  10.455 -13.234
  853   2HG1  VAL 104          2HG1      VAL 104   0.659   9.467 -11.795
  854   3HG1  VAL 104          3HG1      VAL 104  -1.003   9.569 -12.425
  855   1HG2  VAL 104          1HG2      VAL 104   1.546  12.182 -11.975
  856   2HG2  VAL 104          2HG2      VAL 104   0.725  13.061 -10.663
  857   3HG2  VAL 104          3HG2      VAL 104   1.533  11.511 -10.326
  858    H    GLU 105           H        GLU 105  -3.954  12.154 -12.148
  859    HA   GLU 105           HA       GLU 105  -3.949  11.126 -14.827
  860   1HB   GLU 105          1HB       GLU 105  -5.156   9.548 -12.513
  861   2HB   GLU 105          2HB       GLU 105  -5.445   9.194 -14.205
  862   1HG   GLU 105          1HG       GLU 105  -2.786   9.164 -14.355
  863   2HG   GLU 105          2HG       GLU 105  -2.879   8.913 -12.624
  864    HE2  GLU 105           HE       GLU 105  -3.712   7.479 -15.663
  865    H    GLY 106           H        GLY 106  -5.686  12.196 -11.877
  866   1HA   GLY 106          1HA       GLY 106  -7.347  13.760 -11.757
  867   2HA   GLY 106          2HA       GLY 106  -7.485  13.774 -13.503
  868    H    MET 107           H        MET 107  -7.448  10.536 -12.842
  869    HA   MET 107           HA       MET 107 -10.329  10.489 -12.371
  870   1HB   MET 107          1HB       MET 107  -8.676   8.645 -14.186
  871   2HB   MET 107          2HB       MET 107 -10.411   8.549 -13.961
  872   1HG   MET 107          1HG       MET 107 -10.817  10.290 -15.398
  873   2HG   MET 107          2HG       MET 107  -9.514  11.261 -14.742
  874   1HE   MET 107          1HE       MET 107  -6.865   8.637 -15.691
  875   2HE   MET 107          2HE       MET 107  -6.421  10.269 -16.246
  876   3HE   MET 107          3HE       MET 107  -7.237  10.053 -14.678
  877    H    ARG 108           H        ARG 108  -7.976  10.211 -10.498
  878    HA   ARG 108           HA       ARG 108  -8.340   7.417  -9.791
  879   1HB   ARG 108          1HB       ARG 108  -6.047   9.249  -9.737
  880   2HB   ARG 108          2HB       ARG 108  -6.304   8.543  -8.154
  881   1HG   ARG 108          1HG       ARG 108  -4.896   6.967  -9.219
  882   2HG   ARG 108          2HG       ARG 108  -6.488   6.256  -9.397
  883   1HD   ARG 108          1HD       ARG 108  -6.488   7.687 -11.682
  884   2HD   ARG 108          2HD       ARG 108  -4.750   7.572 -11.486
  885    HE   ARG 108           HE       ARG 108  -5.491   4.973 -11.099
  886   1HH1  ARG 108          2HH2      ARG 108  -6.392   7.298 -13.617
  887   2HH1  ARG 108          1HH2      ARG 108  -6.638   6.082 -14.825
  888   1HH2  ARG 108          1HH       ARG 108  -6.293   3.779 -14.260
  Start of MODEL    2
    1    H    MET   1           H        MET   1 -15.074 -12.860   0.177
    2    HA   MET   1           HA       MET   1 -14.642 -11.857  -1.820
    3   1HB   MET   1          1HB       MET   1 -14.258  -9.929   0.515
    4   2HB   MET   1          2HB       MET   1 -14.254  -9.320  -1.129
    5   1HG   MET   1          1HG       MET   1 -16.524  -9.273  -1.046
    6   2HG   MET   1          2HG       MET   1 -16.511 -11.024  -1.027
    7   1HE   MET   1          1HE       MET   1 -15.674  -8.028   0.901
    8   2HE   MET   1          2HE       MET   1 -16.825  -8.009   2.260
    9   3HE   MET   1          3HE       MET   1 -15.246  -8.810   2.443
   10    H    ALA   2           H        ALA   2 -12.394 -13.299  -1.750
   11    HA   ALA   2           HA       ALA   2 -10.416 -11.423  -2.711
   12   1HB   ALA   2          1HB       ALA   2  -9.976 -11.667  -0.248
   13   2HB   ALA   2          2HB       ALA   2  -9.739 -13.412  -0.510
   14   3HB   ALA   2          3HB       ALA   2  -8.640 -12.240  -1.275
   15    H    LYS   3           H        LYS   3  -8.657 -14.097  -2.118
   16    HA   LYS   3           HA       LYS   3  -9.830 -15.788  -4.156
   17   1HB   LYS   3          1HB       LYS   3  -8.027 -13.847  -4.951
   18   2HB   LYS   3          2HB       LYS   3  -7.001 -15.250  -4.727
   19   1HG   LYS   3          1HG       LYS   3  -9.623 -15.569  -6.208
   20   2HG   LYS   3          2HG       LYS   3  -8.258 -14.852  -7.041
   21   1HD   LYS   3          1HD       LYS   3  -7.135 -16.843  -7.186
   22   2HD   LYS   3          2HD       LYS   3  -7.532 -17.299  -5.541
   23   1HE   LYS   3          1HE       LYS   3  -8.647 -18.889  -6.973
   24   2HE   LYS   3          2HE       LYS   3  -9.897 -17.837  -6.338
   25   1HZ   LYS   3          1HZ       LYS   3  -9.231 -16.525  -8.573
   26   2HZ   LYS   3          2HZ       LYS   3  -8.916 -18.044  -9.064
   27    H    GLU   4           H        GLU   4 -10.112 -17.268  -2.409
   28    HA   GLU   4           HA       GLU   4  -7.726 -18.036  -0.999
   29   1HB   GLU   4          1HB       GLU   4  -9.391 -19.639   0.155
   30   2HB   GLU   4          2HB       GLU   4  -9.627 -17.921   0.414
   31   1HG   GLU   4          1HG       GLU   4 -11.555 -17.834  -0.899
   32   2HG   GLU   4          2HG       GLU   4 -11.035 -19.139  -1.949
   33    HE2  GLU   4           HE       GLU   4 -13.426 -19.681   1.025
   34    H    PHE   5           H        PHE   5  -6.450 -18.995  -2.682
   35    HA   PHE   5           HA       PHE   5  -7.348 -21.679  -3.342
   36   1HB   PHE   5          1HB       PHE   5  -7.757 -19.708  -5.151
   37   2HB   PHE   5          2HB       PHE   5  -6.035 -19.884  -5.428
   38    HD1  PHE   5           HD1      PHE   5  -5.959 -20.798  -7.578
   39    HD2  PHE   5           HD2      PHE   5  -8.488 -22.571  -4.668
   40    HE1  PHE   5           HE1      PHE   5  -6.407 -22.717  -9.134
   41    HE2  PHE   5           HE2      PHE   5  -8.935 -24.489  -6.224
   42    HZ   PHE   5           HZ       PHE   5  -7.890 -24.538  -8.439
   43    H    GLY   6           H        GLY   6  -5.681 -23.178  -3.347
   44   1HA   GLY   6          1HA       GLY   6  -3.385 -22.840  -2.007
   45   2HA   GLY   6          2HA       GLY   6  -3.557 -23.976  -3.330
   46    H    ARG   7           H        ARG   7  -4.084 -21.650  -5.277
   47    HA   ARG   7           HA       ARG   7  -1.534 -21.450  -6.232
   48   1HB   ARG   7          1HB       ARG   7  -4.168 -20.386  -6.874
   49   2HB   ARG   7          2HB       ARG   7  -2.976 -19.122  -7.098
   50   1HG   ARG   7          1HG       ARG   7  -3.160 -20.334  -9.194
   51   2HG   ARG   7          2HG       ARG   7  -1.600 -20.721  -8.496
   52   1HD   ARG   7          1HD       ARG   7  -3.232 -22.685  -7.380
   53   2HD   ARG   7          2HD       ARG   7  -3.943 -22.485  -8.969
   54    HE   ARG   7           HE       ARG   7  -1.225 -23.477  -8.370
   55   1HH1  ARG   7          2HH2      ARG   7  -3.474 -22.334 -10.859
   56   2HH1  ARG   7          1HH2      ARG   7  -2.587 -23.048 -12.163
   57   1HH2  ARG   7          1HH       ARG   7  -0.580 -24.269 -11.691
   58    HA   PRO   8           HA       PRO   8   0.180 -17.916  -4.303
   59   1HB   PRO   8          1HB       PRO   8   1.103 -16.271  -6.281
   60   2HB   PRO   8          2HB       PRO   8   1.941 -17.725  -5.773
   61   1HG   PRO   8          1HG       PRO   8   0.343 -17.263  -8.218
   62   2HG   PRO   8          2HG       PRO   8   1.515 -18.525  -7.895
   63   1HD   PRO   8          1HD       PRO   8  -1.341 -18.790  -7.873
   64   2HD   PRO   8          2HD       PRO   8  -0.170 -20.019  -7.437
   65    H    GLN   9           H        GLN   9  -2.705 -17.662  -5.661
   66    HA   GLN   9           HA       GLN   9  -2.957 -14.836  -5.539
   67   1HB   GLN   9          1HB       GLN   9  -4.408 -16.961  -6.683
   68   2HB   GLN   9          2HB       GLN   9  -5.476 -16.341  -5.440
   69   1HG   GLN   9          1HG       GLN   9  -6.037 -14.951  -7.238
   70   2HG   GLN   9          2HG       GLN   9  -4.836 -13.968  -6.423
   71   1HE2  GLN   9          1HE2      GLN   9  -3.516 -13.026  -7.762
   72   2HE2  GLN   9          2HE2      GLN   9  -2.854 -13.673  -9.226
   73    H    ARG  10           H        ARG  10  -3.639 -17.644  -3.423
   74    HA   ARG  10           HA       ARG  10  -5.237 -16.336  -1.608
   75   1HB   ARG  10          1HB       ARG  10  -4.770 -18.846  -1.777
   76   2HB   ARG  10          2HB       ARG  10  -3.228 -18.560  -0.993
   77   1HG   ARG  10          1HG       ARG  10  -5.671 -17.438   0.358
   78   2HG   ARG  10          2HG       ARG  10  -5.478 -19.179   0.390
   79   1HD   ARG  10          1HD       ARG  10  -3.138 -17.396   1.136
   80   2HD   ARG  10          2HD       ARG  10  -4.398 -17.710   2.311
   81    HE   ARG  10           HE       ARG  10  -2.411 -19.625   1.324
   82   1HH1  ARG  10          2HH2      ARG  10  -5.581 -19.289   2.868
   83   2HH1  ARG  10          1HH2      ARG  10  -5.537 -20.865   3.585
   84   1HH2  ARG  10          1HH       ARG  10  -3.630 -22.267   3.220
   85    H    VAL  11           H        VAL  11  -1.673 -17.086  -1.416
   86    HA   VAL  11           HA       VAL  11  -1.170 -15.687   0.909
   87    HB   VAL  11           HB       VAL  11   0.521 -16.356  -1.496
   88   1HG1  VAL  11          1HG1      VAL  11   1.481 -15.249   1.165
   89   2HG1  VAL  11          2HG1      VAL  11   2.504 -15.799  -0.184
   90   3HG1  VAL  11          3HG1      VAL  11   1.467 -14.365  -0.379
   91   1HG2  VAL  11          1HG2      VAL  11  -0.270 -17.717   0.996
   92   2HG2  VAL  11          2HG2      VAL  11   0.300 -18.389  -0.551
   93   3HG2  VAL  11          3HG2      VAL  11   1.473 -17.783   0.643
   94    H    ALA  12           H        ALA  12  -1.194 -14.583  -2.529
   95    HA   ALA  12           HA       ALA  12  -0.264 -12.002  -2.024
   96   1HB   ALA  12          1HB       ALA  12  -0.214 -12.434  -4.264
   97   2HB   ALA  12          2HB       ALA  12  -1.653 -13.478  -4.202
   98   3HB   ALA  12          3HB       ALA  12  -1.838 -11.709  -4.226
   99    H    GLN  13           H        GLN  13  -3.536 -13.484  -1.899
  100    HA   GLN  13           HA       GLN  13  -4.900 -11.073  -1.633
  101   1HB   GLN  13          1HB       GLN  13  -5.564 -13.942  -0.885
  102   2HB   GLN  13          2HB       GLN  13  -6.694 -12.637  -0.582
  103   1HG   GLN  13          1HG       GLN  13  -6.217 -14.026  -3.052
  104   2HG   GLN  13          2HG       GLN  13  -7.388 -12.761  -2.733
  105   1HE2  GLN  13          1HE2      GLN  13  -6.766 -10.556  -2.966
  106   2HE2  GLN  13          2HE2      GLN  13  -5.510 -10.087  -4.062
  107    H    GLU  14           H        GLU  14  -4.390 -13.599   0.942
  108    HA   GLU  14           HA       GLU  14  -5.141 -12.234   3.070
  109   1HB   GLU  14          1HB       GLU  14  -3.425 -13.534   4.377
  110   2HB   GLU  14          2HB       GLU  14  -4.341 -14.514   3.248
  111   1HG   GLU  14          1HG       GLU  14  -2.521 -14.612   1.678
  112   2HG   GLU  14          2HG       GLU  14  -1.672 -13.287   2.452
  113    HE2  GLU  14           HE       GLU  14  -2.230 -16.831   3.005
  114    H    MET  15           H        MET  15  -2.085 -11.751   1.264
  115    HA   MET  15           HA       MET  15  -1.012  -9.990   3.197
  116   1HB   MET  15          1HB       MET  15  -0.207 -11.296   0.747
  117   2HB   MET  15          2HB       MET  15   0.074  -9.580   0.524
  118   1HG   MET  15          1HG       MET  15   2.063 -10.036   1.591
  119   2HG   MET  15          2HG       MET  15   1.095  -9.857   3.040
  120   1HE   MET  15          1HE       MET  15   3.203 -10.955   3.767
  121   2HE   MET  15          2HE       MET  15   3.161 -12.676   4.221
  122   3HE   MET  15          3HE       MET  15   3.914 -12.180   2.687
  123    H    GLN  16           H        GLN  16  -2.785  -9.631   0.076
  124    HA   GLN  16           HA       GLN  16  -2.483  -6.872  -0.078
  125   1HB   GLN  16          1HB       GLN  16  -3.284  -8.615  -1.858
  126   2HB   GLN  16          2HB       GLN  16  -4.880  -8.376  -1.175
  127   1HG   GLN  16          1HG       GLN  16  -3.475  -5.824  -1.688
  128   2HG   GLN  16          2HG       GLN  16  -3.677  -6.782  -3.141
  129   1HE2  GLN  16          1HE2      GLN  16  -5.018  -4.828  -3.606
  130   2HE2  GLN  16          2HE2      GLN  16  -6.701  -4.873  -3.198
  131    H    LYS  17           H        LYS  17  -4.806  -8.990   1.619
  132    HA   LYS  17           HA       LYS  17  -6.581  -6.840   2.255
  133   1HB   LYS  17          1HB       LYS  17  -7.296  -9.209   1.964
  134   2HB   LYS  17          2HB       LYS  17  -6.410  -9.636   3.413
  135   1HG   LYS  17          1HG       LYS  17  -7.844  -7.585   4.441
  136   2HG   LYS  17          2HG       LYS  17  -8.932  -8.016   3.136
  137   1HD   LYS  17          1HD       LYS  17  -9.753  -9.608   4.542
  138   2HD   LYS  17          2HD       LYS  17  -8.293 -10.510   4.192
  139   1HE   LYS  17          1HE       LYS  17  -7.175  -9.677   6.162
  140   2HE   LYS  17          2HE       LYS  17  -8.372  -8.422   6.407
  141   1HZ   LYS  17          1HZ       LYS  17  -8.505 -11.206   7.156
  142   2HZ   LYS  17          2HZ       LYS  17  -9.298  -9.934   7.795
  143    H    GLU  18           H        GLU  18  -3.854  -8.572   3.820
  144    HA   GLU  18           HA       GLU  18  -4.232  -7.363   6.313
  145   1HB   GLU  18          1HB       GLU  18  -2.928  -9.457   5.940
  146   2HB   GLU  18          2HB       GLU  18  -1.703  -8.545   5.081
  147   1HG   GLU  18          1HG       GLU  18  -0.712  -8.439   7.154
  148   2HG   GLU  18          2HG       GLU  18  -1.791  -7.074   7.371
  149    HE2  GLU  18           HE       GLU  18  -2.397 -10.442   9.406
  150    H    ILE  19           H        ILE  19  -2.300  -6.530   3.392
  151    HA   ILE  19           HA       ILE  19  -1.059  -4.295   4.678
  152    HB   ILE  19           HB       ILE  19   0.034  -3.942   2.637
  153   1HG1  ILE  19          1HG1      ILE  19  -2.186  -5.542   1.343
  154   2HG1  ILE  19          2HG1      ILE  19  -1.809  -3.847   1.105
  155   1HG2  ILE  19          1HG2      ILE  19   1.231  -5.751   3.108
  156   2HG2  ILE  19          2HG2      ILE  19  -0.201  -6.625   3.701
  157   3HG2  ILE  19          3HG2      ILE  19   0.203  -6.654   1.969
  158   1HD1  ILE  19          1HD1      ILE  19   0.620  -5.021   0.499
  159   2HD1  ILE  19          2HD1      ILE  19  -0.533  -6.249  -0.076
  160   3HD1  ILE  19          3HD1      ILE  19  -0.620  -4.585  -0.701
  161    H    ALA  20           H        ALA  20  -3.888  -4.897   2.558
  162    HA   ALA  20           HA       ALA  20  -4.433  -2.246   1.918
  163   1HB   ALA  20          1HB       ALA  20  -6.816  -3.198   1.673
  164   2HB   ALA  20          2HB       ALA  20  -5.532  -3.965   0.708
  165   3HB   ALA  20          3HB       ALA  20  -6.119  -4.750   2.194
  166    H    LEU  21           H        LEU  21  -5.115  -4.215   4.830
  167    HA   LEU  21           HA       LEU  21  -6.860  -2.259   5.957
  168   1HB   LEU  21          1HB       LEU  21  -7.164  -4.564   6.496
  169   2HB   LEU  21          2HB       LEU  21  -5.505  -4.727   7.038
  170    HG   LEU  21           HG       LEU  21  -6.651  -2.664   8.609
  171   1HD1  LEU  21          1HD1      LEU  21  -8.781  -4.012   7.664
  172   2HD1  LEU  21          2HD1      LEU  21  -8.386  -5.025   9.074
  173   3HD1  LEU  21          3HD1      LEU  21  -8.713  -3.289   9.290
  174   1HD2  LEU  21          1HD2      LEU  21  -5.124  -3.807   9.798
  175   2HD2  LEU  21          2HD2      LEU  21  -6.522  -4.796  10.286
  176   3HD2  LEU  21          3HD2      LEU  21  -5.461  -5.344   8.967
  177    H    ILE  22           H        ILE  22  -3.509  -3.407   6.787
  178    HA   ILE  22           HA       ILE  22  -3.024  -1.406   8.647
  179    HB   ILE  22           HB       ILE  22  -1.193  -3.068   6.924
  180   1HG1  ILE  22          1HG1      ILE  22  -1.739  -3.330   9.885
  181   2HG1  ILE  22          2HG1      ILE  22  -2.749  -4.114   8.687
  182   1HG2  ILE  22          1HG2      ILE  22   0.677  -2.341   8.139
  183   2HG2  ILE  22          2HG2      ILE  22  -0.199  -0.849   7.718
  184   3HG2  ILE  22          3HG2      ILE  22  -0.320  -1.519   9.363
  185   1HD1  ILE  22          1HD1      ILE  22  -0.714  -5.226   7.720
  186   2HD1  ILE  22          2HD1      ILE  22   0.266  -4.478   9.005
  187   3HD1  ILE  22          3HD1      ILE  22  -0.994  -5.664   9.422
  188    H    LEU  23           H        LEU  23  -3.255  -1.296   5.171
  189    HA   LEU  23           HA       LEU  23  -1.685   1.131   5.001
  190   1HB   LEU  23          1HB       LEU  23  -1.513  -0.591   3.273
  191   2HB   LEU  23          2HB       LEU  23  -3.223  -0.430   2.920
  192    HG   LEU  23           HG       LEU  23  -1.483   2.002   2.709
  193   1HD1  LEU  23          1HD1      LEU  23  -1.707   0.383   0.243
  194   2HD1  LEU  23          2HD1      LEU  23  -0.378   1.408   0.838
  195   3HD1  LEU  23          3HD1      LEU  23  -0.591  -0.238   1.483
  196   1HD2  LEU  23          1HD2      LEU  23  -3.503   1.373   0.656
  197   2HD2  LEU  23          2HD2      LEU  23  -4.142   1.577   2.305
  198   3HD2  LEU  23          3HD2      LEU  23  -3.193   2.881   1.551
  199    H    GLN  24           H        GLN  24  -4.912   0.141   5.722
  200    HA   GLN  24           HA       GLN  24  -5.849   2.815   5.028
  201   1HB   GLN  24          1HB       GLN  24  -7.090   0.124   4.878
  202   2HB   GLN  24          2HB       GLN  24  -8.133   1.347   5.577
  203   1HG   GLN  24          1HG       GLN  24  -8.139   2.666   3.621
  204   2HG   GLN  24          2HG       GLN  24  -6.613   2.019   3.052
  205   1HE2  GLN  24          1HE2      GLN  24  -7.185   1.298   1.100
  206   2HE2  GLN  24          2HE2      GLN  24  -8.344   0.051   0.781
  207    H    ARG  25           H        ARG  25  -4.756   0.878   7.572
  208    HA   ARG  25           HA       ARG  25  -6.444   2.328   9.451
  209   1HB   ARG  25          1HB       ARG  25  -5.497  -0.467   9.343
  210   2HB   ARG  25          2HB       ARG  25  -5.125   0.282  10.882
  211   1HG   ARG  25          1HG       ARG  25  -7.854   0.934   9.971
  212   2HG   ARG  25          2HG       ARG  25  -7.607  -0.795  10.116
  213   1HD   ARG  25          1HD       ARG  25  -6.639  -0.365  12.453
  214   2HD   ARG  25          2HD       ARG  25  -7.154   1.302  12.289
  215    HE   ARG  25           HE       ARG  25  -9.342   0.621  12.727
  216   1HH1  ARG  25          2HH2      ARG  25  -7.513  -2.190  11.581
  217   2HH1  ARG  25          1HH2      ARG  25  -8.816  -3.300  11.843
  218   1HH2  ARG  25          1HH       ARG  25 -10.892  -2.487  12.723
  219    H    GLU  26           H        GLU  26  -3.147   0.777   9.216
  220    HA   GLU  26           HA       GLU  26  -2.068   2.431  11.189
  221   1HB   GLU  26          1HB       GLU  26  -0.341   0.982  11.015
  222   2HB   GLU  26          2HB       GLU  26  -1.277   0.144   9.793
  223   1HG   GLU  26          1HG       GLU  26   0.754   0.580   8.672
  224   2HG   GLU  26          2HG       GLU  26  -0.276   1.882   8.110
  225    HE2  GLU  26           HE       GLU  26   0.337   3.268  11.020
  226    H    ILE  27           H        ILE  27  -2.830   2.942   7.844
  227    HA   ILE  27           HA       ILE  27  -0.819   4.975   7.462
  228    HB   ILE  27           HB       ILE  27  -2.352   3.303   5.820
  229   1HG1  ILE  27          1HG1      ILE  27  -0.254   5.409   5.453
  230   2HG1  ILE  27          2HG1      ILE  27  -0.166   3.680   5.181
  231   1HG2  ILE  27          1HG2      ILE  27  -4.144   5.012   5.914
  232   2HG2  ILE  27          2HG2      ILE  27  -3.007   6.203   5.237
  233   3HG2  ILE  27          3HG2      ILE  27  -3.479   4.779   4.279
  234   1HD1  ILE  27          1HD1      ILE  27  -1.837   4.019   3.249
  235   2HD1  ILE  27          2HD1      ILE  27  -1.545   5.765   3.444
  236   3HD1  ILE  27          3HD1      ILE  27  -0.204   4.681   3.002
  237    H    LYS  28           H        LYS  28  -1.813   7.148   6.429
  238    HA   LYS  28           HA       LYS  28  -3.679   8.103   8.473
  239   1HB   LYS  28          1HB       LYS  28  -2.779  10.333   7.962
  240   2HB   LYS  28          2HB       LYS  28  -1.533   9.221   8.489
  241   1HG   LYS  28          1HG       LYS  28  -1.731   8.958   5.634
  242   2HG   LYS  28          2HG       LYS  28  -1.721  10.674   5.986
  243   1HD   LYS  28          1HD       LYS  28   0.589   9.904   5.718
  244   2HD   LYS  28          2HD       LYS  28   0.334  10.369   7.388
  245   1HE   LYS  28          1HE       LYS  28  -0.237   7.847   7.803
  246   2HE   LYS  28          2HE       LYS  28   0.486   7.559   6.234
  247   1HZ   LYS  28          1HZ       LYS  28   2.546   8.536   7.023
  248   2HZ   LYS  28          2HZ       LYS  28   1.884   8.955   8.451
  249    H    ASP  29           H        ASP  29  -5.409   6.949   7.188
  250    HA   ASP  29           HA       ASP  29  -5.980   8.120   4.647
  251   1HB   ASP  29          1HB       ASP  29  -6.862   6.029   4.477
  252   2HB   ASP  29          2HB       ASP  29  -6.828   5.797   6.213
  253    HD2  ASP  29           HD       ASP  29 -10.246   5.833   6.233
  254    HA   PRO  30           HA       PRO  30  -9.466   9.773   7.486
  255   1HB   PRO  30          1HB       PRO  30  -9.170   9.583  10.195
  256   2HB   PRO  30          2HB       PRO  30 -10.090   8.431   9.249
  257   1HG   PRO  30          1HG       PRO  30  -7.408   8.119  10.453
  258   2HG   PRO  30          2HG       PRO  30  -8.507   6.878   9.884
  259   1HD   PRO  30          1HD       PRO  30  -6.159   7.837   8.545
  260   2HD   PRO  30          2HD       PRO  30  -7.320   6.680   7.925
  261    H    ARG  31           H        ARG  31  -6.181  10.227   7.870
  262    HA   ARG  31           HA       ARG  31  -6.520  12.750   9.176
  263   1HB   ARG  31          1HB       ARG  31  -3.919  11.867   7.899
  264   2HB   ARG  31          2HB       ARG  31  -4.161  12.779   9.377
  265   1HG   ARG  31          1HG       ARG  31  -5.329  10.575  10.254
  266   2HG   ARG  31          2HG       ARG  31  -4.490   9.796   8.927
  267   1HD   ARG  31          1HD       ARG  31  -2.533   9.808  10.083
  268   2HD   ARG  31          2HD       ARG  31  -2.624  11.545  10.307
  269    HE   ARG  31           HE       ARG  31  -3.487   9.480  12.220
  270   1HH1  ARG  31          2HH2      ARG  31  -3.675  12.903  11.324
  271   2HH1  ARG  31          1HH2      ARG  31  -4.132  13.422  12.913
  272   1HH2  ARG  31          1HH       ARG  31  -4.369  11.794  14.656
  273    H    LEU  32           H        LEU  32  -6.245  11.403   5.931
  274    HA   LEU  32           HA       LEU  32  -5.491  13.931   4.754
  275   1HB   LEU  32          1HB       LEU  32  -5.786  11.119   3.871
  276   2HB   LEU  32          2HB       LEU  32  -6.111  12.348   2.665
  277    HG   LEU  32           HG       LEU  32  -3.855  11.803   2.377
  278   1HD1  LEU  32          1HD1      LEU  32  -2.905  13.854   2.427
  279   2HD1  LEU  32          2HD1      LEU  32  -4.545  14.348   2.908
  280   3HD1  LEU  32          3HD1      LEU  32  -3.286  14.117   4.145
  281   1HD2  LEU  32          1HD2      LEU  32  -2.311  12.081   4.544
  282   2HD2  LEU  32          2HD2      LEU  32  -3.817  11.566   5.341
  283   3HD2  LEU  32          3HD2      LEU  32  -3.076  10.540   4.090
  284    H    GLY  33           H        GLY  33  -8.370  12.176   5.679
  285   1HA   GLY  33          1HA       GLY  33 -10.496  13.011   5.737
  286   2HA   GLY  33          2HA       GLY  33 -10.011  14.370   4.743
  287    H    MET  34           H        MET  34  -9.047  11.155   3.673
  288    HA   MET  34           HA       MET  34 -11.382  10.935   1.993
  289   1HB   MET  34          1HB       MET  34  -8.505  11.143   0.945
  290   2HB   MET  34          2HB       MET  34  -9.863  10.650  -0.045
  291   1HG   MET  34          1HG       MET  34 -10.935  12.815   0.174
  292   2HG   MET  34          2HG       MET  34  -9.849  13.302   1.461
  293   1HE   MET  34          1HE       MET  34  -7.349  15.147   0.069
  294   2HE   MET  34          2HE       MET  34  -7.970  14.176   1.426
  295   3HE   MET  34          3HE       MET  34  -6.657  13.542   0.403
  296    H    MET  35           H        MET  35 -11.627   8.780   1.031
  297    HA   MET  35           HA       MET  35 -10.311   6.820   2.672
  298   1HB   MET  35          1HB       MET  35 -12.888   7.101   1.710
  299   2HB   MET  35          2HB       MET  35 -12.233   6.011   0.507
  300   1HG   MET  35          1HG       MET  35 -11.502   4.444   2.316
  301   2HG   MET  35          2HG       MET  35 -12.141   5.539   3.527
  302   1HE   MET  35          1HE       MET  35 -14.431   3.637   0.141
  303   2HE   MET  35          2HE       MET  35 -12.672   3.776   0.379
  304   3HE   MET  35          3HE       MET  35 -13.567   2.424   1.116
  305    H    THR  36           H        THR  36  -8.250   6.326   1.958
  306    HA   THR  36           HA       THR  36  -7.464   6.409  -0.731
  307    HB   THR  36           HB       THR  36  -5.408   5.421   0.157
  308    HG1  THR  36           HG1      THR  36  -7.084   4.871   2.499
  309   1HG2  THR  36          1HG2      THR  36  -4.885   6.930   1.886
  310   2HG2  THR  36          2HG2      THR  36  -6.306   7.736   1.182
  311   3HG2  THR  36          3HG2      THR  36  -6.480   6.751   2.654
  312    H    THR  37           H        THR  37  -6.477   4.413  -1.875
  313    HA   THR  37           HA       THR  37  -8.086   2.023  -1.467
  314    HB   THR  37           HB       THR  37  -8.260   3.911  -3.842
  315    HG1  THR  37           HG1      THR  37  -9.938   3.884  -2.220
  316   1HG2  THR  37          1HG2      THR  37  -7.652   1.592  -4.718
  317   2HG2  THR  37          2HG2      THR  37  -9.064   0.957  -3.839
  318   3HG2  THR  37          3HG2      THR  37  -9.293   2.122  -5.165
  319    H    VAL  38           H        VAL  38  -7.315   0.194  -2.864
  320    HA   VAL  38           HA       VAL  38  -4.483   0.576  -3.540
  321    HB   VAL  38           HB       VAL  38  -5.761  -1.661  -1.960
  322   1HG1  VAL  38          1HG1      VAL  38  -4.265  -2.925  -3.132
  323   2HG1  VAL  38          2HG1      VAL  38  -3.207  -1.541  -3.497
  324   3HG1  VAL  38          3HG1      VAL  38  -3.158  -2.300  -1.887
  325   1HG2  VAL  38          1HG2      VAL  38  -4.441  -0.966  -0.134
  326   2HG2  VAL  38          2HG2      VAL  38  -3.419   0.074  -1.155
  327   3HG2  VAL  38          3HG2      VAL  38  -5.104   0.538  -0.817
  328    H    SER  39           H        SER  39  -5.119   0.824  -5.761
  329    HA   SER  39           HA       SER  39  -6.499  -1.450  -6.891
  330   1HB   SER  39          1HB       SER  39  -6.450   1.339  -7.453
  331   2HB   SER  39          2HB       SER  39  -5.689   0.569  -8.830
  332    HG   SER  39           HG       SER  39  -8.072   0.781  -8.961
  333    H    GLY  40           H        GLY  40  -3.516  -1.158  -5.875
  334   1HA   GLY  40          1HA       GLY  40  -2.378  -2.664  -8.093
  335   2HA   GLY  40          2HA       GLY  40  -1.593  -1.144  -7.708
  336    H    VAL  41           H        VAL  41  -1.329  -4.379  -7.202
  337    HA   VAL  41           HA       VAL  41   0.202  -3.955  -4.779
  338    HB   VAL  41           HB       VAL  41  -1.969  -6.056  -4.942
  339   1HG1  VAL  41          1HG1      VAL  41  -0.178  -5.262  -2.622
  340   2HG1  VAL  41          2HG1      VAL  41  -1.408  -6.550  -2.631
  341   3HG1  VAL  41          3HG1      VAL  41   0.049  -6.701  -3.644
  342   1HG2  VAL  41          1HG2      VAL  41  -2.929  -3.805  -4.694
  343   2HG2  VAL  41          2HG2      VAL  41  -3.136  -4.770  -3.213
  344   3HG2  VAL  41          3HG2      VAL  41  -1.880  -3.510  -3.286
  345    H    GLU  42           H        GLU  42   2.116  -5.030  -4.935
  346    HA   GLU  42           HA       GLU  42   2.165  -7.386  -6.616
  347   1HB   GLU  42          1HB       GLU  42   4.165  -5.104  -6.916
  348   2HB   GLU  42          2HB       GLU  42   4.182  -6.613  -7.809
  349   1HG   GLU  42          1HG       GLU  42   1.599  -5.742  -8.286
  350   2HG   GLU  42          2HG       GLU  42   2.452  -4.216  -8.175
  351    HE2  GLU  42           HE       GLU  42   1.676  -4.836 -10.803
  352    H    MET  43           H        MET  43   3.363  -9.023  -5.695
  353    HA   MET  43           HA       MET  43   5.225  -8.205  -3.605
  354   1HB   MET  43          1HB       MET  43   3.778 -10.843  -3.380
  355   2HB   MET  43          2HB       MET  43   4.305  -9.770  -2.100
  356   1HG   MET  43          1HG       MET  43   1.943  -9.244  -3.969
  357   2HG   MET  43          2HG       MET  43   1.814  -9.810  -2.315
  358   1HE   MET  43          1HE       MET  43   2.597  -8.144  -0.112
  359   2HE   MET  43          2HE       MET  43   1.504  -6.766  -0.384
  360   3HE   MET  43          3HE       MET  43   0.981  -8.414  -0.806
  361    H    SER  44           H        SER  44   7.233  -8.664  -4.417
  362    HA   SER  44           HA       SER  44   7.472 -11.183  -5.864
  363   1HB   SER  44          1HB       SER  44   8.684  -8.483  -6.231
  364   2HB   SER  44          2HB       SER  44   9.787  -9.826  -6.454
  365    HG   SER  44           HG       SER  44   8.056  -8.892  -8.233
  366    H    ARG  45           H        ARG  45   8.194 -12.742  -4.444
  367    HA   ARG  45           HA       ARG  45  10.100 -11.880  -2.440
  368   1HB   ARG  45          1HB       ARG  45   8.185 -14.214  -2.692
  369   2HB   ARG  45          2HB       ARG  45   9.585 -14.391  -1.654
  370   1HG   ARG  45          1HG       ARG  45   8.389 -13.342  -0.033
  371   2HG   ARG  45          2HG       ARG  45   8.596 -11.863  -0.950
  372   1HD   ARG  45          1HD       ARG  45   6.208 -12.190  -0.511
  373   2HD   ARG  45          2HD       ARG  45   6.493 -12.377  -2.230
  374    HE   ARG  45           HE       ARG  45   5.930 -14.583  -0.302
  375   1HH1  ARG  45          2HH2      ARG  45   6.459 -13.539  -3.647
  376   2HH1  ARG  45          1HH2      ARG  45   5.865 -15.015  -4.331
  377   1HH2  ARG  45          1HH       ARG  45   5.097 -16.759  -2.878
  378    H    ASP  46           H        ASP  46  10.061 -13.120  -5.549
  379    HA   ASP  46           HA       ASP  46  11.580 -15.323  -5.605
  380   1HB   ASP  46          1HB       ASP  46  11.302 -12.909  -7.360
  381   2HB   ASP  46          2HB       ASP  46  12.690 -13.927  -7.687
  382    HD2  ASP  46           HD       ASP  46   9.814 -14.274  -9.573
  383    H    LEU  47           H        LEU  47  12.445 -12.078  -4.552
  384    HA   LEU  47           HA       LEU  47  15.098 -13.013  -3.870
  385   1HB   LEU  47          1HB       LEU  47  14.595 -11.293  -6.128
  386   2HB   LEU  47          2HB       LEU  47  15.519 -10.432  -4.912
  387    HG   LEU  47           HG       LEU  47  16.658 -13.046  -5.222
  388   1HD1  LEU  47          1HD1      LEU  47  15.578 -13.103  -7.416
  389   2HD1  LEU  47          2HD1      LEU  47  16.326 -11.542  -7.833
  390   3HD1  LEU  47          3HD1      LEU  47  17.348 -12.975  -7.565
  391   1HD2  LEU  47          1HD2      LEU  47  17.464 -10.214  -5.320
  392   2HD2  LEU  47          2HD2      LEU  47  18.249 -11.614  -4.550
  393   3HD2  LEU  47          3HD2      LEU  47  18.472 -11.314  -6.291
  394    H    ALA  48           H        ALA  48  13.139  -9.951  -4.063
  395    HA   ALA  48           HA       ALA  48  12.330  -9.740  -1.524
  396   1HB   ALA  48          1HB       ALA  48  14.208  -9.755  -0.261
  397   2HB   ALA  48          2HB       ALA  48  15.261  -9.468  -1.668
  398   3HB   ALA  48          3HB       ALA  48  14.459  -8.098  -0.863
  399    H    TYR  49           H        TYR  49  10.948  -8.809  -3.354
  400    HA   TYR  49           HA       TYR  49  11.283  -5.937  -3.294
  401   1HB   TYR  49          1HB       TYR  49  10.877  -7.483  -5.914
  402   2HB   TYR  49          2HB       TYR  49  11.291  -5.788  -5.750
  403    HD1  TYR  49           HD1      TYR  49  12.565  -8.927  -6.570
  404    HD2  TYR  49           HD2      TYR  49  13.609  -5.392  -4.399
  405    HE1  TYR  49           HE1      TYR  49  15.031  -9.500  -6.808
  406    HE2  TYR  49           HE2      TYR  49  16.071  -5.977  -4.643
  407    HH   TYR  49           HH       TYR  49  17.393  -7.452  -6.518
  408    H    ALA  50           H        ALA  50   9.314  -4.848  -3.412
  409    HA   ALA  50           HA       ALA  50   6.984  -6.305  -4.320
  410   1HB   ALA  50          1HB       ALA  50   6.857  -7.083  -2.111
  411   2HB   ALA  50          2HB       ALA  50   7.522  -5.576  -1.437
  412   3HB   ALA  50          3HB       ALA  50   5.856  -5.613  -2.063
  413    H    LYS  51           H        LYS  51   5.233  -4.888  -4.853
  414    HA   LYS  51           HA       LYS  51   5.890  -2.041  -4.593
  415   1HB   LYS  51          1HB       LYS  51   4.491  -2.851  -7.069
  416   2HB   LYS  51          2HB       LYS  51   5.721  -1.630  -6.811
  417   1HG   LYS  51          1HG       LYS  51   7.364  -3.631  -6.447
  418   2HG   LYS  51          2HG       LYS  51   6.107  -4.630  -7.146
  419   1HD   LYS  51          1HD       LYS  51   6.794  -4.023  -9.217
  420   2HD   LYS  51          2HD       LYS  51   6.349  -2.365  -8.868
  421   1HE   LYS  51          1HE       LYS  51   8.556  -1.833  -8.045
  422   2HE   LYS  51          2HE       LYS  51   9.013  -3.522  -7.948
  423   1HZ   LYS  51          1HZ       LYS  51   9.961  -2.757  -9.944
  424   2HZ   LYS  51          2HZ       LYS  51   8.628  -3.528 -10.471
  425    H    VAL  52           H        VAL  52   4.411  -1.271  -3.173
  426    HA   VAL  52           HA       VAL  52   1.691  -2.345  -3.384
  427    HB   VAL  52           HB       VAL  52   3.359  -1.212  -1.177
  428   1HG1  VAL  52          1HG1      VAL  52   1.506   0.240  -0.960
  429   2HG1  VAL  52          2HG1      VAL  52   0.344  -1.043  -1.371
  430   3HG1  VAL  52          3HG1      VAL  52   1.197  -1.083   0.191
  431   1HG2  VAL  52          1HG2      VAL  52   1.621  -3.640  -1.608
  432   2HG2  VAL  52          2HG2      VAL  52   3.344  -3.552  -1.174
  433   3HG2  VAL  52          3HG2      VAL  52   2.103  -3.127   0.027
  434    H    TYR  53           H        TYR  53   0.302  -1.136  -4.556
  435    HA   TYR  53           HA       TYR  53   0.933   1.671  -4.969
  436   1HB   TYR  53          1HB       TYR  53  -0.218  -0.536  -6.393
  437   2HB   TYR  53          2HB       TYR  53  -1.576   0.524  -6.071
  438    HD1  TYR  53           HD1      TYR  53  -2.102   2.017  -7.758
  439    HD2  TYR  53           HD2      TYR  53   1.990   0.890  -7.215
  440    HE1  TYR  53           HE1      TYR  53  -1.432   3.466  -9.736
  441    HE2  TYR  53           HE2      TYR  53   2.645   2.342  -9.195
  442    HH   TYR  53           HH       TYR  53   1.269   4.636 -10.278
  443    H    VAL  54           H        VAL  54  -0.658   3.372  -4.645
  444    HA   VAL  54           HA       VAL  54  -2.987   2.726  -3.079
  445    HB   VAL  54           HB       VAL  54  -2.222   4.457  -1.334
  446   1HG1  VAL  54          1HG1      VAL  54  -0.655   1.912  -1.080
  447   2HG1  VAL  54          2HG1      VAL  54  -1.682   2.745   0.111
  448   3HG1  VAL  54          3HG1      VAL  54  -2.429   1.824  -1.218
  449   1HG2  VAL  54          1HG2      VAL  54   0.452   3.650  -2.519
  450   2HG2  VAL  54          2HG2      VAL  54  -0.225   5.290  -2.377
  451   3HG2  VAL  54          3HG2      VAL  54   0.256   4.396  -0.915
  452    H    THR  55           H        THR  55  -4.599   3.986  -3.849
  453    HA   THR  55           HA       THR  55  -3.797   6.489  -5.177
  454    HB   THR  55           HB       THR  55  -4.791   5.165  -6.853
  455    HG1  THR  55           HG1      THR  55  -6.598   6.445  -7.104
  456   1HG2  THR  55          1HG2      THR  55  -6.413   4.018  -4.557
  457   2HG2  THR  55          2HG2      THR  55  -7.065   3.940  -6.211
  458   3HG2  THR  55          3HG2      THR  55  -5.514   3.155  -5.827
  459    H    PHE  56           H        PHE  56  -4.592   8.417  -4.519
  460    HA   PHE  56           HA       PHE  56  -6.687   8.298  -2.468
  461   1HB   PHE  56          1HB       PHE  56  -4.405  10.333  -2.563
  462   2HB   PHE  56          2HB       PHE  56  -5.403   9.914  -1.183
  463    HD1  PHE  56           HD1      PHE  56  -5.242   7.081  -0.916
  464    HD2  PHE  56           HD2      PHE  56  -2.211   9.782  -2.151
  465    HE1  PHE  56           HE1      PHE  56  -3.487   5.467  -0.133
  466    HE2  PHE  56           HE2      PHE  56  -0.454   8.168  -1.367
  467    HZ   PHE  56           HZ       PHE  56  -1.113   6.031  -0.367
  468    H    LEU  57           H        LEU  57  -7.940  10.342  -2.252
  469    HA   LEU  57           HA       LEU  57  -8.282  11.527  -4.881
  470   1HB   LEU  57          1HB       LEU  57 -10.156  10.536  -3.506
  471   2HB   LEU  57          2HB       LEU  57  -9.971  11.890  -2.410
  472    HG   LEU  57           HG       LEU  57 -10.278  13.322  -4.611
  473   1HD1  LEU  57          1HD1      LEU  57 -10.824  12.234  -6.462
  474   2HD1  LEU  57          2HD1      LEU  57 -10.678  10.685  -5.600
  475   3HD1  LEU  57          3HD1      LEU  57 -12.243  11.531  -5.648
  476   1HD2  LEU  57          1HD2      LEU  57 -12.220  12.112  -2.726
  477   2HD2  LEU  57          2HD2      LEU  57 -11.874  13.819  -3.093
  478   3HD2  LEU  57          3HD2      LEU  57 -12.899  12.863  -4.190
  479    H    ASN  58           H        ASN  58  -6.074  12.051  -2.652
  480    HA   ASN  58           HA       ASN  58  -6.384  14.529  -1.623
  481   1HB   ASN  58          1HB       ASN  58  -4.125  12.761  -2.346
  482   2HB   ASN  58          2HB       ASN  58  -3.678  14.453  -2.446
  483   1HD2  ASN  58          1HD2      ASN  58  -5.201  15.615  -0.515
  484   2HD2  ASN  58          2HD2      ASN  58  -4.756  15.050   1.062
  485    H    ASP  59           H        ASP  59  -5.802  13.493  -4.964
  486    HA   ASP  59           HA       ASP  59  -4.570  15.474  -6.174
  487   1HB   ASP  59          1HB       ASP  59  -5.389  13.835  -7.626
  488   2HB   ASP  59          2HB       ASP  59  -6.985  13.839  -6.903
  489    HD2  ASP  59           HD       ASP  59  -8.433  14.803  -7.913
  490    H    LYS  60           H        LYS  60  -7.976  15.489  -4.965
  491    HA   LYS  60           HA       LYS  60  -9.029  17.702  -6.034
  492   1HB   LYS  60          1HB       LYS  60  -9.284  16.305  -3.447
  493   2HB   LYS  60          2HB       LYS  60  -9.831  17.969  -3.427
  494   1HG   LYS  60          1HG       LYS  60 -10.842  16.959  -5.857
  495   2HG   LYS  60          2HG       LYS  60 -11.041  15.627  -4.735
  496   1HD   LYS  60          1HD       LYS  60 -11.892  18.445  -3.972
  497   2HD   LYS  60          2HD       LYS  60 -12.953  17.410  -4.907
  498   1HE   LYS  60          1HE       LYS  60 -13.532  16.200  -3.070
  499   2HE   LYS  60          2HE       LYS  60 -11.856  15.935  -2.633
  500   1HZ   LYS  60          1HZ       LYS  60 -12.560  18.631  -2.113
  501   2HZ   LYS  60          2HZ       LYS  60 -13.635  17.652  -1.378
  502    H    ASP  61           H        ASP  61  -6.550  17.587  -3.422
  503    HA   ASP  61           HA       ASP  61  -6.170  20.432  -3.929
  504   1HB   ASP  61          1HB       ASP  61  -5.359  19.333  -1.268
  505   2HB   ASP  61          2HB       ASP  61  -6.019  20.907  -1.663
  506    HD2  ASP  61           HD       ASP  61  -7.833  17.550  -1.444
  507    H    GLU  62           H        GLU  62  -4.121  20.718  -4.818
  508    HA   GLU  62           HA       GLU  62  -2.287  18.611  -4.871
  509   1HB   GLU  62          1HB       GLU  62  -2.616  20.597  -6.528
  510   2HB   GLU  62          2HB       GLU  62  -1.606  21.518  -5.430
  511   1HG   GLU  62          1HG       GLU  62   0.294  20.143  -5.808
  512   2HG   GLU  62          2HG       GLU  62  -0.670  18.798  -6.388
  513    HE2  GLU  62           HE       GLU  62   0.801  19.424  -8.949
  514    H    ASP  63           H        ASP  63  -2.998  21.073  -2.528
  515    HA   ASP  63           HA       ASP  63  -0.408  21.333  -1.480
  516   1HB   ASP  63          1HB       ASP  63  -2.911  22.530  -1.086
  517   2HB   ASP  63          2HB       ASP  63  -2.649  21.680   0.424
  518    HD2  ASP  63           HD       ASP  63  -1.207  24.575   1.407
  519    H    ALA  64           H        ALA  64  -3.340  19.342  -0.734
  520    HA   ALA  64           HA       ALA  64  -2.058  18.052   1.492
  521   1HB   ALA  64          1HB       ALA  64  -4.167  16.856   1.676
  522   2HB   ALA  64          2HB       ALA  64  -4.509  18.577   1.372
  523   3HB   ALA  64          3HB       ALA  64  -4.656  17.392   0.051
  524    H    VAL  65           H        VAL  65  -2.189  17.707  -1.970
  525    HA   VAL  65           HA       VAL  65  -1.786  14.883  -2.011
  526    HB   VAL  65           HB       VAL  65  -2.537  16.838  -3.802
  527   1HG1  VAL  65          1HG1      VAL  65  -0.173  17.464  -4.160
  528   2HG1  VAL  65          2HG1      VAL  65   0.182  15.793  -4.662
  529   3HG1  VAL  65          3HG1      VAL  65  -0.923  16.798  -5.631
  530   1HG2  VAL  65          1HG2      VAL  65  -1.894  14.595  -5.360
  531   2HG2  VAL  65          2HG2      VAL  65  -2.200  13.955  -3.727
  532   3HG2  VAL  65          3HG2      VAL  65  -3.440  14.936  -4.546
  533    H    LYS  66           H        LYS  66   0.287  17.832  -2.224
  534    HA   LYS  66           HA       LYS  66   2.662  16.295  -2.576
  535   1HB   LYS  66          1HB       LYS  66   2.240  18.655  -3.403
  536   2HB   LYS  66          2HB       LYS  66   2.416  19.197  -1.746
  537   1HG   LYS  66          1HG       LYS  66   4.600  17.385  -2.548
  538   2HG   LYS  66          2HG       LYS  66   4.497  18.787  -3.593
  539   1HD   LYS  66          1HD       LYS  66   4.923  20.304  -1.848
  540   2HD   LYS  66          2HD       LYS  66   4.310  19.223  -0.612
  541   1HE   LYS  66          1HE       LYS  66   6.866  18.665  -2.186
  542   2HE   LYS  66          2HE       LYS  66   6.856  19.518  -0.655
  543   1HZ   LYS  66          1HZ       LYS  66   5.958  17.584   0.423
  544   2HZ   LYS  66          2HZ       LYS  66   5.691  16.807  -0.983
  545    H    ALA  67           H        ALA  67   1.223  18.195   0.163
  546    HA   ALA  67           HA       ALA  67   3.204  17.468   2.003
  547   1HB   ALA  67          1HB       ALA  67   1.974  18.755   3.434
  548   2HB   ALA  67          2HB       ALA  67   1.141  19.238   1.938
  549   3HB   ALA  67          3HB       ALA  67   0.438  17.978   2.980
  550    H    GLY  68           H        GLY  68  -0.117  16.134   1.381
  551   1HA   GLY  68          1HA       GLY  68  -0.121  14.139   3.288
  552   2HA   GLY  68          2HA       GLY  68  -0.979  14.094   1.760
  553    H    ILE  69           H        ILE  69   0.691  13.732  -0.241
  554    HA   ILE  69           HA       ILE  69   1.591  11.131   0.008
  555    HB   ILE  69           HB       ILE  69   1.002  12.565  -2.050
  556   1HG1  ILE  69          1HG1      ILE  69   3.272  10.555  -2.052
  557   2HG1  ILE  69          2HG1      ILE  69   1.558  10.209  -2.176
  558   1HG2  ILE  69          1HG2      ILE  69   3.921  12.955  -2.447
  559   2HG2  ILE  69          2HG2      ILE  69   2.537  13.911  -3.030
  560   3HG2  ILE  69          3HG2      ILE  69   3.096  14.089  -1.349
  561   1HD1  ILE  69          1HD1      ILE  69   1.393  11.078  -4.363
  562   2HD1  ILE  69          2HD1      ILE  69   2.852  12.079  -4.177
  563   3HD1  ILE  69          3HD1      ILE  69   3.002  10.317  -4.370
  564    H    LYS  70           H        LYS  70   3.169  14.236   0.716
  565    HA   LYS  70           HA       LYS  70   5.800  13.230   0.772
  566   1HB   LYS  70          1HB       LYS  70   5.426  15.579   0.503
  567   2HB   LYS  70          2HB       LYS  70   4.485  15.673   1.978
  568   1HG   LYS  70          1HG       LYS  70   6.737  14.666   3.061
  569   2HG   LYS  70          2HG       LYS  70   7.468  15.390   1.642
  570   1HD   LYS  70          1HD       LYS  70   5.757  17.412   2.523
  571   2HD   LYS  70          2HD       LYS  70   6.295  16.697   4.030
  572   1HE   LYS  70          1HE       LYS  70   8.369  17.264   1.909
  573   2HE   LYS  70          2HE       LYS  70   7.718  18.619   2.810
  574   1HZ   LYS  70          1HZ       LYS  70   8.416  16.431   4.526
  575   2HZ   LYS  70          2HZ       LYS  70   9.704  16.956   3.678
  576    H    ALA  71           H        ALA  71   3.090  13.274   3.082
  577    HA   ALA  71           HA       ALA  71   4.745  12.509   5.292
  578   1HB   ALA  71          1HB       ALA  71   1.883  13.112   4.744
  579   2HB   ALA  71          2HB       ALA  71   2.192  11.961   6.065
  580   3HB   ALA  71          3HB       ALA  71   2.910  13.587   6.117
  581    H    LEU  72           H        LEU  72   2.539  10.913   2.930
  582    HA   LEU  72           HA       LEU  72   2.707   8.378   4.163
  583   1HB   LEU  72          1HB       LEU  72   1.112   9.523   2.302
  584   2HB   LEU  72          2HB       LEU  72   2.148   8.564   1.264
  585    HG   LEU  72           HG       LEU  72   1.539   6.668   3.059
  586   1HD1  LEU  72          1HD1      LEU  72  -0.084   8.748   3.937
  587   2HD1  LEU  72          2HD1      LEU  72  -1.181   7.696   3.012
  588   3HD1  LEU  72          3HD1      LEU  72  -0.231   7.024   4.359
  589   1HD2  LEU  72          1HD2      LEU  72  -0.092   7.548   0.668
  590   2HD2  LEU  72          2HD2      LEU  72   1.226   6.352   0.721
  591   3HD2  LEU  72          3HD2      LEU  72  -0.329   5.999   1.513
  592    H    GLN  73           H        GLN  73   4.814  10.248   2.069
  593    HA   GLN  73           HA       GLN  73   6.208   7.960   1.114
  594   1HB   GLN  73          1HB       GLN  73   5.974  10.226  -0.073
  595   2HB   GLN  73          2HB       GLN  73   7.143  10.858   1.069
  596   1HG   GLN  73          1HG       GLN  73   8.115   8.341  -0.045
  597   2HG   GLN  73          2HG       GLN  73   7.673   9.432  -1.344
  598   1HE2  GLN  73          1HE2      GLN  73  10.190   8.893  -1.311
  599   2HE2  GLN  73          2HE2      GLN  73  11.182  10.148  -0.648
  600    H    GLU  74           H        GLU  74   6.836  10.607   3.513
  601    HA   GLU  74           HA       GLU  74   9.339   9.716   4.253
  602   1HB   GLU  74          1HB       GLU  74   9.222  11.326   5.950
  603   2HB   GLU  74          2HB       GLU  74   8.056  11.937   4.793
  604   1HG   GLU  74          1HG       GLU  74   6.693  12.024   6.648
  605   2HG   GLU  74          2HG       GLU  74   6.391  10.349   6.232
  606    HE2  GLU  74           HE       GLU  74   6.135  10.666   8.876
  607    H    ALA  75           H        ALA  75   6.083   8.614   5.119
  608    HA   ALA  75           HA       ALA  75   7.098   7.025   7.324
  609   1HB   ALA  75          1HB       ALA  75   4.604   8.206   6.562
  610   2HB   ALA  75          2HB       ALA  75   4.370   6.445   6.639
  611   3HB   ALA  75          3HB       ALA  75   4.996   7.322   8.055
  612    H    SER  76           H        SER  76   7.686   6.742   4.224
  613    HA   SER  76           HA       SER  76   6.513   4.459   3.310
  614   1HB   SER  76          1HB       SER  76   9.160   5.815   2.821
  615   2HB   SER  76          2HB       SER  76   8.912   4.222   2.134
  616    HG   SER  76           HG       SER  76   6.836   6.145   1.777
  617    H    GLY  77           H        GLY  77   9.928   4.585   4.568
  618   1HA   GLY  77          1HA       GLY  77  10.300   1.895   4.941
  619   2HA   GLY  77          2HA       GLY  77  11.092   3.158   5.861
  620    H    PHE  78           H        PHE  78   8.212   4.078   6.736
  621    HA   PHE  78           HA       PHE  78   8.236   2.548   9.143
  622   1HB   PHE  78          1HB       PHE  78   7.132   5.016   7.991
  623   2HB   PHE  78          2HB       PHE  78   5.849   4.142   8.805
  624    HD1  PHE  78           HD1      PHE  78   5.884   3.838  11.213
  625    HD2  PHE  78           HD2      PHE  78   9.017   5.917   9.247
  626    HE1  PHE  78           HE1      PHE  78   6.668   4.742  13.420
  627    HE2  PHE  78           HE2      PHE  78   9.801   6.821  11.453
  628    HZ   PHE  78           HZ       PHE  78   8.617   6.224  13.514
  629    H    ILE  79           H        ILE  79   6.079   2.865   6.261
  630    HA   ILE  79           HA       ILE  79   4.126   1.094   7.306
  631    HB   ILE  79           HB       ILE  79   3.337   1.112   4.910
  632   1HG1  ILE  79          1HG1      ILE  79   5.416   3.271   4.515
  633   2HG1  ILE  79          2HG1      ILE  79   5.683   1.612   4.019
  634   1HG2  ILE  79          1HG2      ILE  79   2.879   3.696   5.065
  635   2HG2  ILE  79          2HG2      ILE  79   2.171   2.569   6.246
  636   3HG2  ILE  79          3HG2      ILE  79   3.616   3.515   6.676
  637   1HD1  ILE  79          1HD1      ILE  79   4.140   1.721   2.298
  638   2HD1  ILE  79          2HD1      ILE  79   3.080   2.849   3.180
  639   3HD1  ILE  79          3HD1      ILE  79   4.555   3.449   2.385
  640    H    ARG  80           H        ARG  80   7.031   0.775   5.221
  641    HA   ARG  80           HA       ARG  80   6.495  -1.859   4.495
  642   1HB   ARG  80          1HB       ARG  80   8.083  -0.697   3.147
  643   2HB   ARG  80          2HB       ARG  80   8.977  -0.110   4.535
  644   1HG   ARG  80          1HG       ARG  80   9.895  -2.317   4.991
  645   2HG   ARG  80          2HG       ARG  80   8.809  -3.076   3.842
  646   1HD   ARG  80          1HD       ARG  80  10.689  -2.921   2.490
  647   2HD   ARG  80          2HD       ARG  80   9.982  -1.359   2.128
  648    HE   ARG  80           HE       ARG  80  11.649  -0.292   3.444
  649   1HH1  ARG  80          2HH2      ARG  80  11.905  -3.815   3.716
  650   2HH1  ARG  80          1HH2      ARG  80  13.470  -3.768   4.458
  651   1HH2  ARG  80          1HH       ARG  80  14.512  -1.649   4.866
  652    H    SER  81           H        SER  81   8.489  -0.344   7.112
  653    HA   SER  81           HA       SER  81   9.405  -2.822   8.079
  654   1HB   SER  81          1HB       SER  81  10.513  -0.550   8.399
  655   2HB   SER  81          2HB       SER  81   9.262  -0.163   9.564
  656    HG   SER  81           HG       SER  81  11.535  -1.689   9.890
  657    H    LEU  82           H        LEU  82   6.602  -0.701   8.697
  658    HA   LEU  82           HA       LEU  82   5.834  -1.884  11.136
  659   1HB   LEU  82          1HB       LEU  82   5.101   0.313  10.519
  660   2HB   LEU  82          2HB       LEU  82   4.337  -0.286   9.060
  661    HG   LEU  82           HG       LEU  82   3.332  -1.538  11.532
  662   1HD1  LEU  82          1HD1      LEU  82   3.386   1.424  11.234
  663   2HD1  LEU  82          2HD1      LEU  82   1.871   0.679  11.797
  664   3HD1  LEU  82          3HD1      LEU  82   3.383   0.412  12.698
  665   1HD2  LEU  82          1HD2      LEU  82   2.328  -0.610   8.902
  666   2HD2  LEU  82          2HD2      LEU  82   1.957  -2.085   9.828
  667   3HD2  LEU  82          3HD2      LEU  82   1.174  -0.545  10.257
  668    H    LEU  83           H        LEU  83   5.332  -2.689   7.698
  669    HA   LEU  83           HA       LEU  83   3.280  -4.581   8.210
  670   1HB   LEU  83          1HB       LEU  83   5.019  -3.871   5.872
  671   2HB   LEU  83          2HB       LEU  83   4.035  -5.322   5.831
  672    HG   LEU  83           HG       LEU  83   2.898  -2.571   6.378
  673   1HD1  LEU  83          1HD1      LEU  83   2.450  -2.231   4.133
  674   2HD1  LEU  83          2HD1      LEU  83   4.087  -2.929   4.097
  675   3HD1  LEU  83          3HD1      LEU  83   2.677  -3.946   3.715
  676   1HD2  LEU  83          1HD2      LEU  83   1.785  -5.051   6.794
  677   2HD2  LEU  83          2HD2      LEU  83   0.889  -3.533   6.549
  678   3HD2  LEU  83          3HD2      LEU  83   1.186  -4.622   5.174
  679    H    GLY  84           H        GLY  84   6.826  -4.840   7.479
  680   1HA   GLY  84          1HA       GLY  84   7.120  -7.559   7.578
  681   2HA   GLY  84          2HA       GLY  84   8.328  -6.400   8.094
  682    H    LYS  85           H        LYS  85   7.118  -5.214  10.351
  683    HA   LYS  85           HA       LYS  85   7.508  -7.311  12.249
  684   1HB   LYS  85          1HB       LYS  85   7.378  -4.379  12.226
  685   2HB   LYS  85          2HB       LYS  85   6.622  -5.084  13.640
  686   1HG   LYS  85          1HG       LYS  85   8.853  -6.619  13.592
  687   2HG   LYS  85          2HG       LYS  85   9.493  -5.220  12.754
  688   1HD   LYS  85          1HD       LYS  85   8.027  -5.032  15.424
  689   2HD   LYS  85          2HD       LYS  85   9.766  -5.201  15.301
  690   1HE   LYS  85          1HE       LYS  85   8.999  -3.082  13.513
  691   2HE   LYS  85          2HE       LYS  85   8.163  -2.802  15.027
  692   1HZ   LYS  85          1HZ       LYS  85  10.288  -2.941  16.185
  693   2HZ   LYS  85          2HZ       LYS  85  11.086  -3.295  14.812
  694    H    ALA  86           H        ALA  86   4.739  -5.379  10.999
  695    HA   ALA  86           HA       ALA  86   2.846  -6.307  12.820
  696   1HB   ALA  86          1HB       ALA  86   2.398  -4.385  11.453
  697   2HB   ALA  86          2HB       ALA  86   2.667  -5.308   9.955
  698   3HB   ALA  86          3HB       ALA  86   1.240  -5.644  10.963
  699    H    MET  87           H        MET  87   4.332  -7.764   9.942
  700    HA   MET  87           HA       MET  87   2.521 -10.025  10.297
  701   1HB   MET  87          1HB       MET  87   3.209  -8.524   7.983
  702   2HB   MET  87          2HB       MET  87   4.139 -10.001   7.821
  703   1HG   MET  87          1HG       MET  87   1.860 -11.200   8.456
  704   2HG   MET  87          2HG       MET  87   1.128  -9.678   7.991
  705   1HE   MET  87          1HE       MET  87   3.024  -9.071   4.695
  706   2HE   MET  87          2HE       MET  87   1.252  -8.980   4.829
  707   3HE   MET  87          3HE       MET  87   2.276  -8.385   6.157
  708    H    ARG  88           H        ARG  88   5.295  -9.130  11.538
  709    HA   ARG  88           HA       ARG  88   7.374  -9.976  11.676
  710   1HB   ARG  88          1HB       ARG  88   5.323 -11.861  12.838
  711   2HB   ARG  88          2HB       ARG  88   7.000 -12.371  12.882
  712   1HG   ARG  88          1HG       ARG  88   7.519 -10.039  13.904
  713   2HG   ARG  88          2HG       ARG  88   5.789  -9.865  14.119
  714   1HD   ARG  88          1HD       ARG  88   6.881 -12.463  15.089
  715   2HD   ARG  88          2HD       ARG  88   7.489 -11.061  15.949
  716    HE   ARG  88           HE       ARG  88   4.731 -10.632  15.773
  717   1HH1  ARG  88          2HH2      ARG  88   6.802 -13.177  17.109
  718   2HH1  ARG  88          1HH2      ARG  88   5.669 -13.625  18.339
  719   1HH2  ARG  88          1HH       ARG  88   3.577 -12.463  18.489
  720    H    LEU  89           H        LEU  89   7.947 -10.238   9.357
  721    HA   LEU  89           HA       LEU  89   7.935 -13.069   8.569
  722   1HB   LEU  89          1HB       LEU  89   6.638 -11.019   7.283
  723   2HB   LEU  89          2HB       LEU  89   8.162 -11.086   6.420
  724    HG   LEU  89           HG       LEU  89   7.802 -13.468   5.928
  725   1HD1  LEU  89          1HD1      LEU  89   5.034 -13.760   6.519
  726   2HD1  LEU  89          2HD1      LEU  89   6.411 -14.713   7.121
  727   3HD1  LEU  89          3HD1      LEU  89   5.868 -13.273   8.015
  728   1HD2  LEU  89          1HD2      LEU  89   6.362 -13.136   4.156
  729   2HD2  LEU  89          2HD2      LEU  89   5.273 -12.085   5.092
  730   3HD2  LEU  89          3HD2      LEU  89   6.851 -11.471   4.547
  731    H    ARG  90           H        ARG  90   9.692 -12.532   6.279
  732    HA   ARG  90           HA       ARG  90  12.049 -11.509   7.598
  733   1HB   ARG  90          1HB       ARG  90  12.057 -14.195   6.139
  734   2HB   ARG  90          2HB       ARG  90  13.393 -13.476   7.018
  735   1HG   ARG  90          1HG       ARG  90  11.357 -13.514   8.934
  736   2HG   ARG  90          2HG       ARG  90  11.064 -14.994   8.042
  737   1HD   ARG  90          1HD       ARG  90  13.543 -15.561   8.329
  738   2HD   ARG  90          2HD       ARG  90  13.684 -14.168   9.380
  739    HE   ARG  90           HE       ARG  90  11.537 -16.064  10.096
  740   1HH1  ARG  90          2HH2      ARG  90  14.887 -15.056  10.645
  741   2HH1  ARG  90          1HH2      ARG  90  15.000 -15.836  12.188
  742   1HH2  ARG  90          1HH       ARG  90  13.104 -17.028  13.041
  743    H    ILE  91           H        ILE  91  10.460 -12.823   4.634
  744    HA   ILE  91           HA       ILE  91  12.187 -12.311   2.679
  745    HB   ILE  91           HB       ILE  91  10.093 -11.476   1.385
  746   1HG1  ILE  91          1HG1      ILE  91   8.384 -12.750   3.393
  747   2HG1  ILE  91          2HG1      ILE  91   9.074 -11.241   3.956
  748   1HG2  ILE  91          1HG2      ILE  91  11.040 -14.050   2.241
  749   2HG2  ILE  91          2HG2      ILE  91   9.265 -14.078   2.101
  750   3HG2  ILE  91          3HG2      ILE  91  10.258 -13.580   0.711
  751   1HD1  ILE  91          1HD1      ILE  91   7.843  -9.986   2.496
  752   2HD1  ILE  91          2HD1      ILE  91   8.099 -11.128   1.155
  753   3HD1  ILE  91          3HD1      ILE  91   6.829 -11.442   2.362
  754    H    VAL  92           H        VAL  92  10.501  -9.873   4.670
  755    HA   VAL  92           HA       VAL  92  10.433  -7.603   4.322
  756    HB   VAL  92           HB       VAL  92  13.316  -8.306   4.910
  757   1HG1  VAL  92          1HG1      VAL  92  13.604  -6.076   4.658
  758   2HG1  VAL  92          2HG1      VAL  92  11.866  -5.725   4.808
  759   3HG1  VAL  92          3HG1      VAL  92  12.849  -5.997   6.268
  760   1HG2  VAL  92          1HG2      VAL  92  10.825  -8.473   6.468
  761   2HG2  VAL  92          2HG2      VAL  92  12.404  -9.250   6.737
  762   3HG2  VAL  92          3HG2      VAL  92  12.130  -7.579   7.285
  763    HA   PRO  93           HA       PRO  93  12.145  -7.542   0.081
  764   1HB   PRO  93          1HB       PRO  93   9.809  -7.445  -1.333
  765   2HB   PRO  93          2HB       PRO  93  10.693  -8.929  -1.044
  766   1HG   PRO  93          1HG       PRO  93   8.200  -7.979   0.230
  767   2HG   PRO  93          2HG       PRO  93   8.858  -9.603   0.182
  768   1HD   PRO  93          1HD       PRO  93   8.926  -7.788   2.403
  769   2HD   PRO  93          2HD       PRO  93   9.685  -9.365   2.315
  770    H    GLU  94           H        GLU  94  12.100  -5.824  -1.584
  771    HA   GLU  94           HA       GLU  94  11.902  -3.390  -0.211
  772   1HB   GLU  94          1HB       GLU  94  13.327  -4.211  -2.346
  773   2HB   GLU  94          2HB       GLU  94  12.003  -3.459  -3.214
  774   1HG   GLU  94          1HG       GLU  94  12.377  -1.323  -2.083
  775   2HG   GLU  94          2HG       GLU  94  13.539  -2.046  -0.989
  776    HE2  GLU  94           HE       GLU  94  14.770  -0.583  -4.355
  777    H    LEU  95           H        LEU  95   9.528  -3.862   0.452
  778    HA   LEU  95           HA       LEU  95   7.539  -3.605  -1.551
  779   1HB   LEU  95          1HB       LEU  95   7.596  -4.547   0.973
  780   2HB   LEU  95          2HB       LEU  95   6.921  -2.958   1.273
  781    HG   LEU  95           HG       LEU  95   5.503  -4.035  -0.940
  782   1HD1  LEU  95          1HD1      LEU  95   5.193  -5.981   1.303
  783   2HD1  LEU  95          2HD1      LEU  95   4.879  -6.171  -0.439
  784   3HD1  LEU  95          3HD1      LEU  95   6.550  -6.202   0.172
  785   1HD2  LEU  95          1HD2      LEU  95   4.914  -3.271   1.894
  786   2HD2  LEU  95          2HD2      LEU  95   4.312  -2.578   0.368
  787   3HD2  LEU  95          3HD2      LEU  95   3.673  -4.134   0.952
  788    H    THR  96           H        THR  96   8.055  -1.749  -2.796
  789    HA   THR  96           HA       THR  96   8.432   0.781  -1.527
  790    HB   THR  96           HB       THR  96   9.216  -0.216  -3.880
  791    HG1  THR  96           HG1      THR  96   9.784   1.907  -3.257
  792   1HG2  THR  96          1HG2      THR  96   6.470  -0.048  -4.398
  793   2HG2  THR  96          2HG2      THR  96   7.084   1.503  -5.020
  794   3HG2  THR  96          3HG2      THR  96   7.747  -0.030  -5.640
  795    H    PHE  97           H        PHE  97   6.996   2.705  -2.361
  796    HA   PHE  97           HA       PHE  97   4.195   1.874  -2.129
  797   1HB   PHE  97          1HB       PHE  97   5.789   3.154  -0.180
  798   2HB   PHE  97          2HB       PHE  97   5.008   4.508  -0.972
  799    HD1  PHE  97           HD1      PHE  97   3.559   1.140  -0.404
  800    HD2  PHE  97           HD2      PHE  97   3.535   5.236   0.702
  801    HE1  PHE  97           HE1      PHE  97   1.495   0.756   0.972
  802    HE2  PHE  97           HE2      PHE  97   1.472   4.853   2.079
  803    HZ   PHE  97           HZ       PHE  97   0.477   2.618   2.198
  804    H    PHE  98           H        PHE  98   3.227   2.427  -4.026
  805    HA   PHE  98           HA       PHE  98   4.182   4.860  -5.343
  806   1HB   PHE  98          1HB       PHE  98   3.264   2.155  -6.101
  807   2HB   PHE  98          2HB       PHE  98   2.307   3.368  -6.928
  808    HD1  PHE  98           HD1      PHE  98   5.563   1.792  -6.671
  809    HD2  PHE  98           HD2      PHE  98   3.396   4.965  -8.471
  810    HE1  PHE  98           HE1      PHE  98   7.390   2.077  -8.368
  811    HE2  PHE  98           HE2      PHE  98   5.222   5.250 -10.168
  812    HZ   PHE  98           HZ       PHE  98   7.198   3.803 -10.097
  813    H    TYR  99           H        TYR  99   2.953   6.669  -5.173
  814    HA   TYR  99           HA       TYR  99   0.188   6.339  -4.292
  815   1HB   TYR  99          1HB       TYR  99   1.524   9.008  -4.742
  816   2HB   TYR  99          2HB       TYR  99   0.569   8.489  -3.366
  817    HD1  TYR  99           HD1      TYR  99   1.602   7.367  -1.462
  818    HD2  TYR  99           HD2      TYR  99   3.939   8.550  -4.845
  819    HE1  TYR  99           HE1      TYR  99   3.735   7.023  -0.119
  820    HE2  TYR  99           HE2      TYR  99   6.062   8.202  -3.491
  821    HH   TYR  99           HH       TYR  99   6.633   6.647  -1.409
  822    H    ASP 100           H        ASP 100  -1.230   6.058  -5.964
  823    HA   ASP 100           HA       ASP 100  -0.758   7.701  -8.318
  824   1HB   ASP 100          1HB       ASP 100  -1.199   5.001  -8.166
  825   2HB   ASP 100          2HB       ASP 100  -2.854   5.557  -8.321
  826    HD2  ASP 100           HD       ASP 100  -3.227   6.622 -10.791
  827    H    ASN 101           H        ASN 101  -1.817   9.653  -7.610
  828    HA   ASN 101           HA       ASN 101  -4.512   9.351  -6.607
  829   1HB   ASN 101          1HB       ASN 101  -4.240  11.945  -6.351
  830   2HB   ASN 101          2HB       ASN 101  -3.298  10.921  -5.287
  831   1HD2  ASN 101          1HD2      ASN 101  -1.331  11.618  -5.017
  832   2HD2  ASN 101          2HD2      ASN 101  -0.297  12.347  -6.198
  833    H    SER 102           H        SER 102  -5.734  11.711  -7.480
  834    HA   SER 102           HA       SER 102  -5.989  11.154 -10.290
  835   1HB   SER 102          1HB       SER 102  -7.956  11.433  -8.659
  836   2HB   SER 102          2HB       SER 102  -7.580  13.144  -8.621
  837    HG   SER 102           HG       SER 102  -8.801  13.284 -10.369
  838    H    LEU 103           H        LEU 103  -3.690  12.730  -8.813
  839    HA   LEU 103           HA       LEU 103  -3.966  15.268 -10.237
  840   1HB   LEU 103          1HB       LEU 103  -3.459  15.248  -7.804
  841   2HB   LEU 103          2HB       LEU 103  -1.951  14.424  -8.149
  842    HG   LEU 103           HG       LEU 103  -2.113  16.792  -9.777
  843   1HD1  LEU 103          1HD1      LEU 103  -1.982  18.437  -7.840
  844   2HD1  LEU 103          2HD1      LEU 103  -3.598  17.823  -8.268
  845   3HD1  LEU 103          3HD1      LEU 103  -2.743  17.169  -6.848
  846   1HD2  LEU 103          1HD2      LEU 103  -0.199  15.307  -8.439
  847   2HD2  LEU 103          2HD2      LEU 103   0.066  16.836  -9.311
  848   3HD2  LEU 103          3HD2      LEU 103  -0.221  16.851  -7.554
  849    H    VAL 104           H        VAL 104  -3.020  12.197 -10.928
  850    HA   VAL 104           HA       VAL 104  -0.896  13.180 -12.700
  851    HB   VAL 104           HB       VAL 104  -0.884  10.975 -10.732
  852   1HG1  VAL 104          1HG1      VAL 104   0.698   9.618 -12.105
  853   2HG1  VAL 104          2HG1      VAL 104  -0.967   9.625 -12.736
  854   3HG1  VAL 104          3HG1      VAL 104   0.285  10.626 -13.512
  855   1HG2  VAL 104          1HG2      VAL 104   1.606  11.441 -10.917
  856   2HG2  VAL 104          2HG2      VAL 104   1.188  12.759 -12.035
  857   3HG2  VAL 104          3HG2      VAL 104   0.599  12.796 -10.356
  858    H    GLU 105           H        GLU 105  -4.009  12.001 -12.383
  859    HA   GLU 105           HA       GLU 105  -3.912  11.072 -15.119
  860   1HB   GLU 105          1HB       GLU 105  -5.450   9.502 -13.018
  861   2HB   GLU 105          2HB       GLU 105  -5.163   9.056 -14.688
  862   1HG   GLU 105          1HG       GLU 105  -2.586   9.285 -13.930
  863   2HG   GLU 105          2HG       GLU 105  -3.269   8.974 -12.345
  864    HE2  GLU 105           HE       GLU 105  -3.880   7.537 -15.578
  865    H    GLY 106           H        GLY 106  -5.830  12.021 -12.220
  866   1HA   GLY 106          1HA       GLY 106  -7.449  13.669 -12.201
  867   2HA   GLY 106          2HA       GLY 106  -7.586  13.585 -13.945
  868    H    MET 107           H        MET 107  -7.504  10.521 -12.226
  869    HA   MET 107           HA       MET 107 -10.338  10.412 -11.911
  870   1HB   MET 107          1HB       MET 107 -10.809   8.814 -13.620
  871   2HB   MET 107          2HB       MET 107  -9.698   9.906 -14.423
  872   1HG   MET 107          1HG       MET 107  -8.023   8.019 -13.130
  873   2HG   MET 107          2HG       MET 107  -9.351   7.065 -13.763
  874   1HE   MET 107          1HE       MET 107  -6.438   9.736 -16.022
  875   2HE   MET 107          2HE       MET 107  -8.012  10.510 -15.712
  876   3HE   MET 107          3HE       MET 107  -7.033   9.907 -14.353
  877    H    ARG 108           H        ARG 108  -7.983  10.183 -10.186
  878    HA   ARG 108           HA       ARG 108  -8.302   7.385  -9.445
  879   1HB   ARG 108          1HB       ARG 108  -5.868   9.031  -9.812
  880   2HB   ARG 108          2HB       ARG 108  -5.905   8.238  -8.250
  881   1HG   ARG 108          1HG       ARG 108  -4.869   6.632  -9.650
  882   2HG   ARG 108          2HG       ARG 108  -6.526   6.070  -9.553
  883   1HD   ARG 108          1HD       ARG 108  -6.561   7.867 -11.725
  884   2HD   ARG 108          2HD       ARG 108  -5.022   7.046 -11.893
  885    HE   ARG 108           HE       ARG 108  -7.692   5.835 -12.138
  886   1HH1  ARG 108          2HH2      ARG 108  -4.234   5.217 -11.677
  887   2HH1  ARG 108          1HH2      ARG 108  -4.326   3.577 -12.230
  888   1HH2  ARG 108          1HH       ARG 108  -6.443   2.691 -12.925
  Start of MODEL    3
    1    H    MET   1           H        MET   1 -13.690  -8.908  -1.665
    2    HA   MET   1           HA       MET   1 -11.925  -9.843  -3.257
    3   1HB   MET   1          1HB       MET   1 -11.886  -7.680  -1.237
    4   2HB   MET   1          2HB       MET   1 -10.263  -8.206  -1.638
    5   1HG   MET   1          1HG       MET   1 -10.852  -6.429  -3.187
    6   2HG   MET   1          2HG       MET   1 -10.832  -7.927  -4.097
    7   1HE   MET   1          1HE       MET   1 -14.061  -4.992  -4.122
    8   2HE   MET   1          2HE       MET   1 -13.136  -5.054  -2.603
    9   3HE   MET   1          3HE       MET   1 -12.284  -4.905  -4.160
   10    H    ALA   2           H        ALA   2 -11.145 -11.962  -3.063
   11    HA   ALA   2           HA       ALA   2  -8.767 -12.355  -1.709
   12   1HB   ALA   2          1HB       ALA   2  -9.910 -14.184  -0.098
   13   2HB   ALA   2          2HB       ALA   2  -9.627 -12.504   0.416
   14   3HB   ALA   2          3HB       ALA   2 -11.239 -13.000  -0.152
   15    H    LYS   3           H        LYS   3  -8.158 -14.793  -1.759
   16    HA   LYS   3           HA       LYS   3  -9.787 -16.302  -3.623
   17   1HB   LYS   3          1HB       LYS   3  -8.319 -14.899  -5.049
   18   2HB   LYS   3          2HB       LYS   3  -6.911 -15.579  -4.260
   19   1HG   LYS   3          1HG       LYS   3  -7.203 -17.693  -5.233
   20   2HG   LYS   3          2HG       LYS   3  -8.936 -17.498  -5.403
   21   1HD   LYS   3          1HD       LYS   3  -8.591 -15.841  -7.229
   22   2HD   LYS   3          2HD       LYS   3  -6.854 -15.978  -7.042
   23   1HE   LYS   3          1HE       LYS   3  -6.773 -18.129  -7.980
   24   2HE   LYS   3          2HE       LYS   3  -8.414 -18.518  -7.503
   25   1HZ   LYS   3          1HZ       LYS   3  -8.863 -18.031  -9.658
   26   2HZ   LYS   3          2HZ       LYS   3  -8.806 -16.466  -9.211
   27    H    GLU   4           H        GLU   4 -10.152 -17.644  -1.768
   28    HA   GLU   4           HA       GLU   4  -7.952 -18.678  -0.343
   29   1HB   GLU   4          1HB       GLU   4  -9.774 -20.302   0.528
   30   2HB   GLU   4          2HB       GLU   4  -9.981 -18.594   0.867
   31   1HG   GLU   4          1HG       GLU   4 -11.152 -19.406  -1.731
   32   2HG   GLU   4          2HG       GLU   4 -11.861 -20.251  -0.370
   33    HE2  GLU   4           HE       GLU   4 -11.869 -18.293   1.544
   34    H    PHE   5           H        PHE   5  -6.523 -19.570  -1.954
   35    HA   PHE   5           HA       PHE   5  -7.370 -22.220  -2.799
   36   1HB   PHE   5          1HB       PHE   5  -7.448 -20.030  -4.517
   37   2HB   PHE   5          2HB       PHE   5  -5.790 -20.547  -4.748
   38    HD1  PHE   5           HD1      PHE   5  -7.040 -23.540  -4.028
   39    HD2  PHE   5           HD2      PHE   5  -7.548 -20.571  -7.016
   40    HE1  PHE   5           HE1      PHE   5  -7.813 -25.298  -5.644
   41    HE2  PHE   5           HE2      PHE   5  -8.321 -22.328  -8.632
   42    HZ   PHE   5           HZ       PHE   5  -8.444 -24.671  -7.927
   43    H    GLY   6           H        GLY   6  -5.219 -23.134  -4.135
   44   1HA   GLY   6          1HA       GLY   6  -3.096 -22.932  -2.129
   45   2HA   GLY   6          2HA       GLY   6  -3.303 -24.185  -3.336
   46    H    ARG   7           H        ARG   7  -3.946 -21.303  -4.935
   47    HA   ARG   7           HA       ARG   7  -1.422 -21.429  -6.222
   48   1HB   ARG   7          1HB       ARG   7  -4.070 -20.412  -6.803
   49   2HB   ARG   7          2HB       ARG   7  -2.930 -19.104  -7.044
   50   1HG   ARG   7          1HG       ARG   7  -1.550 -21.108  -8.276
   51   2HG   ARG   7          2HG       ARG   7  -3.179 -21.707  -8.518
   52   1HD   ARG   7          1HD       ARG   7  -3.569 -20.172 -10.149
   53   2HD   ARG   7          2HD       ARG   7  -3.125 -18.853  -9.085
   54    HE   ARG   7           HE       ARG   7  -0.945 -18.859  -9.984
   55   1HH1  ARG   7          2HH2      ARG   7  -2.701 -21.734 -11.084
   56   2HH1  ARG   7          1HH2      ARG   7  -1.504 -22.165 -12.260
   57   1HH2  ARG   7          1HH       ARG   7   0.447 -20.796 -12.509
   58    HA   PRO   8           HA       PRO   8   0.396 -17.862  -4.458
   59   1HB   PRO   8          1HB       PRO   8   1.239 -16.269  -6.512
   60   2HB   PRO   8          2HB       PRO   8   2.091 -17.717  -6.010
   61   1HG   PRO   8          1HG       PRO   8   0.386 -17.301  -8.389
   62   2HG   PRO   8          2HG       PRO   8   1.564 -18.562  -8.091
   63   1HD   PRO   8          1HD       PRO   8  -1.289 -18.808  -7.934
   64   2HD   PRO   8          2HD       PRO   8  -0.107 -20.034  -7.523
   65    H    GLN   9           H        GLN   9  -2.532 -17.597  -5.767
   66    HA   GLN   9           HA       GLN   9  -2.710 -14.747  -5.504
   67   1HB   GLN   9          1HB       GLN   9  -4.082 -16.669  -6.996
   68   2HB   GLN   9          2HB       GLN   9  -5.244 -16.246  -5.754
   69   1HG   GLN   9          1HG       GLN   9  -5.453 -14.050  -6.489
   70   2HG   GLN   9          2HG       GLN   9  -3.793 -13.956  -7.041
   71   1HE2  GLN   9          1HE2      GLN   9  -5.625 -12.926  -8.637
   72   2HE2  GLN   9          2HE2      GLN   9  -5.924 -13.900 -10.038
   73    H    ARG  10           H        ARG  10  -3.454 -17.703  -3.669
   74    HA   ARG  10           HA       ARG  10  -5.251 -16.609  -1.895
   75   1HB   ARG  10          1HB       ARG  10  -4.481 -19.091  -2.258
   76   2HB   ARG  10          2HB       ARG  10  -3.194 -18.724  -1.127
   77   1HG   ARG  10          1HG       ARG  10  -6.060 -18.065  -0.390
   78   2HG   ARG  10          2HG       ARG  10  -5.490 -19.715  -0.244
   79   1HD   ARG  10          1HD       ARG  10  -3.497 -17.940   0.902
   80   2HD   ARG  10          2HD       ARG  10  -5.064 -17.539   1.579
   81    HE   ARG  10           HE       ARG  10  -5.101 -20.257   1.778
   82   1HH1  ARG  10          2HH2      ARG  10  -2.597 -17.907   2.651
   83   2HH1  ARG  10          1HH2      ARG  10  -1.951 -18.884   3.928
   84   1HH2  ARG  10          1HH       ARG  10  -2.938 -21.018   4.386
   85    H    VAL  11           H        VAL  11  -1.642 -16.981  -1.707
   86    HA   VAL  11           HA       VAL  11  -1.440 -15.720   0.815
   87    HB   VAL  11           HB       VAL  11   0.399 -16.633  -1.346
   88   1HG1  VAL  11          1HG1      VAL  11   1.289 -14.849   0.946
   89   2HG1  VAL  11          2HG1      VAL  11   2.356 -15.703  -0.193
   90   3HG1  VAL  11          3HG1      VAL  11   1.282 -14.409  -0.779
   91   1HG2  VAL  11          1HG2      VAL  11   0.835 -17.119   1.569
   92   2HG2  VAL  11          2HG2      VAL  11  -0.572 -17.891   0.798
   93   3HG2  VAL  11          3HG2      VAL  11   1.067 -18.205   0.177
   94    H    ALA  12           H        ALA  12  -1.283 -14.624  -2.602
   95    HA   ALA  12           HA       ALA  12  -0.316 -12.062  -2.105
   96   1HB   ALA  12          1HB       ALA  12  -1.982 -11.827  -4.308
   97   2HB   ALA  12          2HB       ALA  12  -0.287 -12.373  -4.345
   98   3HB   ALA  12          3HB       ALA  12  -1.606 -13.567  -4.282
   99    H    GLN  13           H        GLN  13  -3.654 -13.431  -2.096
  100    HA   GLN  13           HA       GLN  13  -4.912 -10.971  -1.767
  101   1HB   GLN  13          1HB       GLN  13  -5.776 -13.807  -1.067
  102   2HB   GLN  13          2HB       GLN  13  -6.844 -12.426  -0.934
  103   1HG   GLN  13          1HG       GLN  13  -6.198 -13.952  -3.288
  104   2HG   GLN  13          2HG       GLN  13  -7.329 -12.621  -3.139
  105   1HE2  GLN  13          1HE2      GLN  13  -6.554 -10.451  -3.356
  106   2HE2  GLN  13          2HE2      GLN  13  -5.179 -10.090  -4.345
  107    H    GLU  14           H        GLU  14  -4.425 -13.625   0.683
  108    HA   GLU  14           HA       GLU  14  -5.251 -12.362   2.866
  109   1HB   GLU  14          1HB       GLU  14  -3.373 -14.523   2.274
  110   2HB   GLU  14          2HB       GLU  14  -2.879 -13.659   3.716
  111   1HG   GLU  14          1HG       GLU  14  -5.134 -13.956   4.705
  112   2HG   GLU  14          2HG       GLU  14  -5.700 -14.734   3.241
  113    HE2  GLU  14           HE       GLU  14  -5.354 -17.307   5.166
  114    H    MET  15           H        MET  15  -2.136 -11.842   1.164
  115    HA   MET  15           HA       MET  15  -1.144 -10.139   3.206
  116   1HB   MET  15          1HB       MET  15  -0.301 -11.158   0.510
  117   2HB   MET  15          2HB       MET  15   0.367  -9.597   0.944
  118   1HG   MET  15          1HG       MET  15   1.300 -10.516   3.034
  119   2HG   MET  15          2HG       MET  15   0.513 -12.057   2.752
  120   1HE   MET  15          1HE       MET  15   3.419 -10.866   3.230
  121   2HE   MET  15          2HE       MET  15   4.600 -11.539   2.081
  122   3HE   MET  15          3HE       MET  15   3.862  -9.949   1.770
  123    H    GLN  16           H        GLN  16  -2.892  -9.767   0.104
  124    HA   GLN  16           HA       GLN  16  -2.453  -7.020  -0.126
  125   1HB   GLN  16          1HB       GLN  16  -3.311  -8.762  -1.877
  126   2HB   GLN  16          2HB       GLN  16  -4.899  -8.460  -1.202
  127   1HG   GLN  16          1HG       GLN  16  -3.379  -5.979  -1.782
  128   2HG   GLN  16          2HG       GLN  16  -3.683  -6.953  -3.205
  129   1HE2  GLN  16          1HE2      GLN  16  -4.928  -4.932  -3.666
  130   2HE2  GLN  16          2HE2      GLN  16  -6.596  -4.875  -3.201
  131    H    LYS  17           H        LYS  17  -4.846  -9.014   1.618
  132    HA   LYS  17           HA       LYS  17  -6.545  -6.788   2.201
  133   1HB   LYS  17          1HB       LYS  17  -7.930  -8.331   3.251
  134   2HB   LYS  17          2HB       LYS  17  -7.186  -9.271   1.974
  135   1HG   LYS  17          1HG       LYS  17  -5.664 -10.346   3.494
  136   2HG   LYS  17          2HG       LYS  17  -5.971  -9.175   4.761
  137   1HD   LYS  17          1HD       LYS  17  -8.525 -10.220   4.190
  138   2HD   LYS  17          2HD       LYS  17  -7.470 -11.615   4.074
  139   1HE   LYS  17          1HE       LYS  17  -6.564 -11.179   6.330
  140   2HE   LYS  17          2HE       LYS  17  -7.478  -9.688   6.444
  141   1HZ   LYS  17          1HZ       LYS  17  -8.883 -11.165   7.500
  142   2HZ   LYS  17          2HZ       LYS  17  -9.482 -11.305   5.992
  143    H    GLU  18           H        GLU  18  -3.893  -8.595   3.813
  144    HA   GLU  18           HA       GLU  18  -4.228  -7.324   6.278
  145   1HB   GLU  18          1HB       GLU  18  -2.984  -9.478   5.887
  146   2HB   GLU  18          2HB       GLU  18  -1.705  -8.572   5.102
  147   1HG   GLU  18          1HG       GLU  18  -0.798  -8.511   7.208
  148   2HG   GLU  18          2HG       GLU  18  -1.883  -7.152   7.427
  149    HE2  GLU  18           HE       GLU  18  -2.467 -10.566   9.349
  150    H    ILE  19           H        ILE  19  -2.188  -6.644   3.378
  151    HA   ILE  19           HA       ILE  19  -0.886  -4.433   4.610
  152    HB   ILE  19           HB       ILE  19   0.182  -4.133   2.540
  153   1HG1  ILE  19          1HG1      ILE  19  -2.089  -5.716   1.313
  154   2HG1  ILE  19          2HG1      ILE  19  -1.692  -4.030   1.039
  155   1HG2  ILE  19          1HG2      ILE  19  -0.130  -6.805   3.641
  156   2HG2  ILE  19          2HG2      ILE  19   0.311  -6.840   1.917
  157   3HG2  ILE  19          3HG2      ILE  19   1.331  -5.959   3.079
  158   1HD1  ILE  19          1HD1      ILE  19   0.707  -5.185   0.390
  159   2HD1  ILE  19          2HD1      ILE  19  -0.418  -6.485  -0.073
  160   3HD1  ILE  19          3HD1      ILE  19  -0.586  -4.865  -0.792
  161    H    ALA  20           H        ALA  20  -3.725  -4.916   2.457
  162    HA   ALA  20           HA       ALA  20  -4.166  -2.236   1.857
  163   1HB   ALA  20          1HB       ALA  20  -5.976  -4.663   2.086
  164   2HB   ALA  20          2HB       ALA  20  -6.560  -3.080   1.523
  165   3HB   ALA  20          3HB       ALA  20  -5.291  -3.934   0.614
  166    H    LEU  21           H        LEU  21  -4.953  -4.225   4.726
  167    HA   LEU  21           HA       LEU  21  -6.694  -2.295   5.864
  168   1HB   LEU  21          1HB       LEU  21  -6.929  -4.595   6.434
  169   2HB   LEU  21          2HB       LEU  21  -5.258  -4.713   6.947
  170    HG   LEU  21           HG       LEU  21  -6.438  -2.668   8.521
  171   1HD1  LEU  21          1HD1      LEU  21  -8.258  -4.996   8.028
  172   2HD1  LEU  21          2HD1      LEU  21  -8.180  -4.267   9.649
  173   3HD1  LEU  21          3HD1      LEU  21  -8.640  -3.272   8.247
  174   1HD2  LEU  21          1HD2      LEU  21  -4.586  -4.362   9.019
  175   2HD2  LEU  21          2HD2      LEU  21  -5.716  -3.966  10.335
  176   3HD2  LEU  21          3HD2      LEU  21  -5.897  -5.492   9.435
  177    H    ILE  22           H        ILE  22  -3.338  -3.361   6.785
  178    HA   ILE  22           HA       ILE  22  -2.924  -1.256   8.552
  179    HB   ILE  22           HB       ILE  22  -0.936  -2.891   6.973
  180   1HG1  ILE  22          1HG1      ILE  22  -1.920  -3.350   9.797
  181   2HG1  ILE  22          2HG1      ILE  22  -2.626  -4.139   8.401
  182   1HG2  ILE  22          1HG2      ILE  22  -0.126  -0.704   8.036
  183   2HG2  ILE  22          2HG2      ILE  22  -0.417  -1.503   9.600
  184   3HG2  ILE  22          3HG2      ILE  22   0.747  -2.199   8.447
  185   1HD1  ILE  22          1HD1      ILE  22   0.269  -4.332   9.342
  186   2HD1  ILE  22          2HD1      ILE  22  -0.947  -5.631   9.320
  187   3HD1  ILE  22          3HD1      ILE  22  -0.307  -4.987   7.790
  188    H    LEU  23           H        LEU  23  -3.065  -1.340   5.080
  189    HA   LEU  23           HA       LEU  23  -1.448   1.042   4.793
  190   1HB   LEU  23          1HB       LEU  23  -1.257  -0.695   3.136
  191   2HB   LEU  23          2HB       LEU  23  -2.981  -0.667   2.833
  192    HG   LEU  23           HG       LEU  23  -1.433   1.859   2.405
  193   1HD1  LEU  23          1HD1      LEU  23  -0.414  -0.414   1.308
  194   2HD1  LEU  23          2HD1      LEU  23  -1.564   0.092   0.047
  195   3HD1  LEU  23          3HD1      LEU  23  -0.287   1.208   0.586
  196   1HD2  LEU  23          1HD2      LEU  23  -3.205   2.503   1.167
  197   2HD2  LEU  23          2HD2      LEU  23  -3.457   0.882   0.476
  198   3HD2  LEU  23          3HD2      LEU  23  -4.048   1.254   2.114
  199    H    GLN  24           H        GLN  24  -4.707   0.174   5.544
  200    HA   GLN  24           HA       GLN  24  -5.563   2.839   4.725
  201   1HB   GLN  24          1HB       GLN  24  -6.914   0.177   4.742
  202   2HB   GLN  24          2HB       GLN  24  -7.907   1.523   5.261
  203   1HG   GLN  24          1HG       GLN  24  -6.860   2.702   3.086
  204   2HG   GLN  24          2HG       GLN  24  -6.611   1.044   2.576
  205   1HE2  GLN  24          1HE2      GLN  24  -8.133   0.388   1.281
  206   2HE2  GLN  24          2HE2      GLN  24  -9.832   0.707   1.396
  207    H    ARG  25           H        ARG  25  -4.687   0.847   7.367
  208    HA   ARG  25           HA       ARG  25  -6.333   2.426   9.164
  209   1HB   ARG  25          1HB       ARG  25  -5.787  -0.336   9.093
  210   2HB   ARG  25          2HB       ARG  25  -4.750   0.243  10.382
  211   1HG   ARG  25          1HG       ARG  25  -6.730   1.384  11.437
  212   2HG   ARG  25          2HG       ARG  25  -7.757   0.752  10.165
  213   1HD   ARG  25          1HD       ARG  25  -7.675  -1.432  10.981
  214   2HD   ARG  25          2HD       ARG  25  -6.059  -1.248  11.636
  215    HE   ARG  25           HE       ARG  25  -8.508  -0.824  13.067
  216   1HH1  ARG  25          2HH2      ARG  25  -5.279   0.597  12.723
  217   2HH1  ARG  25          1HH2      ARG  25  -5.271   1.273  14.318
  218   1HH2  ARG  25          1HH       ARG  25  -7.172   0.949  15.740
  219    H    GLU  26           H        GLU  26  -3.028   0.876   9.115
  220    HA   GLU  26           HA       GLU  26  -1.992   2.620  11.011
  221   1HB   GLU  26          1HB       GLU  26  -0.323   1.104  10.918
  222   2HB   GLU  26          2HB       GLU  26  -1.125   0.338   9.563
  223   1HG   GLU  26          1HG       GLU  26   0.982   0.855   8.652
  224   2HG   GLU  26          2HG       GLU  26   0.011   2.207   8.106
  225    HE2  GLU  26           HE       GLU  26   0.415   3.879  10.824
  226    H    ILE  27           H        ILE  27  -2.814   3.101   7.704
  227    HA   ILE  27           HA       ILE  27  -0.789   5.104   7.234
  228    HB   ILE  27           HB       ILE  27  -2.075   3.394   5.610
  229   1HG1  ILE  27          1HG1      ILE  27  -0.795   6.068   5.054
  230   2HG1  ILE  27          2HG1      ILE  27  -0.103   4.465   4.905
  231   1HG2  ILE  27          1HG2      ILE  27  -4.259   4.345   5.796
  232   2HG2  ILE  27          2HG2      ILE  27  -3.639   5.982   5.467
  233   3HG2  ILE  27          3HG2      ILE  27  -3.624   4.750   4.182
  234   1HD1  ILE  27          1HD1      ILE  27  -2.132   5.816   3.102
  235   2HD1  ILE  27          2HD1      ILE  27  -0.579   5.063   2.666
  236   3HD1  ILE  27          3HD1      ILE  27  -1.966   4.044   3.115
  237    H    LYS  28           H        LYS  28  -1.907   7.233   6.109
  238    HA   LYS  28           HA       LYS  28  -3.632   8.259   8.244
  239   1HB   LYS  28          1HB       LYS  28  -2.796  10.484   7.547
  240   2HB   LYS  28          2HB       LYS  28  -1.529   9.416   8.112
  241   1HG   LYS  28          1HG       LYS  28  -1.769   8.933   5.305
  242   2HG   LYS  28          2HG       LYS  28  -1.825  10.674   5.503
  243   1HD   LYS  28          1HD       LYS  28   0.501  10.125   5.292
  244   2HD   LYS  28          2HD       LYS  28   0.254  10.476   6.992
  245   1HE   LYS  28          1HE       LYS  28  -0.009   7.622   5.992
  246   2HE   LYS  28          2HE       LYS  28   1.581   8.297   6.281
  247   1HZ   LYS  28          1HZ       LYS  28   0.502   7.151   8.242
  248   2HZ   LYS  28          2HZ       LYS  28   1.048   8.650   8.560
  249    H    ASP  29           H        ASP  29  -5.440   7.064   7.131
  250    HA   ASP  29           HA       ASP  29  -6.183   8.188   4.598
  251   1HB   ASP  29          1HB       ASP  29  -7.060   6.103   4.421
  252   2HB   ASP  29          2HB       ASP  29  -6.765   5.788   6.119
  253    HD2  ASP  29           HD       ASP  29  -8.723   4.702   6.306
  254    HA   PRO  30           HA       PRO  30  -9.652   9.633   7.547
  255   1HB   PRO  30          1HB       PRO  30  -9.458   9.155  10.230
  256   2HB   PRO  30          2HB       PRO  30 -10.350   8.118   9.133
  257   1HG   PRO  30          1HG       PRO  30  -7.716   7.652  10.393
  258   2HG   PRO  30          2HG       PRO  30  -8.802   6.490   9.657
  259   1HD   PRO  30          1HD       PRO  30  -6.399   7.559   8.511
  260   2HD   PRO  30          2HD       PRO  30  -7.546   6.488   7.730
  261    H    ARG  31           H        ARG  31  -6.399  10.058   7.965
  262    HA   ARG  31           HA       ARG  31  -6.732  12.393   9.591
  263   1HB   ARG  31          1HB       ARG  31  -4.695  11.437  10.165
  264   2HB   ARG  31          2HB       ARG  31  -4.449  10.747   8.573
  265   1HG   ARG  31          1HG       ARG  31  -3.928  13.054   7.689
  266   2HG   ARG  31          2HG       ARG  31  -4.098  13.691   9.311
  267   1HD   ARG  31          1HD       ARG  31  -2.328  11.581   9.716
  268   2HD   ARG  31          2HD       ARG  31  -1.862  12.137   8.120
  269    HE   ARG  31           HE       ARG  31  -0.992  14.076   9.089
  270   1HH1  ARG  31          2HH2      ARG  31  -3.286  12.622  11.364
  271   2HH1  ARG  31          1HH2      ARG  31  -2.925  13.740  12.635
  272   1HH2  ARG  31          1HH       ARG  31  -1.293  15.455  12.262
  273    H    LEU  32           H        LEU  32  -6.274  11.446   6.195
  274    HA   LEU  32           HA       LEU  32  -5.660  14.142   5.373
  275   1HB   LEU  32          1HB       LEU  32  -5.839  11.463   4.068
  276   2HB   LEU  32          2HB       LEU  32  -5.995  12.895   3.068
  277    HG   LEU  32           HG       LEU  32  -3.807  13.545   3.384
  278   1HD1  LEU  32          1HD1      LEU  32  -3.753  13.731   5.764
  279   2HD1  LEU  32          2HD1      LEU  32  -3.804  11.962   5.963
  280   3HD1  LEU  32          3HD1      LEU  32  -2.363  12.739   5.263
  281   1HD2  LEU  32          1HD2      LEU  32  -2.505  11.772   2.711
  282   2HD2  LEU  32          2HD2      LEU  32  -3.269  10.633   3.846
  283   3HD2  LEU  32          3HD2      LEU  32  -4.139  11.147   2.380
  284    H    GLY  33           H        GLY  33  -8.441  12.301   6.175
  285   1HA   GLY  33          1HA       GLY  33 -10.596  13.066   6.225
  286   2HA   GLY  33          2HA       GLY  33 -10.161  14.418   5.198
  287    H    MET  34           H        MET  34  -8.919  11.424   3.994
  288    HA   MET  34           HA       MET  34 -11.317  10.884   2.481
  289   1HB   MET  34          1HB       MET  34  -8.612  11.302   1.104
  290   2HB   MET  34          2HB       MET  34 -10.166  11.081   0.323
  291   1HG   MET  34          1HG       MET  34 -10.965  13.251   1.147
  292   2HG   MET  34          2HG       MET  34  -9.535  13.454   2.140
  293   1HE   MET  34          1HE       MET  34  -7.129  15.099   0.330
  294   2HE   MET  34          2HE       MET  34  -7.539  13.984   1.656
  295   3HE   MET  34          3HE       MET  34  -6.731  13.370   0.194
  296    H    MET  35           H        MET  35 -11.094   8.798   1.185
  297    HA   MET  35           HA       MET  35  -9.322   7.027   2.669
  298   1HB   MET  35          1HB       MET  35 -11.964   6.790   2.525
  299   2HB   MET  35          2HB       MET  35 -11.667   6.169   0.914
  300   1HG   MET  35          1HG       MET  35  -9.818   4.822   2.637
  301   2HG   MET  35          2HG       MET  35 -11.359   4.815   3.473
  302   1HE   MET  35          1HE       MET  35 -13.668   3.777   2.330
  303   2HE   MET  35          2HE       MET  35 -13.234   2.102   1.914
  304   3HE   MET  35          3HE       MET  35 -12.562   2.859   3.379
  305    H    THR  36           H        THR  36  -8.141   5.339   1.518
  306    HA   THR  36           HA       THR  36  -7.726   6.026  -1.317
  307    HB   THR  36           HB       THR  36  -5.636   6.463  -0.399
  308    HG1  THR  36           HG1      THR  36  -4.470   4.593  -0.922
  309   1HG2  THR  36          1HG2      THR  36  -4.735   5.234   1.612
  310   2HG2  THR  36          2HG2      THR  36  -6.246   6.101   1.979
  311   3HG2  THR  36          3HG2      THR  36  -6.270   4.340   1.719
  312    H    THR  37           H        THR  37  -6.724   4.056  -2.552
  313    HA   THR  37           HA       THR  37  -8.081   1.599  -1.700
  314    HB   THR  37           HB       THR  37  -8.478   3.229  -4.228
  315    HG1  THR  37           HG1      THR  37 -10.082   1.448  -2.530
  316   1HG2  THR  37          1HG2      THR  37  -7.743   0.926  -4.987
  317   2HG2  THR  37          2HG2      THR  37  -8.998   0.222  -3.940
  318   3HG2  THR  37          3HG2      THR  37  -9.461   1.243  -5.322
  319    H    VAL  38           H        VAL  38  -7.333  -0.317  -3.082
  320    HA   VAL  38           HA       VAL  38  -4.491   0.079  -3.718
  321    HB   VAL  38           HB       VAL  38  -5.675  -2.423  -2.529
  322   1HG1  VAL  38          1HG1      VAL  38  -2.816  -1.480  -2.340
  323   2HG1  VAL  38          2HG1      VAL  38  -3.472  -3.128  -2.192
  324   3HG1  VAL  38          3HG1      VAL  38  -3.408  -2.336  -3.785
  325   1HG2  VAL  38          1HG2      VAL  38  -5.178   0.120  -1.210
  326   2HG2  VAL  38          2HG2      VAL  38  -5.936  -1.361  -0.580
  327   3HG2  VAL  38          3HG2      VAL  38  -4.166  -1.177  -0.530
  328    H    SER  39           H        SER  39  -5.403   0.512  -5.924
  329    HA   SER  39           HA       SER  39  -6.667  -1.712  -7.186
  330   1HB   SER  39          1HB       SER  39  -6.461   1.079  -7.657
  331   2HB   SER  39          2HB       SER  39  -5.655   0.326  -9.019
  332    HG   SER  39           HG       SER  39  -8.153  -0.781  -8.209
  333    H    GLY  40           H        GLY  40  -3.643  -1.441  -6.094
  334   1HA   GLY  40          1HA       GLY  40  -2.540  -3.110  -8.199
  335   2HA   GLY  40          2HA       GLY  40  -1.739  -1.571  -7.962
  336    H    VAL  41           H        VAL  41  -1.369  -4.712  -7.233
  337    HA   VAL  41           HA       VAL  41   0.106  -4.087  -4.820
  338    HB   VAL  41           HB       VAL  41  -1.843  -4.701  -3.734
  339   1HG1  VAL  41          1HG1      VAL  41  -2.501  -5.980  -6.191
  340   2HG1  VAL  41          2HG1      VAL  41  -2.653  -7.193  -4.898
  341   3HG1  VAL  41          3HG1      VAL  41  -3.554  -5.661  -4.792
  342   1HG2  VAL  41          1HG2      VAL  41  -0.722  -7.478  -3.989
  343   2HG2  VAL  41          2HG2      VAL  41   0.286  -6.182  -3.303
  344   3HG2  VAL  41          3HG2      VAL  41  -1.268  -6.597  -2.541
  345    H    GLU  42           H        GLU  42   2.097  -4.975  -5.013
  346    HA   GLU  42           HA       GLU  42   2.274  -7.421  -6.577
  347   1HB   GLU  42          1HB       GLU  42   4.159  -5.035  -6.833
  348   2HB   GLU  42          2HB       GLU  42   4.358  -6.574  -7.649
  349   1HG   GLU  42          1HG       GLU  42   2.843  -6.029  -9.260
  350   2HG   GLU  42          2HG       GLU  42   1.660  -5.498  -8.080
  351    HE2  GLU  42           HE       GLU  42   4.390  -3.239  -9.800
  352    H    MET  43           H        MET  43   3.410  -9.012  -5.528
  353    HA   MET  43           HA       MET  43   5.250  -8.118  -3.454
  354   1HB   MET  43          1HB       MET  43   3.898 -10.707  -2.924
  355   2HB   MET  43          2HB       MET  43   4.144  -9.354  -1.840
  356   1HG   MET  43          1HG       MET  43   2.254  -8.133  -3.029
  357   2HG   MET  43          2HG       MET  43   1.964  -9.583  -3.970
  358   1HE   MET  43          1HE       MET  43  -0.542  -8.622  -1.003
  359   2HE   MET  43          2HE       MET  43   0.946  -8.068  -0.200
  360   3HE   MET  43          3HE       MET  43   0.633  -7.629  -1.896
  361    H    SER  44           H        SER  44   7.238  -8.676  -4.271
  362    HA   SER  44           HA       SER  44   7.404 -11.299  -5.529
  363   1HB   SER  44          1HB       SER  44   8.349  -8.730  -6.348
  364   2HB   SER  44          2HB       SER  44   9.772  -9.669  -5.939
  365    HG   SER  44           HG       SER  44   7.668 -10.668  -7.655
  366    H    ARG  45           H        ARG  45   8.047 -12.778  -3.987
  367    HA   ARG  45           HA       ARG  45   9.996 -11.857  -2.052
  368   1HB   ARG  45          1HB       ARG  45   8.782 -14.597  -1.837
  369   2HB   ARG  45          2HB       ARG  45   9.133 -13.442  -0.569
  370   1HG   ARG  45          1HG       ARG  45   7.188 -12.102  -2.043
  371   2HG   ARG  45          2HG       ARG  45   6.670 -13.770  -2.191
  372   1HD   ARG  45          1HD       ARG  45   7.510 -12.997   0.562
  373   2HD   ARG  45          2HD       ARG  45   6.106 -12.130  -0.030
  374    HE   ARG  45           HE       ARG  45   4.865 -14.134  -0.015
  375   1HH1  ARG  45          2HH2      ARG  45   8.301 -14.861   0.453
  376   2HH1  ARG  45          1HH2      ARG  45   8.020 -16.517   0.873
  377   1HH2  ARG  45          1HH       ARG  45   5.775 -17.354   0.918
  378    H    ASP  46           H        ASP  46   9.912 -13.292  -5.059
  379    HA   ASP  46           HA       ASP  46  11.441 -15.558  -4.792
  380   1HB   ASP  46          1HB       ASP  46  10.387 -13.971  -6.885
  381   2HB   ASP  46          2HB       ASP  46  12.112 -13.991  -7.187
  382    HD2  ASP  46           HD       ASP  46   9.878 -16.434  -6.087
  383    H    LEU  47           H        LEU  47  12.195 -12.227  -4.237
  384    HA   LEU  47           HA       LEU  47  15.012 -12.895  -3.983
  385   1HB   LEU  47          1HB       LEU  47  14.180 -11.653  -6.257
  386   2HB   LEU  47          2HB       LEU  47  14.510 -10.271  -5.231
  387    HG   LEU  47           HG       LEU  47  16.696 -12.127  -5.016
  388   1HD1  LEU  47          1HD1      LEU  47  17.515 -12.042  -7.346
  389   2HD1  LEU  47          2HD1      LEU  47  16.034 -13.014  -7.167
  390   3HD1  LEU  47          3HD1      LEU  47  15.943 -11.374  -7.853
  391   1HD2  LEU  47          1HD2      LEU  47  18.009 -10.247  -5.396
  392   2HD2  LEU  47          2HD2      LEU  47  16.787  -9.474  -6.433
  393   3HD2  LEU  47          3HD2      LEU  47  16.528  -9.571  -4.674
  394    H    ALA  48           H        ALA  48  12.961  -9.897  -3.891
  395    HA   ALA  48           HA       ALA  48  12.370  -9.680  -1.318
  396   1HB   ALA  48          1HB       ALA  48  14.527  -8.234  -0.591
  397   2HB   ALA  48          2HB       ALA  48  14.396  -9.981  -0.282
  398   3HB   ALA  48          3HB       ALA  48  15.323  -9.394  -1.682
  399    H    TYR  49           H        TYR  49  11.147  -8.701  -3.411
  400    HA   TYR  49           HA       TYR  49  11.377  -5.846  -3.051
  401   1HB   TYR  49          1HB       TYR  49  11.621  -5.511  -5.527
  402   2HB   TYR  49          2HB       TYR  49  12.969  -6.456  -4.929
  403    HD1  TYR  49           HD1      TYR  49  13.156  -8.858  -5.446
  404    HD2  TYR  49           HD2      TYR  49   9.938  -6.498  -6.988
  405    HE1  TYR  49           HE1      TYR  49  12.625 -10.676  -7.141
  406    HE2  TYR  49           HE2      TYR  49   9.417  -8.323  -8.677
  407    HH   TYR  49           HH       TYR  49  10.246 -10.149  -9.666
  408    H    ALA  50           H        ALA  50   9.373  -4.909  -3.102
  409    HA   ALA  50           HA       ALA  50   7.256  -6.367  -4.500
  410   1HB   ALA  50          1HB       ALA  50   5.983  -5.397  -2.253
  411   2HB   ALA  50          2HB       ALA  50   6.526  -7.077  -2.476
  412   3HB   ALA  50          3HB       ALA  50   7.552  -5.919  -1.596
  413    H    LYS  51           H        LYS  51   5.296  -4.935  -4.841
  414    HA   LYS  51           HA       LYS  51   5.928  -2.098  -4.694
  415   1HB   LYS  51          1HB       LYS  51   4.800  -2.808  -7.296
  416   2HB   LYS  51          2HB       LYS  51   6.118  -1.725  -6.894
  417   1HG   LYS  51          1HG       LYS  51   7.585  -3.785  -6.512
  418   2HG   LYS  51          2HG       LYS  51   6.272  -4.764  -7.137
  419   1HD   LYS  51          1HD       LYS  51   7.246  -4.419  -9.175
  420   2HD   LYS  51          2HD       LYS  51   6.463  -2.852  -9.115
  421   1HE   LYS  51          1HE       LYS  51   8.515  -1.881  -8.035
  422   2HE   LYS  51          2HE       LYS  51   9.296  -3.446  -8.134
  423   1HZ   LYS  51          1HZ       LYS  51   8.577  -3.143 -10.671
  424   2HZ   LYS  51          2HZ       LYS  51   8.719  -1.567 -10.285
  425    H    VAL  52           H        VAL  52   4.306  -1.598  -3.268
  426    HA   VAL  52           HA       VAL  52   1.650  -2.668  -3.857
  427    HB   VAL  52           HB       VAL  52   2.968  -2.661  -1.554
  428   1HG1  VAL  52          1HG1      VAL  52   1.361  -0.118  -1.261
  429   2HG1  VAL  52          2HG1      VAL  52   2.550  -0.823  -0.140
  430   3HG1  VAL  52          3HG1      VAL  52   3.093  -0.100  -1.673
  431   1HG2  VAL  52          1HG2      VAL  52   0.593  -2.442  -0.452
  432   2HG2  VAL  52          2HG2      VAL  52   0.036  -2.364  -2.140
  433   3HG2  VAL  52          3HG2      VAL  52   0.946  -3.783  -1.567
  434    H    TYR  53           H        TYR  53   0.074  -1.412  -4.738
  435    HA   TYR  53           HA       TYR  53   0.769   1.382  -5.223
  436   1HB   TYR  53          1HB       TYR  53  -0.382  -0.790  -6.664
  437   2HB   TYR  53          2HB       TYR  53  -1.766   0.212  -6.272
  438    HD1  TYR  53           HD1      TYR  53   1.764   0.892  -7.386
  439    HD2  TYR  53           HD2      TYR  53  -2.412   1.572  -8.027
  440    HE1  TYR  53           HE1      TYR  53   2.306   2.419  -9.346
  441    HE2  TYR  53           HE2      TYR  53  -1.854   3.095  -9.985
  442    HH   TYR  53           HH       TYR  53   0.566   4.580 -10.479
  443    H    VAL  54           H        VAL  54  -0.779   3.101  -4.842
  444    HA   VAL  54           HA       VAL  54  -3.101   2.468  -3.257
  445    HB   VAL  54           HB       VAL  54  -2.203   4.257  -1.552
  446   1HG1  VAL  54          1HG1      VAL  54  -2.872   1.838  -1.161
  447   2HG1  VAL  54          2HG1      VAL  54  -1.154   1.420  -1.367
  448   3HG1  VAL  54          3HG1      VAL  54  -1.655   2.500  -0.043
  449   1HG2  VAL  54          1HG2      VAL  54  -0.099   4.748  -2.637
  450   2HG2  VAL  54          2HG2      VAL  54   0.227   3.923  -1.095
  451   3HG2  VAL  54          3HG2      VAL  54   0.357   3.027  -2.628
  452    H    THR  55           H        THR  55  -4.714   3.838  -3.848
  453    HA   THR  55           HA       THR  55  -3.882   6.323  -5.197
  454    HB   THR  55           HB       THR  55  -4.949   5.148  -6.908
  455    HG1  THR  55           HG1      THR  55  -7.241   5.924  -5.256
  456   1HG2  THR  55          1HG2      THR  55  -6.941   3.622  -6.454
  457   2HG2  THR  55          2HG2      THR  55  -5.422   3.047  -5.728
  458   3HG2  THR  55          3HG2      THR  55  -6.644   3.849  -4.713
  459    H    PHE  56           H        PHE  56  -4.524   8.232  -4.385
  460    HA   PHE  56           HA       PHE  56  -6.590   8.102  -2.301
  461   1HB   PHE  56          1HB       PHE  56  -4.274  10.099  -2.544
  462   2HB   PHE  56          2HB       PHE  56  -5.266   9.809  -1.127
  463    HD1  PHE  56           HD1      PHE  56  -2.818   8.096  -3.354
  464    HD2  PHE  56           HD2      PHE  56  -4.503   8.374   0.532
  465    HE1  PHE  56           HE1      PHE  56  -1.119   6.458  -2.499
  466    HE2  PHE  56           HE2      PHE  56  -2.804   6.735   1.385
  467    HZ   PHE  56           HZ       PHE  56  -1.133   5.797  -0.140
  468    H    LEU  57           H        LEU  57  -7.646  10.329  -1.924
  469    HA   LEU  57           HA       LEU  57  -8.197  11.461  -4.562
  470   1HB   LEU  57          1HB       LEU  57  -9.982  10.433  -3.029
  471   2HB   LEU  57          2HB       LEU  57  -9.798  11.875  -2.048
  472    HG   LEU  57           HG       LEU  57 -10.246  13.157  -4.284
  473   1HD1  LEU  57          1HD1      LEU  57 -10.326  11.690  -6.010
  474   2HD1  LEU  57          2HD1      LEU  57 -10.906  10.346  -4.997
  475   3HD1  LEU  57          3HD1      LEU  57 -12.039  11.610  -5.531
  476   1HD2  LEU  57          1HD2      LEU  57 -12.471  11.674  -2.856
  477   2HD2  LEU  57          2HD2      LEU  57 -11.701  13.183  -2.308
  478   3HD2  LEU  57          3HD2      LEU  57 -12.637  13.161  -3.822
  479    H    ASN  58           H        ASN  58  -5.874  11.960  -2.475
  480    HA   ASN  58           HA       ASN  58  -6.172  14.442  -1.400
  481   1HB   ASN  58          1HB       ASN  58  -3.960  12.633  -2.097
  482   2HB   ASN  58          2HB       ASN  58  -3.476  14.303  -2.306
  483   1HD2  ASN  58          1HD2      ASN  58  -4.975  15.580  -0.394
  484   2HD2  ASN  58          2HD2      ASN  58  -4.479  15.104   1.195
  485    H    ASP  59           H        ASP  59  -5.883  13.417  -4.738
  486    HA   ASP  59           HA       ASP  59  -4.577  15.395  -5.978
  487   1HB   ASP  59          1HB       ASP  59  -5.440  13.650  -7.331
  488   2HB   ASP  59          2HB       ASP  59  -7.061  13.820  -6.689
  489    HD2  ASP  59           HD       ASP  59  -8.355  14.660  -7.964
  490    H    LYS  60           H        LYS  60  -7.923  15.390  -4.638
  491    HA   LYS  60           HA       LYS  60  -9.063  17.559  -5.713
  492   1HB   LYS  60          1HB       LYS  60  -9.142  16.288  -3.028
  493   2HB   LYS  60          2HB       LYS  60  -9.818  17.900  -3.140
  494   1HG   LYS  60          1HG       LYS  60 -10.745  16.501  -5.452
  495   2HG   LYS  60          2HG       LYS  60 -10.920  15.385  -4.112
  496   1HD   LYS  60          1HD       LYS  60 -11.890  18.270  -3.943
  497   2HD   LYS  60          2HD       LYS  60 -12.904  16.985  -4.572
  498   1HE   LYS  60          1HE       LYS  60 -12.392  15.713  -2.362
  499   2HE   LYS  60          2HE       LYS  60 -11.743  17.229  -1.766
  500   1HZ   LYS  60          1HZ       LYS  60 -14.322  17.564  -2.978
  501   2HZ   LYS  60          2HZ       LYS  60 -14.380  16.524  -1.727
  502    H    ASP  61           H        ASP  61  -6.466  17.544  -3.217
  503    HA   ASP  61           HA       ASP  61  -6.153  20.380  -3.808
  504   1HB   ASP  61          1HB       ASP  61  -5.232  19.328  -1.155
  505   2HB   ASP  61          2HB       ASP  61  -5.870  20.909  -1.558
  506    HD2  ASP  61           HD       ASP  61  -9.166  19.995  -1.286
  507    H    GLU  62           H        GLU  62  -4.140  20.694  -4.770
  508    HA   GLU  62           HA       GLU  62  -2.282  18.611  -4.881
  509   1HB   GLU  62          1HB       GLU  62  -2.718  20.618  -6.514
  510   2HB   GLU  62          2HB       GLU  62  -1.618  21.509  -5.479
  511   1HG   GLU  62          1HG       GLU  62  -0.043  19.392  -5.788
  512   2HG   GLU  62          2HG       GLU  62  -1.048  19.073  -7.188
  513    HE2  GLU  62           HE       GLU  62   0.874  21.493  -5.717
  514    H    ASP  63           H        ASP  63  -2.934  21.076  -2.526
  515    HA   ASP  63           HA       ASP  63  -0.294  21.338  -1.579
  516   1HB   ASP  63          1HB       ASP  63  -2.791  22.562  -1.119
  517   2HB   ASP  63          2HB       ASP  63  -2.426  21.785   0.409
  518    HD2  ASP  63           HD       ASP  63   0.242  24.490  -0.861
  519    H    ALA  64           H        ALA  64  -3.220  19.385  -0.751
  520    HA   ALA  64           HA       ALA  64  -1.934  18.148   1.503
  521   1HB   ALA  64          1HB       ALA  64  -4.397  18.678   1.330
  522   2HB   ALA  64          2HB       ALA  64  -4.524  17.407   0.090
  523   3HB   ALA  64          3HB       ALA  64  -4.037  16.986   1.750
  524    H    VAL  65           H        VAL  65  -2.117  17.699  -1.956
  525    HA   VAL  65           HA       VAL  65  -1.660  14.881  -1.897
  526    HB   VAL  65           HB       VAL  65  -2.562  16.690  -3.730
  527   1HG1  VAL  65          1HG1      VAL  65  -1.012  16.830  -5.572
  528   2HG1  VAL  65          2HG1      VAL  65  -0.218  17.474  -4.117
  529   3HG1  VAL  65          3HG1      VAL  65   0.185  15.842  -4.701
  530   1HG2  VAL  65          1HG2      VAL  65  -3.314  14.671  -4.344
  531   2HG2  VAL  65          2HG2      VAL  65  -1.815  14.518  -5.294
  532   3HG2  VAL  65          3HG2      VAL  65  -1.901  13.844  -3.649
  533    H    LYS  66           H        LYS  66   0.330  17.868  -2.248
  534    HA   LYS  66           HA       LYS  66   2.732  16.403  -2.671
  535   1HB   LYS  66          1HB       LYS  66   3.809  18.548  -2.600
  536   2HB   LYS  66          2HB       LYS  66   2.327  18.698  -3.521
  537   1HG   LYS  66          1HG       LYS  66   1.182  19.520  -1.387
  538   2HG   LYS  66          2HG       LYS  66   2.756  19.538  -0.617
  539   1HD   LYS  66          1HD       LYS  66   2.748  20.916  -3.236
  540   2HD   LYS  66          2HD       LYS  66   1.632  21.634  -2.092
  541   1HE   LYS  66          1HE       LYS  66   3.355  22.109  -0.511
  542   2HE   LYS  66          2HE       LYS  66   4.466  20.960  -1.232
  543   1HZ   LYS  66          1HZ       LYS  66   3.607  23.538  -2.430
  544   2HZ   LYS  66          2HZ       LYS  66   5.103  23.164  -1.903
  545    H    ALA  67           H        ALA  67   1.374  18.274   0.133
  546    HA   ALA  67           HA       ALA  67   3.429  17.531   1.889
  547   1HB   ALA  67          1HB       ALA  67   1.975  19.470   2.244
  548   2HB   ALA  67          2HB       ALA  67   0.555  18.406   2.392
  549   3HB   ALA  67          3HB       ALA  67   1.841  18.351   3.622
  550    H    GLY  68           H        GLY  68   0.060  16.247   1.427
  551   1HA   GLY  68          1HA       GLY  68   0.060  14.268   3.319
  552   2HA   GLY  68          2HA       GLY  68  -0.782  14.191   1.783
  553    H    ILE  69           H        ILE  69   0.900  13.784  -0.194
  554    HA   ILE  69           HA       ILE  69   1.779  11.193   0.079
  555    HB   ILE  69           HB       ILE  69   1.300  12.662  -1.991
  556   1HG1  ILE  69          1HG1      ILE  69   3.366  10.479  -1.779
  557   2HG1  ILE  69          2HG1      ILE  69   1.697  10.367  -2.299
  558   1HG2  ILE  69          1HG2      ILE  69   4.197  12.957  -2.400
  559   2HG2  ILE  69          2HG2      ILE  69   2.855  14.048  -2.816
  560   3HG2  ILE  69          3HG2      ILE  69   3.512  14.038  -1.163
  561   1HD1  ILE  69          1HD1      ILE  69   2.762  12.230  -4.087
  562   2HD1  ILE  69          2HD1      ILE  69   4.097  11.075  -3.855
  563   3HD1  ILE  69          3HD1      ILE  69   2.510  10.499  -4.420
  564    H    LYS  70           H        LYS  70   3.391  14.270   0.846
  565    HA   LYS  70           HA       LYS  70   5.999  13.246   0.989
  566   1HB   LYS  70          1HB       LYS  70   4.636  15.731   1.456
  567   2HB   LYS  70          2HB       LYS  70   5.685  15.400   2.821
  568   1HG   LYS  70          1HG       LYS  70   7.312  16.306   1.481
  569   2HG   LYS  70          2HG       LYS  70   7.366  14.702   0.776
  570   1HD   LYS  70          1HD       LYS  70   7.153  16.215  -1.075
  571   2HD   LYS  70          2HD       LYS  70   5.578  15.473  -0.888
  572   1HE   LYS  70          1HE       LYS  70   5.118  17.803  -1.145
  573   2HE   LYS  70          2HE       LYS  70   4.931  17.503   0.572
  574   1HZ   LYS  70          1HZ       LYS  70   7.014  18.497   1.013
  575   2HZ   LYS  70          2HZ       LYS  70   7.520  18.418  -0.533
  576    H    ALA  71           H        ALA  71   3.230  13.282   3.242
  577    HA   ALA  71           HA       ALA  71   4.780  12.454   5.483
  578   1HB   ALA  71          1HB       ALA  71   1.982  13.096   4.818
  579   2HB   ALA  71          2HB       ALA  71   2.145  11.775   6.000
  580   3HB   ALA  71          3HB       ALA  71   2.886  13.358   6.329
  581    H    LEU  72           H        LEU  72   2.867  10.866   2.895
  582    HA   LEU  72           HA       LEU  72   3.017   8.293   4.091
  583   1HB   LEU  72          1HB       LEU  72   1.359   9.293   2.351
  584   2HB   LEU  72          2HB       LEU  72   2.558   8.802   1.172
  585    HG   LEU  72           HG       LEU  72   2.402   6.461   2.109
  586   1HD1  LEU  72          1HD1      LEU  72   0.985   5.858   3.756
  587   2HD1  LEU  72          2HD1      LEU  72   1.161   7.563   4.233
  588   3HD1  LEU  72          3HD1      LEU  72  -0.252   7.046   3.283
  589   1HD2  LEU  72          1HD2      LEU  72   0.882   5.941   0.533
  590   2HD2  LEU  72          2HD2      LEU  72  -0.338   7.066   1.180
  591   3HD2  LEU  72          3HD2      LEU  72   0.978   7.677   0.150
  592    H    GLN  73           H        GLN  73   5.188  10.317   2.240
  593    HA   GLN  73           HA       GLN  73   6.706   8.137   1.235
  594   1HB   GLN  73          1HB       GLN  73   6.451  10.694   0.434
  595   2HB   GLN  73          2HB       GLN  73   7.859  10.907   1.456
  596   1HG   GLN  73          1HG       GLN  73   7.719   8.715  -0.658
  597   2HG   GLN  73          2HG       GLN  73   8.290  10.331  -1.031
  598   1HE2  GLN  73          1HE2      GLN  73   9.588   7.640  -0.929
  599   2HE2  GLN  73          2HE2      GLN  73  10.999   7.823   0.059
  600    H    GLU  74           H        GLU  74   7.017  10.547   3.916
  601    HA   GLU  74           HA       GLU  74   9.510   9.601   4.750
  602   1HB   GLU  74          1HB       GLU  74   9.307  11.141   6.513
  603   2HB   GLU  74          2HB       GLU  74   8.292  11.849   5.271
  604   1HG   GLU  74          1HG       GLU  74   6.765  11.944   6.997
  605   2HG   GLU  74          2HG       GLU  74   6.414  10.309   6.473
  606    HE2  GLU  74           HE       GLU  74   8.637  11.062   9.705
  607    H    ALA  75           H        ALA  75   6.158   8.606   5.361
  608    HA   ALA  75           HA       ALA  75   6.947   6.910   7.573
  609   1HB   ALA  75          1HB       ALA  75   4.279   7.288   6.151
  610   2HB   ALA  75          2HB       ALA  75   4.542   6.409   7.677
  611   3HB   ALA  75          3HB       ALA  75   4.811   8.166   7.606
  612    H    SER  76           H        SER  76   7.760   6.706   4.508
  613    HA   SER  76           HA       SER  76   6.602   4.451   3.477
  614   1HB   SER  76          1HB       SER  76   9.298   5.773   3.140
  615   2HB   SER  76          2HB       SER  76   9.006   4.233   2.358
  616    HG   SER  76           HG       SER  76   8.483   6.212   1.071
  617    H    GLY  77           H        GLY  77   9.980   4.528   4.830
  618   1HA   GLY  77          1HA       GLY  77  10.292   1.821   5.185
  619   2HA   GLY  77          2HA       GLY  77  11.105   3.065   6.115
  620    H    PHE  78           H        PHE  78   8.213   4.028   6.947
  621    HA   PHE  78           HA       PHE  78   8.197   2.533   9.371
  622   1HB   PHE  78          1HB       PHE  78   7.079   4.966   8.149
  623   2HB   PHE  78          2HB       PHE  78   5.801   4.095   8.973
  624    HD1  PHE  78           HD1      PHE  78   6.478   3.263  11.421
  625    HD2  PHE  78           HD2      PHE  78   8.286   6.506   9.364
  626    HE1  PHE  78           HE1      PHE  78   7.234   4.230  13.609
  627    HE2  PHE  78           HE2      PHE  78   9.043   7.472  11.554
  628    HZ   PHE  78           HZ       PHE  78   8.507   6.322  13.651
  629    H    ILE  79           H        ILE  79   6.119   2.750   6.428
  630    HA   ILE  79           HA       ILE  79   4.162   0.976   7.481
  631    HB   ILE  79           HB       ILE  79   3.393   0.962   5.080
  632   1HG1  ILE  79          1HG1      ILE  79   5.438   3.151   4.674
  633   2HG1  ILE  79          2HG1      ILE  79   5.749   1.489   4.214
  634   1HG2  ILE  79          1HG2      ILE  79   3.008   2.756   7.095
  635   2HG2  ILE  79          2HG2      ILE  79   3.568   3.818   5.782
  636   3HG2  ILE  79          3HG2      ILE  79   2.148   2.773   5.536
  637   1HD1  ILE  79          1HD1      ILE  79   4.715   3.126   2.439
  638   2HD1  ILE  79          2HD1      ILE  79   4.056   1.477   2.566
  639   3HD1  ILE  79          3HD1      ILE  79   3.191   2.841   3.314
  640    H    ARG  80           H        ARG  80   7.109   0.684   5.458
  641    HA   ARG  80           HA       ARG  80   6.623  -1.955   4.722
  642   1HB   ARG  80          1HB       ARG  80   8.233  -0.602   3.485
  643   2HB   ARG  80          2HB       ARG  80   9.185  -0.305   4.926
  644   1HG   ARG  80          1HG       ARG  80   9.015  -3.134   4.730
  645   2HG   ARG  80          2HG       ARG  80   9.282  -2.582   3.088
  646   1HD   ARG  80          1HD       ARG  80  11.470  -2.889   4.061
  647   2HD   ARG  80          2HD       ARG  80  11.217  -1.158   3.968
  648    HE   ARG  80           HE       ARG  80  10.249  -2.006   6.502
  649   1HH1  ARG  80          2HH2      ARG  80  13.341  -1.811   4.782
  650   2HH1  ARG  80          1HH2      ARG  80  14.277  -1.635   6.229
  651   1HH2  ARG  80          1HH       ARG  80  13.163  -1.614   8.352
  652    H    SER  81           H        SER  81   8.511  -0.417   7.401
  653    HA   SER  81           HA       SER  81   9.415  -2.895   8.395
  654   1HB   SER  81          1HB       SER  81  10.401  -0.488   8.710
  655   2HB   SER  81          2HB       SER  81   9.237  -0.332  10.011
  656    HG   SER  81           HG       SER  81  10.491  -2.730  10.301
  657    H    LEU  82           H        LEU  82   6.653  -0.699   9.024
  658    HA   LEU  82           HA       LEU  82   5.814  -1.877  11.421
  659   1HB   LEU  82          1HB       LEU  82   5.094   0.308  10.767
  660   2HB   LEU  82          2HB       LEU  82   4.368  -0.300   9.294
  661    HG   LEU  82           HG       LEU  82   3.365  -1.355  11.913
  662   1HD1  LEU  82          1HD1      LEU  82   3.069   0.756  12.650
  663   2HD1  LEU  82          2HD1      LEU  82   3.176   1.464  11.021
  664   3HD1  LEU  82          3HD1      LEU  82   1.660   0.705  11.564
  665   1HD2  LEU  82          1HD2      LEU  82   2.523  -2.324   9.848
  666   2HD2  LEU  82          2HD2      LEU  82   1.235  -1.430  10.689
  667   3HD2  LEU  82          3HD2      LEU  82   2.032  -0.715   9.267
  668    H    LEU  83           H        LEU  83   5.262  -2.664   7.968
  669    HA   LEU  83           HA       LEU  83   3.244  -4.576   8.493
  670   1HB   LEU  83          1HB       LEU  83   5.044  -4.083   6.121
  671   2HB   LEU  83          2HB       LEU  83   3.774  -5.290   6.142
  672    HG   LEU  83           HG       LEU  83   3.053  -2.467   6.828
  673   1HD1  LEU  83          1HD1      LEU  83   3.060  -3.240   3.939
  674   2HD1  LEU  83          2HD1      LEU  83   3.121  -1.631   4.698
  675   3HD1  LEU  83          3HD1      LEU  83   4.571  -2.662   4.679
  676   1HD2  LEU  83          1HD2      LEU  83   0.940  -3.059   5.803
  677   2HD2  LEU  83          2HD2      LEU  83   1.604  -4.621   5.265
  678   3HD2  LEU  83          3HD2      LEU  83   1.400  -4.292   7.002
  679    H    GLY  84           H        GLY  84   6.718  -4.972   7.482
  680   1HA   GLY  84          1HA       GLY  84   7.017  -7.639   7.681
  681   2HA   GLY  84          2HA       GLY  84   8.248  -6.491   8.169
  682    H    LYS  85           H        LYS  85   6.917  -5.290  10.432
  683    HA   LYS  85           HA       LYS  85   7.404  -7.378  12.338
  684   1HB   LYS  85          1HB       LYS  85   6.976  -4.414  12.422
  685   2HB   LYS  85          2HB       LYS  85   6.717  -5.338  13.889
  686   1HG   LYS  85          1HG       LYS  85   8.968  -6.116  13.953
  687   2HG   LYS  85          2HG       LYS  85   9.240  -5.767  12.257
  688   1HD   LYS  85          1HD       LYS  85  10.385  -4.031  13.442
  689   2HD   LYS  85          2HD       LYS  85   8.925  -3.279  12.831
  690   1HE   LYS  85          1HE       LYS  85   8.251  -2.768  14.937
  691   2HE   LYS  85          2HE       LYS  85   8.330  -4.454  15.412
  692   1HZ   LYS  85          1HZ       LYS  85  10.124  -3.911  16.624
  693   2HZ   LYS  85          2HZ       LYS  85  10.960  -3.563  15.269
  694    H    ALA  86           H        ALA  86   4.618  -5.555  11.010
  695    HA   ALA  86           HA       ALA  86   2.736  -6.424  12.885
  696   1HB   ALA  86          1HB       ALA  86   2.348  -4.540  11.390
  697   2HB   ALA  86          2HB       ALA  86   2.473  -5.600   9.965
  698   3HB   ALA  86          3HB       ALA  86   1.110  -5.783  11.094
  699    H    MET  87           H        MET  87   4.257  -7.965  10.074
  700    HA   MET  87           HA       MET  87   2.493 -10.248  10.528
  701   1HB   MET  87          1HB       MET  87   4.113  -9.825   7.986
  702   2HB   MET  87          2HB       MET  87   2.629 -10.736   8.186
  703   1HG   MET  87          1HG       MET  87   1.411  -8.552   8.640
  704   2HG   MET  87          2HG       MET  87   2.898  -7.692   8.289
  705   1HE   MET  87          1HE       MET  87   1.944  -6.356   6.820
  706   2HE   MET  87          2HE       MET  87   2.009  -6.662   5.068
  707   3HE   MET  87          3HE       MET  87   0.477  -6.870   5.953
  708    H    ARG  88           H        ARG  88   5.231  -9.290  11.717
  709    HA   ARG  88           HA       ARG  88   7.345 -10.058  11.814
  710   1HB   ARG  88          1HB       ARG  88   5.471 -12.192  12.920
  711   2HB   ARG  88          2HB       ARG  88   7.206 -12.321  13.132
  712   1HG   ARG  88          1HG       ARG  88   7.160  -9.959  14.135
  713   2HG   ARG  88          2HG       ARG  88   5.410 -10.051  14.100
  714   1HD   ARG  88          1HD       ARG  88   6.106 -12.467  15.318
  715   2HD   ARG  88          2HD       ARG  88   7.325 -11.371  15.939
  716    HE   ARG  88           HE       ARG  88   5.671 -10.433  17.276
  717   1HH1  ARG  88          2HH2      ARG  88   4.110 -11.752  14.381
  718   2HH1  ARG  88          1HH2      ARG  88   2.513 -11.321  14.895
  719   1HH2  ARG  88          1HH       ARG  88   2.215 -10.211  16.998
  720    H    LEU  89           H        LEU  89   7.847 -10.297   9.462
  721    HA   LEU  89           HA       LEU  89   7.896 -13.125   8.664
  722   1HB   LEU  89          1HB       LEU  89   6.520 -11.194   7.405
  723   2HB   LEU  89          2HB       LEU  89   8.072 -10.981   6.620
  724    HG   LEU  89           HG       LEU  89   8.064 -13.266   5.826
  725   1HD1  LEU  89          1HD1      LEU  89   5.626 -14.398   6.268
  726   2HD1  LEU  89          2HD1      LEU  89   7.101 -14.758   7.197
  727   3HD1  LEU  89          3HD1      LEU  89   5.920 -13.584   7.823
  728   1HD2  LEU  89          1HD2      LEU  89   6.855 -11.488   4.550
  729   2HD2  LEU  89          2HD2      LEU  89   6.285 -13.145   4.232
  730   3HD2  LEU  89          3HD2      LEU  89   5.340 -12.064   5.284
  731    H    ARG  90           H        ARG  90   9.643 -12.226   6.327
  732    HA   ARG  90           HA       ARG  90  11.984 -11.304   7.682
  733   1HB   ARG  90          1HB       ARG  90  13.248 -13.386   6.592
  734   2HB   ARG  90          2HB       ARG  90  12.500 -13.537   8.170
  735   1HG   ARG  90          1HG       ARG  90  11.052 -15.111   7.411
  736   2HG   ARG  90          2HG       ARG  90  10.510 -14.065   6.113
  737   1HD   ARG  90          1HD       ARG  90  12.690 -14.727   4.868
  738   2HD   ARG  90          2HD       ARG  90  12.888 -15.973   6.082
  739    HE   ARG  90           HE       ARG  90  10.251 -16.264   5.166
  740   1HH1  ARG  90          2HH2      ARG  90  13.479 -16.384   3.710
  741   2HH1  ARG  90          1HH2      ARG  90  13.013 -17.495   2.466
  742   1HH2  ARG  90          1HH       ARG  90  10.747 -18.271   2.375
  743    H    ILE  91           H        ILE  91  10.449 -12.705   4.728
  744    HA   ILE  91           HA       ILE  91  12.180 -12.171   2.780
  745    HB   ILE  91           HB       ILE  91  10.092 -11.457   1.434
  746   1HG1  ILE  91          1HG1      ILE  91   8.383 -12.657   3.499
  747   2HG1  ILE  91          2HG1      ILE  91   9.017 -11.088   3.951
  748   1HG2  ILE  91          1HG2      ILE  91  10.818 -14.052   2.659
  749   2HG2  ILE  91          2HG2      ILE  91   9.195 -13.953   1.936
  750   3HG2  ILE  91          3HG2      ILE  91  10.632 -13.591   0.949
  751   1HD1  ILE  91          1HD1      ILE  91   7.734  -9.997   2.415
  752   2HD1  ILE  91          2HD1      ILE  91   8.097 -11.188   1.142
  753   3HD1  ILE  91          3HD1      ILE  91   6.807 -11.515   2.325
  754    H    VAL  92           H        VAL  92  10.410  -9.762   4.726
  755    HA   VAL  92           HA       VAL  92  10.262  -7.500   4.336
  756    HB   VAL  92           HB       VAL  92  13.191  -8.002   4.903
  757   1HG1  VAL  92          1HG1      VAL  92  12.986  -5.866   6.205
  758   2HG1  VAL  92          2HG1      VAL  92  12.810  -5.672   4.445
  759   3HG1  VAL  92          3HG1      VAL  92  11.371  -5.646   5.491
  760   1HG2  VAL  92          1HG2      VAL  92  12.690  -8.330   7.162
  761   2HG2  VAL  92          2HG2      VAL  92  11.054  -7.647   7.002
  762   3HG2  VAL  92          3HG2      VAL  92  11.418  -9.252   6.324
  763    HA   PRO  93           HA       PRO  93  11.998  -7.445   0.108
  764   1HB   PRO  93          1HB       PRO  93   9.667  -7.418  -1.318
  765   2HB   PRO  93          2HB       PRO  93  10.583  -8.879  -1.006
  766   1HG   PRO  93          1HG       PRO  93   8.063  -7.969   0.243
  767   2HG   PRO  93          2HG       PRO  93   8.758  -9.578   0.220
  768   1HD   PRO  93          1HD       PRO  93   8.775  -7.734   2.418
  769   2HD   PRO  93          2HD       PRO  93   9.568  -9.295   2.353
  770    H    GLU  94           H        GLU  94  12.150  -5.709  -1.423
  771    HA   GLU  94           HA       GLU  94  11.713  -3.286  -0.103
  772   1HB   GLU  94          1HB       GLU  94  13.253  -4.169  -2.250
  773   2HB   GLU  94          2HB       GLU  94  12.088  -3.120  -3.032
  774   1HG   GLU  94          1HG       GLU  94  12.677  -1.251  -1.565
  775   2HG   GLU  94          2HG       GLU  94  13.679  -2.285  -0.564
  776    HE2  GLU  94           HE       GLU  94  15.811  -2.613  -1.345
  777    H    LEU  95           H        LEU  95   9.284  -3.919   0.275
  778    HA   LEU  95           HA       LEU  95   7.531  -3.654  -1.936
  779   1HB   LEU  95          1HB       LEU  95   5.805  -3.475  -0.114
  780   2HB   LEU  95          2HB       LEU  95   6.762  -4.944  -0.161
  781    HG   LEU  95           HG       LEU  95   8.119  -3.164   1.580
  782   1HD1  LEU  95          1HD1      LEU  95   6.631  -1.985   2.733
  783   2HD1  LEU  95          2HD1      LEU  95   5.421  -2.424   1.503
  784   3HD1  LEU  95          3HD1      LEU  95   5.594  -3.412   2.972
  785   1HD2  LEU  95          1HD2      LEU  95   6.874  -5.820   1.626
  786   2HD2  LEU  95          2HD2      LEU  95   8.412  -5.254   2.321
  787   3HD2  LEU  95          3HD2      LEU  95   6.889  -5.003   3.207
  788    H    THR  96           H        THR  96   8.020  -1.742  -3.068
  789    HA   THR  96           HA       THR  96   8.276   0.752  -1.740
  790    HB   THR  96           HB       THR  96   9.227   0.040  -4.018
  791    HG1  THR  96           HG1      THR  96   7.397   2.330  -4.001
  792   1HG2  THR  96          1HG2      THR  96   7.520   0.747  -5.894
  793   2HG2  THR  96          2HG2      THR  96   7.412  -0.906  -5.247
  794   3HG2  THR  96          3HG2      THR  96   6.273   0.343  -4.691
  795    H    PHE  97           H        PHE  97   6.832   2.653  -2.132
  796    HA   PHE  97           HA       PHE  97   4.041   1.751  -1.992
  797   1HB   PHE  97          1HB       PHE  97   5.684   3.093  -0.119
  798   2HB   PHE  97          2HB       PHE  97   4.812   4.411  -0.876
  799    HD1  PHE  97           HD1      PHE  97   3.653   0.961  -0.074
  800    HD2  PHE  97           HD2      PHE  97   3.268   5.114   0.707
  801    HE1  PHE  97           HE1      PHE  97   1.675   0.500   1.401
  802    HE2  PHE  97           HE2      PHE  97   1.290   4.653   2.181
  803    HZ   PHE  97           HZ       PHE  97   0.517   2.351   2.511
  804    H    PHE  98           H        PHE  98   3.128   2.187  -3.962
  805    HA   PHE  98           HA       PHE  98   3.946   4.626  -5.323
  806   1HB   PHE  98          1HB       PHE  98   2.950   1.925  -5.952
  807   2HB   PHE  98          2HB       PHE  98   1.927   3.120  -6.723
  808    HD1  PHE  98           HD1      PHE  98   3.193   4.990  -8.065
  809    HD2  PHE  98           HD2      PHE  98   4.883   1.237  -7.027
  810    HE1  PHE  98           HE1      PHE  98   4.873   5.235  -9.914
  811    HE2  PHE  98           HE2      PHE  98   6.563   1.483  -8.876
  812    HZ   PHE  98           HZ       PHE  98   6.537   3.478 -10.298
  813    H    TYR  99           H        TYR  99   2.767   6.466  -5.135
  814    HA   TYR  99           HA       TYR  99   0.033   6.201  -4.119
  815   1HB   TYR  99          1HB       TYR  99   1.313   8.875  -4.508
  816   2HB   TYR  99          2HB       TYR  99   0.570   8.228  -3.059
  817    HD1  TYR  99           HD1      TYR  99   3.682   8.859  -4.797
  818    HD2  TYR  99           HD2      TYR  99   1.911   6.690  -1.561
  819    HE1  TYR  99           HE1      TYR  99   5.979   8.508  -3.766
  820    HE2  TYR  99           HE2      TYR  99   4.214   6.345  -0.541
  821    HH   TYR  99           HH       TYR  99   6.372   6.502  -0.883
  822    H    ASP 100           H        ASP 100  -1.104   5.672  -6.043
  823    HA   ASP 100           HA       ASP 100  -0.755   7.480  -8.259
  824   1HB   ASP 100          1HB       ASP 100  -1.107   4.851  -8.308
  825   2HB   ASP 100          2HB       ASP 100  -2.804   5.248  -8.119
  826    HD2  ASP 100           HD       ASP 100  -2.436   7.652  -9.979
  827    H    ASN 101           H        ASN 101  -1.734   9.425  -7.324
  828    HA   ASN 101           HA       ASN 101  -4.431   9.170  -6.362
  829   1HB   ASN 101          1HB       ASN 101  -4.133  11.730  -6.042
  830   2HB   ASN 101          2HB       ASN 101  -3.099  10.698  -5.074
  831   1HD2  ASN 101          1HD2      ASN 101  -1.213  11.629  -4.871
  832   2HD2  ASN 101          2HD2      ASN 101  -0.250  12.333  -6.128
  833    H    SER 102           H        SER 102  -5.613  11.577  -7.192
  834    HA   SER 102           HA       SER 102  -5.968  11.030  -9.991
  835   1HB   SER 102          1HB       SER 102  -7.598  13.223  -9.147
  836   2HB   SER 102          2HB       SER 102  -8.100  11.586  -9.511
  837    HG   SER 102           HG       SER 102  -8.709  12.045  -7.368
  838    H    LEU 103           H        LEU 103  -3.597  12.564  -8.535
  839    HA   LEU 103           HA       LEU 103  -3.822  15.111  -9.930
  840   1HB   LEU 103          1HB       LEU 103  -3.136  14.922  -7.515
  841   2HB   LEU 103          2HB       LEU 103  -1.659  14.154  -8.058
  842    HG   LEU 103           HG       LEU 103  -1.632  16.423  -9.577
  843   1HD1  LEU 103          1HD1      LEU 103  -2.589  17.423  -6.902
  844   2HD1  LEU 103          2HD1      LEU 103  -2.409  18.300  -8.441
  845   3HD1  LEU 103          3HD1      LEU 103  -3.726  17.120  -8.236
  846   1HD2  LEU 103          1HD2      LEU 103  -0.365  15.555  -7.037
  847   2HD2  LEU 103          2HD2      LEU 103   0.364  16.023  -8.592
  848   3HD2  LEU 103          3HD2      LEU 103  -0.206  17.276  -7.463
  849    H    VAL 104           H        VAL 104  -3.122  12.050 -10.818
  850    HA   VAL 104           HA       VAL 104  -1.121  12.991 -12.736
  851    HB   VAL 104           HB       VAL 104  -1.012  10.526 -11.007
  852   1HG1  VAL 104          1HG1      VAL 104  -0.455   9.505 -12.988
  853   2HG1  VAL 104          2HG1      VAL 104   0.160  11.006 -13.720
  854   3HG1  VAL 104          3HG1      VAL 104   1.139  10.139 -12.511
  855   1HG2  VAL 104          1HG2      VAL 104   1.469  11.502 -10.950
  856   2HG2  VAL 104          2HG2      VAL 104   0.610  13.013 -11.332
  857   3HG2  VAL 104          3HG2      VAL 104   0.194  12.099  -9.862
  858    H    GLU 105           H        GLU 105  -4.204  12.227 -12.368
  859    HA   GLU 105           HA       GLU 105  -4.381  11.187 -14.997
  860   1HB   GLU 105          1HB       GLU 105  -4.598   9.358 -12.703
  861   2HB   GLU 105          2HB       GLU 105  -6.043   9.337 -13.695
  862   1HG   GLU 105          1HG       GLU 105  -4.897   8.581 -15.607
  863   2HG   GLU 105          2HG       GLU 105  -3.360   9.237 -15.079
  864    HE2  GLU 105           HE       GLU 105  -3.519   6.202 -15.591
  865    H    GLY 106           H        GLY 106  -5.918  12.021 -11.860
  866   1HA   GLY 106          1HA       GLY 106  -7.587  13.579 -11.578
  867   2HA   GLY 106          2HA       GLY 106  -7.945  13.543 -13.292
  868    H    MET 107           H        MET 107  -8.038  10.551 -13.441
  869    HA   MET 107           HA       MET 107 -10.761  10.311 -12.705
  870   1HB   MET 107          1HB       MET 107 -10.657   8.682 -14.324
  871   2HB   MET 107          2HB       MET 107  -8.971   9.112 -14.542
  872   1HG   MET 107          1HG       MET 107  -8.639   7.505 -12.411
  873   2HG   MET 107          2HG       MET 107 -10.160   6.831 -12.960
  874   1HE   MET 107          1HE       MET 107  -6.041   6.466 -14.695
  875   2HE   MET 107          2HE       MET 107  -6.716   8.076 -15.042
  876   3HE   MET 107          3HE       MET 107  -6.622   7.494 -13.363
  877    H    ARG 108           H        ARG 108  -8.039  10.203 -10.827
  878    HA   ARG 108           HA       ARG 108  -8.966   7.932  -9.282
  879   1HB   ARG 108          1HB       ARG 108  -6.368   8.969  -9.927
  880   2HB   ARG 108          2HB       ARG 108  -6.572   9.191  -8.201
  881   1HG   ARG 108          1HG       ARG 108  -5.856   7.010  -8.097
  882   2HG   ARG 108          2HG       ARG 108  -7.539   6.651  -8.425
  883   1HD   ARG 108          1HD       ARG 108  -7.056   6.530 -10.869
  884   2HD   ARG 108          2HD       ARG 108  -5.378   6.941 -10.570
  885    HE   ARG 108           HE       ARG 108  -4.984   4.751  -9.808
  886   1HH1  ARG 108          2HH2      ARG 108  -8.477   5.300 -10.041
  887   2HH1  ARG 108          1HH2      ARG 108  -8.880   3.637  -9.780
  888   1HH2  ARG 108          1HH       ARG 108  -7.126   2.041  -9.443
  Start of MODEL    4
    1    H    MET   1           H        MET   1 -11.232 -12.933   2.700
    2    HA   MET   1           HA       MET   1  -9.577 -11.629   0.708
    3   1HB   MET   1          1HB       MET   1  -9.926 -14.572   1.510
    4   2HB   MET   1          2HB       MET   1  -8.793 -14.018   0.292
    5   1HG   MET   1          1HG       MET   1  -7.265 -13.638   1.926
    6   2HG   MET   1          2HG       MET   1  -8.305 -12.391   2.584
    7   1HE   MET   1          1HE       MET   1  -9.314 -12.303   4.420
    8   2HE   MET   1          2HE       MET   1  -9.770 -13.562   5.594
    9   3HE   MET   1          3HE       MET   1  -8.090 -12.977   5.523
   10    H    ALA   2           H        ALA   2  -9.769 -12.190  -1.586
   11    HA   ALA   2           HA       ALA   2 -12.516 -12.988  -2.249
   12   1HB   ALA   2          1HB       ALA   2 -11.213 -10.670  -2.860
   13   2HB   ALA   2          2HB       ALA   2 -10.801 -11.660  -4.280
   14   3HB   ALA   2          3HB       ALA   2 -12.506 -11.375  -3.858
   15    H    LYS   3           H        LYS   3  -9.110 -13.787  -2.465
   16    HA   LYS   3           HA       LYS   3  -9.815 -15.951  -4.323
   17   1HB   LYS   3          1HB       LYS   3  -8.229 -14.024  -5.110
   18   2HB   LYS   3          2HB       LYS   3  -7.032 -14.825  -4.113
   19   1HG   LYS   3          1HG       LYS   3  -6.848 -15.718  -6.370
   20   2HG   LYS   3          2HG       LYS   3  -7.496 -16.980  -5.341
   21   1HD   LYS   3          1HD       LYS   3  -9.646 -15.321  -6.463
   22   2HD   LYS   3          2HD       LYS   3  -8.641 -15.994  -7.731
   23   1HE   LYS   3          1HE       LYS   3  -9.553 -18.052  -7.442
   24   2HE   LYS   3          2HE       LYS   3  -9.126 -18.052  -5.743
   25   1HZ   LYS   3          1HZ       LYS   3 -11.312 -16.315  -6.113
   26   2HZ   LYS   3          2HZ       LYS   3 -11.675 -17.728  -6.835
   27    H    GLU   4           H        GLU   4 -10.244 -17.601  -2.891
   28    HA   GLU   4           HA       GLU   4  -8.171 -18.064  -0.894
   29   1HB   GLU   4          1HB       GLU   4 -10.075 -19.593   0.096
   30   2HB   GLU   4          2HB       GLU   4 -10.140 -17.859   0.343
   31   1HG   GLU   4          1HG       GLU   4 -11.887 -17.555  -1.187
   32   2HG   GLU   4          2HG       GLU   4 -11.442 -18.953  -2.145
   33    HE2  GLU   4           HE       GLU   4 -14.429 -19.168  -0.119
   34    H    PHE   5           H        PHE   5  -6.739 -19.180  -2.355
   35    HA   PHE   5           HA       PHE   5  -7.654 -21.895  -2.904
   36   1HB   PHE   5          1HB       PHE   5  -7.646 -20.050  -4.886
   37   2HB   PHE   5          2HB       PHE   5  -5.916 -20.330  -4.861
   38    HD1  PHE   5           HD1      PHE   5  -5.008 -22.106  -6.063
   39    HD2  PHE   5           HD2      PHE   5  -9.156 -22.133  -5.173
   40    HE1  PHE   5           HE1      PHE   5  -5.312 -24.116  -7.536
   41    HE2  PHE   5           HE2      PHE   5  -9.460 -24.143  -6.646
   42    HZ   PHE   5           HZ       PHE   5  -7.532 -25.109  -7.810
   43    H    GLY   6           H        GLY   6  -5.471 -23.054  -3.967
   44   1HA   GLY   6          1HA       GLY   6  -3.492 -22.745  -1.836
   45   2HA   GLY   6          2HA       GLY   6  -3.669 -24.096  -2.938
   46    H    ARG   7           H        ARG   7  -4.014 -21.204  -4.706
   47    HA   ARG   7           HA       ARG   7  -1.420 -21.605  -5.824
   48   1HB   ARG   7          1HB       ARG   7  -3.959 -20.520  -6.692
   49   2HB   ARG   7          2HB       ARG   7  -2.740 -19.283  -6.933
   50   1HG   ARG   7          1HG       ARG   7  -1.365 -21.424  -7.904
   51   2HG   ARG   7          2HG       ARG   7  -2.993 -21.981  -8.226
   52   1HD   ARG   7          1HD       ARG   7  -2.905 -19.227  -9.024
   53   2HD   ARG   7          2HD       ARG   7  -1.452 -19.976  -9.653
   54    HE   ARG   7           HE       ARG   7  -2.760 -21.311 -11.084
   55   1HH1  ARG   7          2HH2      ARG   7  -4.850 -19.741  -8.692
   56   2HH1  ARG   7          1HH2      ARG   7  -6.318 -20.204  -9.487
   57   1HH2  ARG   7          1HH       ARG   7  -6.204 -21.486 -11.509
   58    HA   PRO   8           HA       PRO   8   0.444 -18.000  -4.190
   59   1HB   PRO   8          1HB       PRO   8   1.529 -16.619  -6.284
   60   2HB   PRO   8          2HB       PRO   8   2.258 -18.060  -5.605
   61   1HG   PRO   8          1HG       PRO   8   0.771 -17.755  -8.141
   62   2HG   PRO   8          2HG       PRO   8   1.853 -19.043  -7.652
   63   1HD   PRO   8          1HD       PRO   8  -1.013 -19.139  -7.711
   64   2HD   PRO   8          2HD       PRO   8   0.066 -20.384  -7.113
   65    H    GLN   9           H        GLN   9  -2.343 -17.691  -5.795
   66    HA   GLN   9           HA       GLN   9  -2.388 -14.826  -5.735
   67   1HB   GLN   9          1HB       GLN   9  -3.698 -16.747  -7.249
   68   2HB   GLN   9          2HB       GLN   9  -4.952 -16.259  -6.127
   69   1HG   GLN   9          1HG       GLN   9  -5.305 -14.549  -7.608
   70   2HG   GLN   9          2HG       GLN   9  -3.936 -13.800  -6.810
   71   1HE2  GLN   9          1HE2      GLN   9  -4.425 -13.020  -9.281
   72   2HE2  GLN   9          2HE2      GLN   9  -3.285 -13.644 -10.426
   73    H    ARG  10           H        ARG  10  -3.524 -17.612  -3.818
   74    HA   ARG  10           HA       ARG  10  -5.377 -16.274  -2.285
   75   1HB   ARG  10          1HB       ARG  10  -4.844 -18.818  -2.433
   76   2HB   ARG  10          2HB       ARG  10  -3.575 -18.516  -1.261
   77   1HG   ARG  10          1HG       ARG  10  -6.307 -17.432  -0.616
   78   2HG   ARG  10          2HG       ARG  10  -6.105 -19.171  -0.536
   79   1HD   ARG  10          1HD       ARG  10  -3.809 -18.118   0.760
   80   2HD   ARG  10          2HD       ARG  10  -5.134 -17.113   1.312
   81    HE   ARG  10           HE       ARG  10  -5.931 -18.925   2.546
   82   1HH1  ARG  10          2HH2      ARG  10  -3.857 -20.172  -0.042
   83   2HH1  ARG  10          1HH2      ARG  10  -3.951 -21.814   0.506
   84   1HH2  ARG  10          1HH       ARG  10  -5.249 -22.330   2.452
   85    H    VAL  11           H        VAL  11  -1.858 -16.972  -1.674
   86    HA   VAL  11           HA       VAL  11  -1.743 -15.639   0.780
   87    HB   VAL  11           HB       VAL  11  -0.115 -17.245  -0.678
   88   1HG1  VAL  11          1HG1      VAL  11   1.315 -14.573  -0.662
   89   2HG1  VAL  11          2HG1      VAL  11   1.868 -16.113  -1.361
   90   3HG1  VAL  11          3HG1      VAL  11   0.505 -15.239  -2.102
   91   1HG2  VAL  11          1HG2      VAL  11   0.264 -15.562   1.768
   92   2HG2  VAL  11          2HG2      VAL  11   0.221 -17.333   1.590
   93   3HG2  VAL  11          3HG2      VAL  11   1.674 -16.425   1.108
   94    H    ALA  12           H        ALA  12  -1.355 -14.556  -2.621
   95    HA   ALA  12           HA       ALA  12  -0.321 -12.030  -2.072
   96   1HB   ALA  12          1HB       ALA  12  -0.736 -13.445  -4.298
   97   2HB   ALA  12          2HB       ALA  12  -2.219 -12.463  -4.357
   98   3HB   ALA  12          3HB       ALA  12  -0.626 -11.669  -4.332
   99    H    GLN  13           H        GLN  13  -3.666 -13.331  -2.083
  100    HA   GLN  13           HA       GLN  13  -4.860 -10.798  -1.866
  101   1HB   GLN  13          1HB       GLN  13  -5.826 -13.634  -1.358
  102   2HB   GLN  13          2HB       GLN  13  -6.865 -12.252  -1.069
  103   1HG   GLN  13          1HG       GLN  13  -5.657 -13.173  -3.699
  104   2HG   GLN  13          2HG       GLN  13  -7.349 -12.937  -3.309
  105   1HE2  GLN  13          1HE2      GLN  13  -4.322 -11.427  -4.116
  106   2HE2  GLN  13          2HE2      GLN  13  -4.918  -9.846  -4.495
  107    H    GLU  14           H        GLU  14  -4.667 -13.501   0.570
  108    HA   GLU  14           HA       GLU  14  -5.542 -12.256   2.724
  109   1HB   GLU  14          1HB       GLU  14  -4.558 -14.624   2.484
  110   2HB   GLU  14          2HB       GLU  14  -2.992 -13.915   2.814
  111   1HG   GLU  14          1HG       GLU  14  -5.030 -13.030   4.753
  112   2HG   GLU  14          2HG       GLU  14  -4.865 -14.774   4.728
  113    HE2  GLU  14           HE       GLU  14  -1.904 -14.656   6.462
  114    H    MET  15           H        MET  15  -2.271 -11.841   1.277
  115    HA   MET  15           HA       MET  15  -1.378 -10.173   3.371
  116   1HB   MET  15          1HB       MET  15  -0.209 -11.574   1.282
  117   2HB   MET  15          2HB       MET  15  -0.141  -9.943   0.646
  118   1HG   MET  15          1HG       MET  15   1.765  -9.706   1.878
  119   2HG   MET  15          2HG       MET  15   0.711  -9.567   3.272
  120   1HE   MET  15          1HE       MET  15   3.969 -11.318   3.523
  121   2HE   MET  15          2HE       MET  15   2.922 -10.035   4.175
  122   3HE   MET  15          3HE       MET  15   3.061 -11.591   5.029
  123    H    GLN  16           H        GLN  16  -2.828  -9.666   0.116
  124    HA   GLN  16           HA       GLN  16  -2.364  -6.937   0.002
  125   1HB   GLN  16          1HB       GLN  16  -3.130  -8.546  -1.860
  126   2HB   GLN  16          2HB       GLN  16  -4.753  -8.375  -1.221
  127   1HG   GLN  16          1HG       GLN  16  -3.279  -5.810  -1.679
  128   2HG   GLN  16          2HG       GLN  16  -3.678  -6.717  -3.125
  129   1HE2  GLN  16          1HE2      GLN  16  -5.070  -4.995  -3.690
  130   2HE2  GLN  16          2HE2      GLN  16  -6.660  -4.848  -3.018
  131    H    LYS  17           H        LYS  17  -4.889  -8.893   1.595
  132    HA   LYS  17           HA       LYS  17  -6.570  -6.647   2.126
  133   1HB   LYS  17          1HB       LYS  17  -7.303  -9.062   1.854
  134   2HB   LYS  17          2HB       LYS  17  -6.620  -9.375   3.438
  135   1HG   LYS  17          1HG       LYS  17  -8.198  -7.016   3.733
  136   2HG   LYS  17          2HG       LYS  17  -9.157  -8.108   2.756
  137   1HD   LYS  17          1HD       LYS  17  -9.712  -8.657   5.016
  138   2HD   LYS  17          2HD       LYS  17  -8.637  -9.938   4.491
  139   1HE   LYS  17          1HE       LYS  17  -7.635  -9.410   6.524
  140   2HE   LYS  17          2HE       LYS  17  -6.740  -8.326   5.476
  141   1HZ   LYS  17          1HZ       LYS  17  -7.537  -7.028   7.284
  142   2HZ   LYS  17          2HZ       LYS  17  -8.499  -6.614   6.039
  143    H    GLU  18           H        GLU  18  -4.015  -8.494   3.850
  144    HA   GLU  18           HA       GLU  18  -4.432  -7.210   6.295
  145   1HB   GLU  18          1HB       GLU  18  -3.135  -9.400   5.753
  146   2HB   GLU  18          2HB       GLU  18  -1.779  -8.360   5.364
  147   1HG   GLU  18          1HG       GLU  18  -1.281  -8.480   7.587
  148   2HG   GLU  18          2HG       GLU  18  -2.567  -7.307   7.797
  149    HE2  GLU  18           HE       GLU  18  -3.930 -10.998   7.873
  150    H    ILE  19           H        ILE  19  -2.281  -6.563   3.474
  151    HA   ILE  19           HA       ILE  19  -0.995  -4.366   4.760
  152    HB   ILE  19           HB       ILE  19   0.213  -4.128   2.784
  153   1HG1  ILE  19          1HG1      ILE  19  -2.016  -5.597   1.350
  154   2HG1  ILE  19          2HG1      ILE  19  -1.627  -3.895   1.212
  155   1HG2  ILE  19          1HG2      ILE  19   0.094  -6.884   2.132
  156   2HG2  ILE  19          2HG2      ILE  19   1.261  -6.039   3.178
  157   3HG2  ILE  19          3HG2      ILE  19  -0.219  -6.737   3.878
  158   1HD1  ILE  19          1HD1      ILE  19  -0.017  -6.278   0.244
  159   2HD1  ILE  19          2HD1      ILE  19  -0.576  -4.862  -0.680
  160   3HD1  ILE  19          3HD1      ILE  19   0.755  -4.694   0.490
  161    H    ALA  20           H        ALA  20  -3.753  -4.837   2.512
  162    HA   ALA  20           HA       ALA  20  -4.129  -2.176   1.821
  163   1HB   ALA  20          1HB       ALA  20  -5.279  -3.863   0.605
  164   2HB   ALA  20          2HB       ALA  20  -5.975  -4.570   2.084
  165   3HB   ALA  20          3HB       ALA  20  -6.549  -2.991   1.497
  166    H    LEU  21           H        LEU  21  -5.063  -4.052   4.728
  167    HA   LEU  21           HA       LEU  21  -6.739  -1.999   5.759
  168   1HB   LEU  21          1HB       LEU  21  -7.141  -4.264   6.367
  169   2HB   LEU  21          2HB       LEU  21  -5.497  -4.481   6.935
  170    HG   LEU  21           HG       LEU  21  -6.613  -2.328   8.427
  171   1HD1  LEU  21          1HD1      LEU  21  -8.736  -3.754   7.515
  172   2HD1  LEU  21          2HD1      LEU  21  -8.365  -4.630   9.020
  173   3HD1  LEU  21          3HD1      LEU  21  -8.696  -2.882   9.066
  174   1HD2  LEU  21          1HD2      LEU  21  -6.075  -3.676  10.311
  175   2HD2  LEU  21          2HD2      LEU  21  -6.141  -5.171   9.348
  176   3HD2  LEU  21          3HD2      LEU  21  -4.838  -3.988   9.072
  177    H    ILE  22           H        ILE  22  -3.464  -3.232   6.759
  178    HA   ILE  22           HA       ILE  22  -2.978  -1.155   8.541
  179    HB   ILE  22           HB       ILE  22  -1.215  -3.069   7.036
  180   1HG1  ILE  22          1HG1      ILE  22  -1.558  -2.952  10.013
  181   2HG1  ILE  22          2HG1      ILE  22  -2.852  -3.622   9.040
  182   1HG2  ILE  22          1HG2      ILE  22  -0.305  -1.075   9.128
  183   2HG2  ILE  22          2HG2      ILE  22   0.682  -2.342   8.362
  184   3HG2  ILE  22          3HG2      ILE  22   0.059  -0.989   7.388
  185   1HD1  ILE  22          1HD1      ILE  22  -1.509  -5.386   8.215
  186   2HD1  ILE  22          2HD1      ILE  22   0.006  -4.526   8.579
  187   3HD1  ILE  22          3HD1      ILE  22  -0.960  -5.222   9.901
  188    H    LEU  23           H        LEU  23  -3.054  -1.226   5.061
  189    HA   LEU  23           HA       LEU  23  -1.356   1.111   4.834
  190   1HB   LEU  23          1HB       LEU  23  -1.114  -0.624   3.190
  191   2HB   LEU  23          2HB       LEU  23  -2.827  -0.589   2.819
  192    HG   LEU  23           HG       LEU  23  -1.192   1.898   2.426
  193   1HD1  LEU  23          1HD1      LEU  23  -0.136   1.222   0.544
  194   2HD1  LEU  23          2HD1      LEU  23  -0.227  -0.366   1.344
  195   3HD1  LEU  23          3HD1      LEU  23  -1.420   0.074   0.098
  196   1HD2  LEU  23          1HD2      LEU  23  -3.243   1.062   0.473
  197   2HD2  LEU  23          2HD2      LEU  23  -3.842   1.387   2.118
  198   3HD2  LEU  23          3HD2      LEU  23  -2.945   2.643   1.233
  199    H    GLN  24           H        GLN  24  -4.652   0.318   5.467
  200    HA   GLN  24           HA       GLN  24  -5.414   3.001   4.608
  201   1HB   GLN  24          1HB       GLN  24  -6.847   0.369   4.570
  202   2HB   GLN  24          2HB       GLN  24  -7.816   1.773   4.972
  203   1HG   GLN  24          1HG       GLN  24  -7.533   2.756   2.873
  204   2HG   GLN  24          2HG       GLN  24  -5.961   2.027   2.618
  205   1HE2  GLN  24          1HE2      GLN  24  -9.419   1.319   2.865
  206   2HE2  GLN  24          2HE2      GLN  24  -9.457  -0.028   1.778
  207    H    ARG  25           H        ARG  25  -4.522   1.162   7.267
  208    HA   ARG  25           HA       ARG  25  -6.275   2.718   8.994
  209   1HB   ARG  25          1HB       ARG  25  -6.070  -0.018   8.947
  210   2HB   ARG  25          2HB       ARG  25  -4.817   0.348  10.114
  211   1HG   ARG  25          1HG       ARG  25  -6.696   1.943  11.160
  212   2HG   ARG  25          2HG       ARG  25  -7.786   0.884  10.289
  213   1HD   ARG  25          1HD       ARG  25  -5.829  -0.768  11.634
  214   2HD   ARG  25          2HD       ARG  25  -6.449   0.389  12.797
  215    HE   ARG  25           HE       ARG  25  -7.883  -1.858  11.743
  216   1HH1  ARG  25          2HH2      ARG  25  -8.409   1.547  12.570
  217   2HH1  ARG  25          1HH2      ARG  25 -10.098   1.337  12.892
  218   1HH2  ARG  25          1HH       ARG  25 -11.077  -0.837  12.650
  219    H    GLU  26           H        GLU  26  -2.958   1.469   8.376
  220    HA   GLU  26           HA       GLU  26  -1.956   3.117  10.529
  221   1HB   GLU  26          1HB       GLU  26  -0.254   1.621  10.665
  222   2HB   GLU  26          2HB       GLU  26  -1.234   0.606   9.626
  223   1HG   GLU  26          1HG       GLU  26   0.643   0.653   8.294
  224   2HG   GLU  26          2HG       GLU  26  -0.076   2.140   7.709
  225    HE2  GLU  26           HE       GLU  26   3.418   2.158   8.926
  226    H    ILE  27           H        ILE  27  -2.967   3.744   7.509
  227    HA   ILE  27           HA       ILE  27  -0.634   5.376   6.804
  228    HB   ILE  27           HB       ILE  27  -1.941   3.586   5.277
  229   1HG1  ILE  27          1HG1      ILE  27  -0.154   5.857   4.839
  230   2HG1  ILE  27          2HG1      ILE  27  -0.073   4.220   4.218
  231   1HG2  ILE  27          1HG2      ILE  27  -4.062   4.739   5.289
  232   2HG2  ILE  27          2HG2      ILE  27  -3.291   6.244   4.735
  233   3HG2  ILE  27          3HG2      ILE  27  -3.351   4.826   3.661
  234   1HD1  ILE  27          1HD1      ILE  27  -1.773   4.764   2.492
  235   2HD1  ILE  27          2HD1      ILE  27  -1.896   6.419   3.136
  236   3HD1  ILE  27          3HD1      ILE  27  -0.381   5.867   2.385
  237    H    LYS  28           H        LYS  28  -1.579   7.442   5.430
  238    HA   LYS  28           HA       LYS  28  -2.993   8.918   7.455
  239   1HB   LYS  28          1HB       LYS  28  -1.406   9.539   5.011
  240   2HB   LYS  28          2HB       LYS  28  -2.635  10.700   5.470
  241   1HG   LYS  28          1HG       LYS  28  -0.646  11.385   6.623
  242   2HG   LYS  28          2HG       LYS  28  -1.665  10.649   7.843
  243   1HD   LYS  28          1HD       LYS  28   0.235   8.823   6.398
  244   2HD   LYS  28          2HD       LYS  28   0.947   9.978   7.507
  245   1HE   LYS  28          1HE       LYS  28  -1.371   8.803   8.787
  246   2HE   LYS  28          2HE       LYS  28  -0.387   7.507   8.135
  247   1HZ   LYS  28          1HZ       LYS  28   1.294   7.981   9.577
  248   2HZ   LYS  28          2HZ       LYS  28   1.092   9.596   9.513
  249    H    ASP  29           H        ASP  29  -4.964   7.496   7.262
  250    HA   ASP  29           HA       ASP  29  -6.461   7.997   4.848
  251   1HB   ASP  29          1HB       ASP  29  -7.042   5.848   5.343
  252   2HB   ASP  29          2HB       ASP  29  -6.434   5.980   6.981
  253    HD2  ASP  29           HD       ASP  29 -10.331   6.316   6.290
  254    HA   PRO  30           HA       PRO  30  -9.090   9.882   8.361
  255   1HB   PRO  30          1HB       PRO  30  -8.119   9.952  10.914
  256   2HB   PRO  30          2HB       PRO  30  -9.183   8.690  10.328
  257   1HG   PRO  30          1HG       PRO  30  -6.273   8.574  10.836
  258   2HG   PRO  30          2HG       PRO  30  -7.412   7.252  10.668
  259   1HD   PRO  30          1HD       PRO  30  -5.526   8.153   8.703
  260   2HD   PRO  30          2HD       PRO  30  -6.742   6.910   8.495
  261    H    ARG  31           H        ARG  31  -5.704  10.416   8.301
  262    HA   ARG  31           HA       ARG  31  -5.934  13.065   9.261
  263   1HB   ARG  31          1HB       ARG  31  -3.822  11.899   9.570
  264   2HB   ARG  31          2HB       ARG  31  -3.704  11.516   7.864
  265   1HG   ARG  31          1HG       ARG  31  -3.817  14.195   7.614
  266   2HG   ARG  31          2HG       ARG  31  -3.215  14.145   9.260
  267   1HD   ARG  31          1HD       ARG  31  -1.388  12.530   8.417
  268   2HD   ARG  31          2HD       ARG  31  -1.917  12.908   6.790
  269    HE   ARG  31           HE       ARG  31  -1.542  15.411   7.792
  270   1HH1  ARG  31          2HH2      ARG  31   0.517  12.533   7.956
  271   2HH1  ARG  31          1HH2      ARG  31   1.991  13.438   8.024
  272   1HH2  ARG  31          1HH       ARG  31   1.900  15.834   7.982
  273    H    LEU  32           H        LEU  32  -5.659  11.430   6.057
  274    HA   LEU  32           HA       LEU  32  -5.711  13.984   4.693
  275   1HB   LEU  32          1HB       LEU  32  -5.308  11.126   3.897
  276   2HB   LEU  32          2HB       LEU  32  -5.764  12.307   2.685
  277    HG   LEU  32           HG       LEU  32  -3.751  13.419   2.786
  278   1HD1  LEU  32          1HD1      LEU  32  -3.566  12.451   5.632
  279   2HD1  LEU  32          2HD1      LEU  32  -2.144  13.091   4.775
  280   3HD1  LEU  32          3HD1      LEU  32  -3.580  14.117   5.002
  281   1HD2  LEU  32          1HD2      LEU  32  -3.607  10.569   2.784
  282   2HD2  LEU  32          2HD2      LEU  32  -2.565  11.746   1.949
  283   3HD2  LEU  32          3HD2      LEU  32  -2.159  11.206   3.597
  284    H    GLY  33           H        GLY  33  -7.977  12.535   6.408
  285   1HA   GLY  33          1HA       GLY  33 -10.205  12.111   6.201
  286   2HA   GLY  33          2HA       GLY  33 -10.175  13.715   5.499
  287    H    MET  34           H        MET  34  -9.158  10.400   4.381
  288    HA   MET  34           HA       MET  34 -11.106  10.581   2.278
  289   1HB   MET  34          1HB       MET  34  -8.090  10.655   1.865
  290   2HB   MET  34          2HB       MET  34  -9.094   9.880   0.656
  291   1HG   MET  34          1HG       MET  34 -10.396  11.958   0.342
  292   2HG   MET  34          2HG       MET  34  -9.525  12.740   1.646
  293   1HE   MET  34          1HE       MET  34  -7.559  14.800  -0.147
  294   2HE   MET  34          2HE       MET  34  -8.168  14.169   1.401
  295   3HE   MET  34          3HE       MET  34  -6.517  13.772   0.866
  296    H    MET  35           H        MET  35 -10.697   8.445   0.762
  297    HA   MET  35           HA       MET  35 -10.126   6.294   2.651
  298   1HB   MET  35          1HB       MET  35 -12.590   6.956   1.411
  299   2HB   MET  35          2HB       MET  35 -11.985   5.625   0.445
  300   1HG   MET  35          1HG       MET  35 -11.725   5.234   3.394
  301   2HG   MET  35          2HG       MET  35 -13.375   5.327   2.813
  302   1HE   MET  35          1HE       MET  35 -13.653   1.665   2.599
  303   2HE   MET  35          2HE       MET  35 -12.842   2.450   3.977
  304   3HE   MET  35          3HE       MET  35 -14.225   3.247   3.185
  305    H    THR  36           H        THR  36  -7.929   6.158   1.835
  306    HA   THR  36           HA       THR  36  -7.229   6.000  -0.835
  307    HB   THR  36           HB       THR  36  -5.147   5.048   0.061
  308    HG1  THR  36           HG1      THR  36  -6.916   4.592   2.362
  309   1HG2  THR  36          1HG2      THR  36  -6.063   7.432   0.957
  310   2HG2  THR  36          2HG2      THR  36  -6.111   6.543   2.499
  311   3HG2  THR  36          3HG2      THR  36  -4.577   6.705   1.612
  312    H    THR  37           H        THR  37  -6.561   4.163  -2.164
  313    HA   THR  37           HA       THR  37  -8.026   1.704  -1.515
  314    HB   THR  37           HB       THR  37  -8.259   3.489  -3.971
  315    HG1  THR  37           HG1      THR  37 -10.512   3.007  -3.387
  316   1HG2  THR  37          1HG2      THR  37  -9.093   0.551  -3.728
  317   2HG2  THR  37          2HG2      THR  37  -9.478   1.638  -5.083
  318   3HG2  THR  37          3HG2      THR  37  -7.793   1.146  -4.787
  319    H    VAL  38           H        VAL  38  -7.301  -0.174  -2.859
  320    HA   VAL  38           HA       VAL  38  -4.477   0.175  -3.589
  321    HB   VAL  38           HB       VAL  38  -5.773  -2.146  -2.147
  322   1HG1  VAL  38          1HG1      VAL  38  -3.613  -3.177  -2.073
  323   2HG1  VAL  38          2HG1      VAL  38  -3.940  -2.748  -3.769
  324   3HG1  VAL  38          3HG1      VAL  38  -2.838  -1.746  -2.794
  325   1HG2  VAL  38          1HG2      VAL  38  -5.335  -1.052  -0.256
  326   2HG2  VAL  38          2HG2      VAL  38  -3.607  -1.038  -0.681
  327   3HG2  VAL  38          3HG2      VAL  38  -4.656   0.313  -1.173
  328    H    SER  39           H        SER  39  -5.283   0.552  -5.789
  329    HA   SER  39           HA       SER  39  -6.652  -1.681  -6.975
  330   1HB   SER  39          1HB       SER  39  -6.534   1.113  -7.465
  331   2HB   SER  39          2HB       SER  39  -5.777   0.371  -8.859
  332    HG   SER  39           HG       SER  39  -7.747  -1.102  -8.866
  333    H    GLY  40           H        GLY  40  -3.801  -1.844  -5.922
  334   1HA   GLY  40          1HA       GLY  40  -2.694  -3.337  -8.067
  335   2HA   GLY  40          2HA       GLY  40  -1.896  -1.782  -7.933
  336    H    VAL  41           H        VAL  41  -1.299  -4.822  -7.185
  337    HA   VAL  41           HA       VAL  41   0.212  -4.105  -4.830
  338    HB   VAL  41           HB       VAL  41  -1.849  -4.783  -3.818
  339   1HG1  VAL  41          1HG1      VAL  41  -3.204  -6.083  -5.054
  340   2HG1  VAL  41          2HG1      VAL  41  -1.848  -6.800  -5.958
  341   3HG1  VAL  41          3HG1      VAL  41  -2.296  -7.448  -4.360
  342   1HG2  VAL  41          1HG2      VAL  41  -1.072  -6.924  -2.637
  343   2HG2  VAL  41          2HG2      VAL  41   0.368  -6.835  -3.678
  344   3HG2  VAL  41          3HG2      VAL  41   0.005  -5.508  -2.550
  345    H    GLU  42           H        GLU  42   2.188  -5.115  -4.852
  346    HA   GLU  42           HA       GLU  42   2.412  -7.490  -6.495
  347   1HB   GLU  42          1HB       GLU  42   4.400  -5.199  -6.750
  348   2HB   GLU  42          2HB       GLU  42   4.320  -6.652  -7.728
  349   1HG   GLU  42          1HG       GLU  42   2.011  -5.918  -8.511
  350   2HG   GLU  42          2HG       GLU  42   2.243  -4.413  -7.642
  351    HE2  GLU  42           HE       GLU  42   3.514  -3.333 -10.703
  352    H    MET  43           H        MET  43   3.605  -9.055  -5.470
  353    HA   MET  43           HA       MET  43   5.462  -8.125  -3.429
  354   1HB   MET  43          1HB       MET  43   4.036 -10.715  -2.925
  355   2HB   MET  43          2HB       MET  43   4.475  -9.459  -1.784
  356   1HG   MET  43          1HG       MET  43   2.610  -8.018  -2.719
  357   2HG   MET  43          2HG       MET  43   2.140  -9.352  -3.755
  358   1HE   MET  43          1HE       MET  43   0.852  -8.193   0.087
  359   2HE   MET  43          2HE       MET  43   1.015  -7.522  -1.553
  360   3HE   MET  43          3HE       MET  43  -0.356  -8.584  -1.159
  361    H    SER  44           H        SER  44   7.444  -8.688  -4.246
  362    HA   SER  44           HA       SER  44   7.604 -11.322  -5.486
  363   1HB   SER  44          1HB       SER  44   8.454  -8.790  -6.419
  364   2HB   SER  44          2HB       SER  44   9.929  -9.598  -5.931
  365    HG   SER  44           HG       SER  44   9.474 -11.329  -7.343
  366    H    ARG  45           H        ARG  45   8.342 -12.794  -3.988
  367    HA   ARG  45           HA       ARG  45  10.244 -11.823  -2.037
  368   1HB   ARG  45          1HB       ARG  45   8.422 -14.252  -2.197
  369   2HB   ARG  45          2HB       ARG  45   9.768 -14.244  -1.074
  370   1HG   ARG  45          1HG       ARG  45   8.392 -13.159   0.374
  371   2HG   ARG  45          2HG       ARG  45   8.606 -11.742  -0.634
  372   1HD   ARG  45          1HD       ARG  45   6.181 -12.320  -0.221
  373   2HD   ARG  45          2HD       ARG  45   6.597 -12.256  -1.923
  374    HE   ARG  45           HE       ARG  45   6.946 -14.938  -0.881
  375   1HH1  ARG  45          2HH2      ARG  45   4.465 -12.660  -1.980
  376   2HH1  ARG  45          1HH2      ARG  45   3.347 -13.902  -2.430
  377   1HH2  ARG  45          1HH       ARG  45   3.959 -16.200  -2.125
  378    H    ASP  46           H        ASP  46  10.191 -13.281  -5.075
  379    HA   ASP  46           HA       ASP  46  11.838 -15.422  -4.918
  380   1HB   ASP  46          1HB       ASP  46  12.130 -13.306  -7.083
  381   2HB   ASP  46          2HB       ASP  46  12.328 -15.040  -7.247
  382    HD2  ASP  46           HD       ASP  46  10.074 -16.193  -6.715
  383    H    LEU  47           H        LEU  47  12.483 -12.053  -4.252
  384    HA   LEU  47           HA       LEU  47  15.284 -12.683  -3.806
  385   1HB   LEU  47          1HB       LEU  47  14.271 -10.877  -5.899
  386   2HB   LEU  47          2HB       LEU  47  15.508 -10.184  -4.868
  387    HG   LEU  47           HG       LEU  47  16.521 -12.701  -5.512
  388   1HD1  LEU  47          1HD1      LEU  47  14.531 -12.257  -7.378
  389   2HD1  LEU  47          2HD1      LEU  47  16.003 -11.700  -8.207
  390   3HD1  LEU  47          3HD1      LEU  47  15.920 -13.355  -7.557
  391   1HD2  LEU  47          1HD2      LEU  47  17.210 -10.228  -7.081
  392   2HD2  LEU  47          2HD2      LEU  47  17.578 -10.350  -5.344
  393   3HD2  LEU  47          3HD2      LEU  47  18.274 -11.524  -6.485
  394    H    ALA  48           H        ALA  48  13.174  -9.726  -3.874
  395    HA   ALA  48           HA       ALA  48  12.427  -9.505  -1.337
  396   1HB   ALA  48          1HB       ALA  48  14.446  -9.788  -0.240
  397   2HB   ALA  48          2HB       ALA  48  15.389  -9.044  -1.554
  398   3HB   ALA  48          3HB       ALA  48  14.449  -8.020  -0.442
  399    H    TYR  49           H        TYR  49  11.203  -8.559  -3.378
  400    HA   TYR  49           HA       TYR  49  11.389  -5.701  -3.092
  401   1HB   TYR  49          1HB       TYR  49  11.707  -5.388  -5.554
  402   2HB   TYR  49          2HB       TYR  49  13.041  -6.333  -4.922
  403    HD1  TYR  49           HD1      TYR  49  10.007  -6.412  -6.998
  404    HD2  TYR  49           HD2      TYR  49  13.285  -8.704  -5.477
  405    HE1  TYR  49           HE1      TYR  49   9.521  -8.245  -8.692
  406    HE2  TYR  49           HE2      TYR  49  12.789 -10.527  -7.177
  407    HH   TYR  49           HH       TYR  49  11.313 -10.214  -9.775
  408    H    ALA  50           H        ALA  50   9.362  -4.827  -3.171
  409    HA   ALA  50           HA       ALA  50   7.317  -6.307  -4.646
  410   1HB   ALA  50          1HB       ALA  50   5.814  -5.725  -2.579
  411   2HB   ALA  50          2HB       ALA  50   6.881  -7.149  -2.505
  412   3HB   ALA  50          3HB       ALA  50   7.360  -5.634  -1.701
  413    H    LYS  51           H        LYS  51   5.305  -4.909  -4.937
  414    HA   LYS  51           HA       LYS  51   5.872  -2.066  -4.705
  415   1HB   LYS  51          1HB       LYS  51   4.779  -2.693  -7.335
  416   2HB   LYS  51          2HB       LYS  51   6.098  -1.629  -6.887
  417   1HG   LYS  51          1HG       LYS  51   7.570  -3.685  -6.591
  418   2HG   LYS  51          2HG       LYS  51   6.255  -4.663  -7.209
  419   1HD   LYS  51          1HD       LYS  51   6.894  -4.195  -9.331
  420   2HD   LYS  51          2HD       LYS  51   6.594  -2.491  -9.052
  421   1HE   LYS  51          1HE       LYS  51   8.839  -2.036  -8.507
  422   2HE   LYS  51          2HE       LYS  51   9.162  -3.678  -7.991
  423   1HZ   LYS  51          1HZ       LYS  51   9.075  -2.622 -10.729
  424   2HZ   LYS  51          2HZ       LYS  51  10.160  -3.636 -10.061
  425    H    VAL  52           H        VAL  52   4.212  -1.531  -3.363
  426    HA   VAL  52           HA       VAL  52   1.593  -2.689  -3.976
  427    HB   VAL  52           HB       VAL  52   2.332  -3.100  -1.745
  428   1HG1  VAL  52          1HG1      VAL  52   2.704  -1.046  -0.205
  429   2HG1  VAL  52          2HG1      VAL  52   4.023  -1.553  -1.288
  430   3HG1  VAL  52          3HG1      VAL  52   3.002  -0.159  -1.719
  431   1HG2  VAL  52          1HG2      VAL  52   0.013  -2.734  -1.765
  432   2HG2  VAL  52          2HG2      VAL  52   0.601  -1.715  -0.430
  433   3HG2  VAL  52          3HG2      VAL  52   0.197  -0.979  -2.000
  434    H    TYR  53           H        TYR  53   0.062  -1.459  -4.947
  435    HA   TYR  53           HA       TYR  53   0.699   1.333  -5.410
  436   1HB   TYR  53          1HB       TYR  53  -0.568  -0.861  -6.739
  437   2HB   TYR  53          2HB       TYR  53  -1.897   0.206  -6.328
  438    HD1  TYR  53           HD1      TYR  53   1.557   0.452  -7.794
  439    HD2  TYR  53           HD2      TYR  53  -2.504   1.793  -7.905
  440    HE1  TYR  53           HE1      TYR  53   2.081   1.893  -9.821
  441    HE2  TYR  53           HE2      TYR  53  -1.967   3.229  -9.932
  442    HH   TYR  53           HH       TYR  53   0.309   4.350 -10.791
  443    H    VAL  54           H        VAL  54  -0.799   3.076  -4.970
  444    HA   VAL  54           HA       VAL  54  -3.060   2.501  -3.286
  445    HB   VAL  54           HB       VAL  54  -2.104   4.228  -1.594
  446   1HG1  VAL  54          1HG1      VAL  54  -1.490   2.477  -0.151
  447   2HG1  VAL  54          2HG1      VAL  54  -2.618   1.721  -1.302
  448   3HG1  VAL  54          3HG1      VAL  54  -0.864   1.475  -1.482
  449   1HG2  VAL  54          1HG2      VAL  54   0.333   4.071  -1.275
  450   2HG2  VAL  54          2HG2      VAL  54   0.464   3.104  -2.764
  451   3HG2  VAL  54          3HG2      VAL  54  -0.079   4.796  -2.848
  452    H    THR  55           H        THR  55  -4.667   3.875  -3.868
  453    HA   THR  55           HA       THR  55  -3.839   6.363  -5.213
  454    HB   THR  55           HB       THR  55  -4.930   5.214  -6.922
  455    HG1  THR  55           HG1      THR  55  -6.282   7.059  -6.263
  456   1HG2  THR  55          1HG2      THR  55  -7.030   3.758  -6.342
  457   2HG2  THR  55          2HG2      THR  55  -5.433   3.083  -5.940
  458   3HG2  THR  55          3HG2      THR  55  -6.434   3.820  -4.666
  459    H    PHE  56           H        PHE  56  -4.652   8.297  -4.544
  460    HA   PHE  56           HA       PHE  56  -6.657   8.156  -2.409
  461   1HB   PHE  56          1HB       PHE  56  -4.347  10.157  -2.546
  462   2HB   PHE  56          2HB       PHE  56  -5.318   9.753  -1.146
  463    HD1  PHE  56           HD1      PHE  56  -2.983   8.090  -3.543
  464    HD2  PHE  56           HD2      PHE  56  -4.382   8.381   0.453
  465    HE1  PHE  56           HE1      PHE  56  -1.243   6.435  -2.813
  466    HE2  PHE  56           HE2      PHE  56  -2.641   6.727   1.183
  467    HZ   PHE  56           HZ       PHE  56  -1.094   5.773  -0.459
  468    H    LEU  57           H        LEU  57  -7.849  10.239  -2.093
  469    HA   LEU  57           HA       LEU  57  -8.262  11.478  -4.694
  470   1HB   LEU  57          1HB       LEU  57 -10.100  10.451  -3.261
  471   2HB   LEU  57          2HB       LEU  57  -9.903  11.825  -2.192
  472    HG   LEU  57           HG       LEU  57 -10.269  13.231  -4.386
  473   1HD1  LEU  57          1HD1      LEU  57 -10.206  11.213  -5.857
  474   2HD1  LEU  57          2HD1      LEU  57 -11.744  10.695  -5.128
  475   3HD1  LEU  57          3HD1      LEU  57 -11.663  12.216  -6.046
  476   1HD2  LEU  57          1HD2      LEU  57 -12.495  11.805  -2.907
  477   2HD2  LEU  57          2HD2      LEU  57 -11.725  13.347  -2.464
  478   3HD2  LEU  57          3HD2      LEU  57 -12.705  13.236  -3.945
  479    H    ASN  58           H        ASN  58  -5.929  11.941  -2.676
  480    HA   ASN  58           HA       ASN  58  -6.220  14.392  -1.510
  481   1HB   ASN  58          1HB       ASN  58  -3.990  12.635  -2.357
  482   2HB   ASN  58          2HB       ASN  58  -3.544  14.330  -2.392
  483   1HD2  ASN  58          1HD2      ASN  58  -4.972  15.428  -0.379
  484   2HD2  ASN  58          2HD2      ASN  58  -4.507  14.785   1.159
  485    H    ASP  59           H        ASP  59  -5.649  13.419  -4.889
  486    HA   ASP  59           HA       ASP  59  -4.474  15.458  -6.058
  487   1HB   ASP  59          1HB       ASP  59  -5.256  13.791  -7.515
  488   2HB   ASP  59          2HB       ASP  59  -6.868  13.799  -6.828
  489    HD2  ASP  59           HD       ASP  59  -4.768  15.928  -8.483
  490    H    LYS  60           H        LYS  60  -7.878  15.353  -4.848
  491    HA   LYS  60           HA       LYS  60  -8.989  17.558  -5.878
  492   1HB   LYS  60          1HB       LYS  60  -9.184  16.165  -3.259
  493   2HB   LYS  60          2HB       LYS  60  -9.881  17.771  -3.336
  494   1HG   LYS  60          1HG       LYS  60 -10.696  16.523  -5.746
  495   2HG   LYS  60          2HG       LYS  60 -10.851  15.274  -4.527
  496   1HD   LYS  60          1HD       LYS  60 -11.918  18.059  -3.971
  497   2HD   LYS  60          2HD       LYS  60 -12.857  16.946  -4.947
  498   1HE   LYS  60          1HE       LYS  60 -13.093  15.377  -3.162
  499   2HE   LYS  60          2HE       LYS  60 -11.750  16.055  -2.262
  500   1HZ   LYS  60          1HZ       LYS  60 -14.124  17.725  -2.798
  501   2HZ   LYS  60          2HZ       LYS  60 -14.146  16.669  -1.557
  502    H    ASP  61           H        ASP  61  -6.546  17.458  -3.230
  503    HA   ASP  61           HA       ASP  61  -6.225  20.319  -3.690
  504   1HB   ASP  61          1HB       ASP  61  -5.491  19.109  -1.031
  505   2HB   ASP  61          2HB       ASP  61  -6.013  20.742  -1.391
  506    HD2  ASP  61           HD       ASP  61  -9.300  20.195  -1.148
  507    H    GLU  62           H        GLU  62  -4.157  20.700  -4.503
  508    HA   GLU  62           HA       GLU  62  -2.276  18.637  -4.602
  509   1HB   GLU  62          1HB       GLU  62  -2.575  20.607  -6.222
  510   2HB   GLU  62          2HB       GLU  62  -1.740  21.602  -5.047
  511   1HG   GLU  62          1HG       GLU  62   0.052  19.589  -5.150
  512   2HG   GLU  62          2HG       GLU  62  -0.667  19.342  -6.730
  513    HE2  GLU  62           HE       GLU  62   1.590  21.736  -5.201
  514    H    ASP  63           H        ASP  63  -3.065  21.036  -2.200
  515    HA   ASP  63           HA       ASP  63  -0.515  21.289  -1.077
  516   1HB   ASP  63          1HB       ASP  63  -3.106  22.349  -0.655
  517   2HB   ASP  63          2HB       ASP  63  -2.731  21.519   0.841
  518    HD2  ASP  63           HD       ASP  63  -2.258  24.291  -0.877
  519    H    ALA  64           H        ALA  64  -3.417  19.211  -0.455
  520    HA   ALA  64           HA       ALA  64  -2.145  17.858   1.737
  521   1HB   ALA  64          1HB       ALA  64  -4.587  18.303   1.646
  522   2HB   ALA  64          2HB       ALA  64  -4.712  17.260   0.209
  523   3HB   ALA  64          3HB       ALA  64  -4.231  16.564   1.775
  524    H    VAL  65           H        VAL  65  -2.195  17.651  -1.737
  525    HA   VAL  65           HA       VAL  65  -1.732  14.843  -1.890
  526    HB   VAL  65           HB       VAL  65  -2.459  16.869  -3.614
  527   1HG1  VAL  65          1HG1      VAL  65  -0.805  16.977  -5.377
  528   2HG1  VAL  65          2HG1      VAL  65  -0.056  17.496  -3.849
  529   3HG1  VAL  65          3HG1      VAL  65   0.269  15.868  -4.492
  530   1HG2  VAL  65          1HG2      VAL  65  -1.984  13.973  -3.718
  531   2HG2  VAL  65          2HG2      VAL  65  -3.339  14.939  -4.349
  532   3HG2  VAL  65          3HG2      VAL  65  -1.846  14.774  -5.301
  533    H    LYS  66           H        LYS  66   0.280  17.829  -1.824
  534    HA   LYS  66           HA       LYS  66   2.700  16.359  -2.211
  535   1HB   LYS  66          1HB       LYS  66   2.118  18.837  -2.798
  536   2HB   LYS  66          2HB       LYS  66   2.541  19.165  -1.131
  537   1HG   LYS  66          1HG       LYS  66   4.753  17.969  -1.522
  538   2HG   LYS  66          2HG       LYS  66   4.328  17.826  -3.216
  539   1HD   LYS  66          1HD       LYS  66   4.309  20.233  -3.513
  540   2HD   LYS  66          2HD       LYS  66   4.376  20.517  -1.784
  541   1HE   LYS  66          1HE       LYS  66   6.622  18.838  -2.555
  542   2HE   LYS  66          2HE       LYS  66   6.573  20.239  -3.606
  543   1HZ   LYS  66          1HZ       LYS  66   7.556  21.288  -1.881
  544   2HZ   LYS  66          2HZ       LYS  66   6.103  21.303  -1.147
  545    H    ALA  67           H        ALA  67   1.056  17.982   0.584
  546    HA   ALA  67           HA       ALA  67   3.013  17.231   2.453
  547   1HB   ALA  67          1HB       ALA  67   0.941  18.948   2.445
  548   2HB   ALA  67          2HB       ALA  67   0.160  17.586   3.282
  549   3HB   ALA  67          3HB       ALA  67   1.642  18.309   3.951
  550    H    GLY  68           H        GLY  68  -0.211  15.803   1.581
  551   1HA   GLY  68          1HA       GLY  68  -0.197  13.682   3.358
  552   2HA   GLY  68          2HA       GLY  68  -1.007  13.715   1.805
  553    H    ILE  69           H        ILE  69   0.761  13.592  -0.156
  554    HA   ILE  69           HA       ILE  69   1.744  11.008  -0.084
  555    HB   ILE  69           HB       ILE  69   1.176  12.568  -2.044
  556   1HG1  ILE  69          1HG1      ILE  69   3.494  10.624  -2.040
  557   2HG1  ILE  69          2HG1      ILE  69   1.815  10.299  -2.423
  558   1HG2  ILE  69          1HG2      ILE  69   4.128  13.172  -2.012
  559   2HG2  ILE  69          2HG2      ILE  69   2.835  13.906  -2.991
  560   3HG2  ILE  69          3HG2      ILE  69   2.946  14.262  -1.251
  561   1HD1  ILE  69          1HD1      ILE  69   2.646  10.515  -4.575
  562   2HD1  ILE  69          2HD1      ILE  69   2.236  12.220  -4.263
  563   3HD1  ILE  69          3HD1      ILE  69   3.916  11.662  -4.080
  564    H    LYS  70           H        LYS  70   3.261  14.138   0.765
  565    HA   LYS  70           HA       LYS  70   5.888  13.190   0.908
  566   1HB   LYS  70          1HB       LYS  70   5.472  15.536   0.778
  567   2HB   LYS  70          2HB       LYS  70   4.454  15.516   2.204
  568   1HG   LYS  70          1HG       LYS  70   6.293  15.195   3.676
  569   2HG   LYS  70          2HG       LYS  70   7.330  14.577   2.406
  570   1HD   LYS  70          1HD       LYS  70   7.975  16.889   3.046
  571   2HD   LYS  70          2HD       LYS  70   7.468  16.815   1.370
  572   1HE   LYS  70          1HE       LYS  70   5.995  18.481   1.834
  573   2HE   LYS  70          2HE       LYS  70   5.071  17.312   2.757
  574   1HZ   LYS  70          1HZ       LYS  70   5.629  19.182   4.160
  575   2HZ   LYS  70          2HZ       LYS  70   6.470  17.901   4.710
  576    H    ALA  71           H        ALA  71   3.099  12.975   3.103
  577    HA   ALA  71           HA       ALA  71   4.663  12.184   5.353
  578   1HB   ALA  71          1HB       ALA  71   2.656  13.117   6.007
  579   2HB   ALA  71          2HB       ALA  71   1.762  12.430   4.629
  580   3HB   ALA  71          3HB       ALA  71   2.196  11.398   6.013
  581    H    LEU  72           H        LEU  72   3.007  10.590   2.616
  582    HA   LEU  72           HA       LEU  72   3.214   7.985   3.739
  583   1HB   LEU  72          1HB       LEU  72   2.611   9.034   0.977
  584   2HB   LEU  72          2HB       LEU  72   2.677   7.322   1.350
  585    HG   LEU  72           HG       LEU  72   0.718   9.381   2.364
  586   1HD1  LEU  72          1HD1      LEU  72   0.435   6.794   0.819
  587   2HD1  LEU  72          2HD1      LEU  72  -0.931   7.725   1.478
  588   3HD1  LEU  72          3HD1      LEU  72   0.125   8.448   0.240
  589   1HD2  LEU  72          1HD2      LEU  72   1.344   8.136   4.322
  590   2HD2  LEU  72          2HD2      LEU  72  -0.261   7.587   3.781
  591   3HD2  LEU  72          3HD2      LEU  72   1.179   6.592   3.452
  592    H    GLN  73           H        GLN  73   5.342  10.173   1.991
  593    HA   GLN  73           HA       GLN  73   7.055   8.096   1.087
  594   1HB   GLN  73          1HB       GLN  73   6.706  10.863   0.567
  595   2HB   GLN  73          2HB       GLN  73   8.320  10.725   1.234
  596   1HG   GLN  73          1HG       GLN  73   7.699   8.591  -0.724
  597   2HG   GLN  73          2HG       GLN  73   7.602  10.198  -1.415
  598   1HE2  GLN  73          1HE2      GLN  73   9.617   7.754  -0.055
  599   2HE2  GLN  73          2HE2      GLN  73  11.161   8.488  -0.344
  600    H    GLU  74           H        GLU  74   7.203  10.646   3.670
  601    HA   GLU  74           HA       GLU  74   9.661   9.821   4.655
  602   1HB   GLU  74          1HB       GLU  74   9.155  11.243   6.570
  603   2HB   GLU  74          2HB       GLU  74   8.593  12.033   5.111
  604   1HG   GLU  74          1HG       GLU  74   6.549  12.203   6.078
  605   2HG   GLU  74          2HG       GLU  74   6.392  10.465   5.920
  606    HE2  GLU  74           HE       GLU  74   6.814   9.536   8.881
  607    H    ALA  75           H        ALA  75   6.337   8.679   5.182
  608    HA   ALA  75           HA       ALA  75   7.180   7.030   7.421
  609   1HB   ALA  75          1HB       ALA  75   4.813   6.549   7.650
  610   2HB   ALA  75          2HB       ALA  75   5.010   8.302   7.412
  611   3HB   ALA  75          3HB       ALA  75   4.467   7.277   6.062
  612    H    SER  76           H        SER  76   8.016   6.807   4.398
  613    HA   SER  76           HA       SER  76   6.853   4.590   3.311
  614   1HB   SER  76          1HB       SER  76   8.293   5.750   1.877
  615   2HB   SER  76          2HB       SER  76   9.559   5.893   3.081
  616    HG   SER  76           HG       SER  76  10.450   4.129   2.281
  617    H    GLY  77           H        GLY  77  10.182   4.544   4.780
  618   1HA   GLY  77          1HA       GLY  77  10.385   1.826   5.128
  619   2HA   GLY  77          2HA       GLY  77  11.213   3.035   6.089
  620    H    PHE  78           H        PHE  78   8.348   4.109   6.849
  621    HA   PHE  78           HA       PHE  78   8.201   2.605   9.261
  622   1HB   PHE  78          1HB       PHE  78   7.218   5.085   8.022
  623   2HB   PHE  78          2HB       PHE  78   5.878   4.260   8.794
  624    HD1  PHE  78           HD1      PHE  78   8.439   6.567   9.296
  625    HD2  PHE  78           HD2      PHE  78   6.434   3.383  11.255
  626    HE1  PHE  78           HE1      PHE  78   9.152   7.487  11.519
  627    HE2  PHE  78           HE2      PHE  78   7.146   4.303  13.480
  628    HZ   PHE  78           HZ       PHE  78   8.496   6.343  13.585
  629    H    ILE  79           H        ILE  79   6.193   2.934   6.275
  630    HA   ILE  79           HA       ILE  79   4.150   1.226   7.259
  631    HB   ILE  79           HB       ILE  79   3.439   1.252   4.845
  632   1HG1  ILE  79          1HG1      ILE  79   5.582   3.346   4.465
  633   2HG1  ILE  79          2HG1      ILE  79   5.853   1.666   4.049
  634   1HG2  ILE  79          1HG2      ILE  79   3.799   3.732   6.511
  635   2HG2  ILE  79          2HG2      ILE  79   2.994   3.801   4.925
  636   3HG2  ILE  79          3HG2      ILE  79   2.333   2.768   6.215
  637   1HD1  ILE  79          1HD1      ILE  79   3.580   3.399   2.976
  638   2HD1  ILE  79          2HD1      ILE  79   5.053   2.948   2.085
  639   3HD1  ILE  79          3HD1      ILE  79   3.874   1.697   2.544
  640    H    ARG  80           H        ARG  80   7.120   0.822   5.283
  641    HA   ARG  80           HA       ARG  80   6.555  -1.796   4.542
  642   1HB   ARG  80          1HB       ARG  80   8.240  -0.650   3.288
  643   2HB   ARG  80          2HB       ARG  80   9.095  -0.137   4.728
  644   1HG   ARG  80          1HG       ARG  80  10.013  -2.302   5.114
  645   2HG   ARG  80          2HG       ARG  80   8.814  -3.096   4.111
  646   1HD   ARG  80          1HD       ARG  80  10.769  -3.097   2.758
  647   2HD   ARG  80          2HD       ARG  80   9.827  -1.765   2.119
  648    HE   ARG  80           HE       ARG  80  11.445  -0.259   2.906
  649   1HH1  ARG  80          2HH2      ARG  80  11.947  -3.406   4.456
  650   2HH1  ARG  80          1HH2      ARG  80  13.453  -2.948   5.180
  651   1HH2  ARG  80          1HH       ARG  80  14.307  -0.738   4.816
  652    H    SER  81           H        SER  81   8.475  -0.342   7.250
  653    HA   SER  81           HA       SER  81   9.269  -2.839   8.262
  654   1HB   SER  81          1HB       SER  81  10.575  -0.843   8.745
  655   2HB   SER  81          2HB       SER  81   9.195  -0.047   9.476
  656    HG   SER  81           HG       SER  81  10.634  -2.346  10.479
  657    H    LEU  82           H        LEU  82   6.557  -0.565   8.881
  658    HA   LEU  82           HA       LEU  82   5.617  -1.758  11.220
  659   1HB   LEU  82          1HB       LEU  82   4.977   0.459  10.504
  660   2HB   LEU  82          2HB       LEU  82   4.207  -0.181   9.066
  661    HG   LEU  82           HG       LEU  82   3.143  -1.351  11.535
  662   1HD1  LEU  82          1HD1      LEU  82   2.753   1.623  11.101
  663   2HD1  LEU  82          2HD1      LEU  82   1.960   0.610  12.331
  664   3HD1  LEU  82          3HD1      LEU  82   3.718   0.884  12.402
  665   1HD2  LEU  82          1HD2      LEU  82   1.554  -1.749  10.036
  666   2HD2  LEU  82          2HD2      LEU  82   1.135  -0.019  10.103
  667   3HD2  LEU  82          3HD2      LEU  82   2.280  -0.611   8.876
  668    H    LEU  83           H        LEU  83   5.165  -2.525   7.752
  669    HA   LEU  83           HA       LEU  83   3.087  -4.390   8.192
  670   1HB   LEU  83          1HB       LEU  83   4.778  -3.468   5.964
  671   2HB   LEU  83          2HB       LEU  83   4.239  -5.130   5.835
  672    HG   LEU  83           HG       LEU  83   1.905  -4.433   5.999
  673   1HD1  LEU  83          1HD1      LEU  83   2.741  -1.542   5.925
  674   2HD1  LEU  83          2HD1      LEU  83   1.159  -2.253   6.321
  675   3HD1  LEU  83          3HD1      LEU  83   2.512  -2.398   7.468
  676   1HD2  LEU  83          1HD2      LEU  83   3.464  -2.860   3.928
  677   2HD2  LEU  83          2HD2      LEU  83   2.913  -4.546   3.789
  678   3HD2  LEU  83          3HD2      LEU  83   1.724  -3.226   3.864
  679    H    GLY  84           H        GLY  84   6.617  -4.826   7.430
  680   1HA   GLY  84          1HA       GLY  84   6.848  -7.513   7.610
  681   2HA   GLY  84          2HA       GLY  84   8.069  -6.390   8.179
  682    H    LYS  85           H        LYS  85   6.620  -5.173  10.360
  683    HA   LYS  85           HA       LYS  85   6.958  -7.271  12.286
  684   1HB   LYS  85          1HB       LYS  85   6.776  -4.325  12.273
  685   2HB   LYS  85          2HB       LYS  85   6.043  -5.084  13.671
  686   1HG   LYS  85          1HG       LYS  85   8.266  -6.524  13.736
  687   2HG   LYS  85          2HG       LYS  85   8.919  -5.248  12.728
  688   1HD   LYS  85          1HD       LYS  85   7.413  -4.223  15.066
  689   2HD   LYS  85          2HD       LYS  85   8.790  -5.207  15.515
  690   1HE   LYS  85          1HE       LYS  85   9.875  -3.642  13.497
  691   2HE   LYS  85          2HE       LYS  85   8.723  -2.532  14.213
  692   1HZ   LYS  85          1HZ       LYS  85   9.821  -2.609  16.249
  693   2HZ   LYS  85          2HZ       LYS  85  10.504  -4.064  15.988
  694    H    ALA  86           H        ALA  86   4.273  -5.382  10.830
  695    HA   ALA  86           HA       ALA  86   2.281  -6.297  12.571
  696   1HB   ALA  86          1HB       ALA  86   0.928  -5.770  10.288
  697   2HB   ALA  86          2HB       ALA  86   1.550  -4.494  11.361
  698   3HB   ALA  86          3HB       ALA  86   2.466  -4.962   9.908
  699    H    MET  87           H        MET  87   3.908  -7.717   9.747
  700    HA   MET  87           HA       MET  87   2.082  -9.982   9.983
  701   1HB   MET  87          1HB       MET  87   3.922  -9.438   7.611
  702   2HB   MET  87          2HB       MET  87   2.458 -10.400   7.637
  703   1HG   MET  87          1HG       MET  87   1.241  -8.150   8.250
  704   2HG   MET  87          2HG       MET  87   2.710  -7.370   7.699
  705   1HE   MET  87          1HE       MET  87   2.546  -6.507   4.957
  706   2HE   MET  87          2HE       MET  87   3.774  -7.588   5.659
  707   3HE   MET  87          3HE       MET  87   3.035  -7.982   4.089
  708    H    ARG  88           H        ARG  88   4.748  -9.144  11.422
  709    HA   ARG  88           HA       ARG  88   6.826  -9.978  11.655
  710   1HB   ARG  88          1HB       ARG  88   4.787 -12.051  12.552
  711   2HB   ARG  88          2HB       ARG  88   6.494 -12.313  12.848
  712   1HG   ARG  88          1HG       ARG  88   6.582 -10.039  13.986
  713   2HG   ARG  88          2HG       ARG  88   4.844  -9.926  13.799
  714   1HD   ARG  88          1HD       ARG  88   5.468 -12.509  14.959
  715   2HD   ARG  88          2HD       ARG  88   6.316 -11.276  15.870
  716    HE   ARG  88           HE       ARG  88   3.626 -10.392  15.393
  717   1HH1  ARG  88          2HH2      ARG  88   5.413 -12.769  17.319
  718   2HH1  ARG  88          1HH2      ARG  88   4.226 -12.825  18.580
  719   1HH2  ARG  88          1HH       ARG  88   2.264 -11.461  18.405
  720    H    LEU  89           H        LEU  89   7.662 -10.190   9.450
  721    HA   LEU  89           HA       LEU  89   7.710 -12.988   8.563
  722   1HB   LEU  89          1HB       LEU  89   6.352 -11.048   7.251
  723   2HB   LEU  89          2HB       LEU  89   7.929 -10.878   6.505
  724    HG   LEU  89           HG       LEU  89   7.902 -13.214   5.807
  725   1HD1  LEU  89          1HD1      LEU  89   6.722 -14.710   6.943
  726   2HD1  LEU  89          2HD1      LEU  89   5.815 -13.431   7.786
  727   3HD1  LEU  89          3HD1      LEU  89   5.244 -14.038   6.213
  728   1HD2  LEU  89          1HD2      LEU  89   5.248 -12.005   5.023
  729   2HD2  LEU  89          2HD2      LEU  89   6.807 -11.363   4.451
  730   3HD2  LEU  89          3HD2      LEU  89   6.334 -13.032   4.058
  731    H    ARG  90           H        ARG  90   9.520 -12.000   6.302
  732    HA   ARG  90           HA       ARG  90  11.767 -10.991   7.737
  733   1HB   ARG  90          1HB       ARG  90  13.232 -12.961   6.984
  734   2HB   ARG  90          2HB       ARG  90  12.119 -13.310   8.293
  735   1HG   ARG  90          1HG       ARG  90  10.538 -13.886   6.104
  736   2HG   ARG  90          2HG       ARG  90  12.120 -14.317   5.485
  737   1HD   ARG  90          1HD       ARG  90  11.587 -15.280   8.257
  738   2HD   ARG  90          2HD       ARG  90  10.536 -15.975   7.037
  739    HE   ARG  90           HE       ARG  90  13.083 -16.144   5.913
  740   1HH1  ARG  90          2HH2      ARG  90  11.604 -17.294   8.920
  741   2HH1  ARG  90          1HH2      ARG  90  12.645 -18.672   9.051
  742   1HH2  ARG  90          1HH       ARG  90  14.315 -19.045   7.373
  743    H    ILE  91           H        ILE  91  10.380 -12.480   4.759
  744    HA   ILE  91           HA       ILE  91  12.164 -11.965   2.860
  745    HB   ILE  91           HB       ILE  91  10.096 -11.250   1.455
  746   1HG1  ILE  91          1HG1      ILE  91   8.363 -12.528   3.448
  747   2HG1  ILE  91          2HG1      ILE  91   8.962 -10.967   3.969
  748   1HG2  ILE  91          1HG2      ILE  91  11.111 -13.753   2.417
  749   2HG2  ILE  91          2HG2      ILE  91   9.344 -13.864   2.233
  750   3HG2  ILE  91          3HG2      ILE  91  10.353 -13.366   0.854
  751   1HD1  ILE  91          1HD1      ILE  91   8.098 -11.004   1.133
  752   2HD1  ILE  91          2HD1      ILE  91   6.794 -11.349   2.293
  753   3HD1  ILE  91          3HD1      ILE  91   7.722  -9.834   2.421
  754    H    VAL  92           H        VAL  92  10.338  -9.530   4.717
  755    HA   VAL  92           HA       VAL  92  10.197  -7.276   4.291
  756    HB   VAL  92           HB       VAL  92  13.069  -7.892   5.010
  757   1HG1  VAL  92          1HG1      VAL  92  13.221  -5.651   4.459
  758   2HG1  VAL  92          2HG1      VAL  92  11.533  -5.311   4.911
  759   3HG1  VAL  92          3HG1      VAL  92  12.763  -5.554   6.175
  760   1HG2  VAL  92          1HG2      VAL  92  10.504  -7.774   6.537
  761   2HG2  VAL  92          2HG2      VAL  92  11.923  -8.826   6.755
  762   3HG2  VAL  92          3HG2      VAL  92  11.969  -7.142   7.325
  763    HA   PRO  93           HA       PRO  93  12.030  -7.282   0.103
  764   1HB   PRO  93          1HB       PRO  93   9.733  -7.296  -1.379
  765   2HB   PRO  93          2HB       PRO  93  10.651  -8.745  -1.021
  766   1HG   PRO  93          1HG       PRO  93   8.096  -7.833   0.155
  767   2HG   PRO  93          2HG       PRO  93   8.803  -9.437   0.174
  768   1HD   PRO  93          1HD       PRO  93   8.754  -7.556   2.340
  769   2HD   PRO  93          2HD       PRO  93   9.560  -9.113   2.321
  770    H    GLU  94           H        GLU  94  12.159  -5.581  -1.492
  771    HA   GLU  94           HA       GLU  94  11.724  -3.135  -0.218
  772   1HB   GLU  94          1HB       GLU  94  13.221  -4.068  -2.391
  773   2HB   GLU  94          2HB       GLU  94  12.065  -2.989  -3.143
  774   1HG   GLU  94          1HG       GLU  94  12.723  -1.143  -1.672
  775   2HG   GLU  94          2HG       GLU  94  13.729  -2.206  -0.708
  776    HE2  GLU  94           HE       GLU  94  16.257  -1.235  -2.054
  777    H    LEU  95           H        LEU  95   9.304  -3.738   0.206
  778    HA   LEU  95           HA       LEU  95   7.517  -3.557  -1.980
  779   1HB   LEU  95          1HB       LEU  95   5.821  -3.297  -0.150
  780   2HB   LEU  95          2HB       LEU  95   6.784  -4.760  -0.126
  781    HG   LEU  95           HG       LEU  95   8.166  -2.907   1.501
  782   1HD1  LEU  95          1HD1      LEU  95   6.677  -1.537   2.406
  783   2HD1  LEU  95          2HD1      LEU  95   5.369  -2.278   1.453
  784   3HD1  LEU  95          3HD1      LEU  95   5.796  -2.943   3.048
  785   1HD2  LEU  95          1HD2      LEU  95   6.473  -5.337   2.120
  786   2HD2  LEU  95          2HD2      LEU  95   8.237  -5.256   1.890
  787   3HD2  LEU  95          3HD2      LEU  95   7.491  -4.503   3.319
  788    H    THR  96           H        THR  96   7.960  -1.705  -3.215
  789    HA   THR  96           HA       THR  96   8.274   0.848  -2.020
  790    HB   THR  96           HB       THR  96   9.143   0.025  -4.289
  791    HG1  THR  96           HG1      THR  96   9.190   2.248  -4.247
  792   1HG2  THR  96          1HG2      THR  96   6.208  -0.081  -4.759
  793   2HG2  THR  96          2HG2      THR  96   7.092   0.875  -5.971
  794   3HG2  THR  96          3HG2      THR  96   7.526  -0.828  -5.692
  795    H    PHE  97           H        PHE  97   6.829   2.735  -2.430
  796    HA   PHE  97           HA       PHE  97   4.038   1.862  -2.169
  797   1HB   PHE  97          1HB       PHE  97   5.739   3.242  -0.388
  798   2HB   PHE  97          2HB       PHE  97   4.883   4.553  -1.175
  799    HD1  PHE  97           HD1      PHE  97   3.415   5.346   0.445
  800    HD2  PHE  97           HD2      PHE  97   3.635   1.166  -0.254
  801    HE1  PHE  97           HE1      PHE  97   1.460   4.989   1.976
  802    HE2  PHE  97           HE2      PHE  97   1.679   0.808   1.278
  803    HZ   PHE  97           HZ       PHE  97   0.615   2.723   2.375
  804    H    PHE  98           H        PHE  98   3.103   2.214  -4.152
  805    HA   PHE  98           HA       PHE  98   3.894   4.586  -5.628
  806   1HB   PHE  98          1HB       PHE  98   2.871   1.884  -6.110
  807   2HB   PHE  98          2HB       PHE  98   1.757   3.030  -6.829
  808    HD1  PHE  98           HD1      PHE  98   3.026   4.985  -8.195
  809    HD2  PHE  98           HD2      PHE  98   4.559   1.099  -7.459
  810    HE1  PHE  98           HE1      PHE  98   4.537   5.205 -10.187
  811    HE2  PHE  98           HE2      PHE  98   6.070   1.318  -9.450
  812    HZ   PHE  98           HZ       PHE  98   6.042   3.369 -10.790
  813    H    TYR  99           H        TYR  99   2.776   6.465  -5.455
  814    HA   TYR  99           HA       TYR  99   0.074   6.314  -4.335
  815   1HB   TYR  99          1HB       TYR  99   1.435   8.928  -4.865
  816   2HB   TYR  99          2HB       TYR  99   0.697   8.371  -3.377
  817    HD1  TYR  99           HD1      TYR  99   3.803   8.528  -5.326
  818    HD2  TYR  99           HD2      TYR  99   1.998   7.121  -1.711
  819    HE1  TYR  99           HE1      TYR  99   6.105   8.129  -4.322
  820    HE2  TYR  99           HE2      TYR  99   4.305   6.727  -0.720
  821    HH   TYR  99           HH       TYR  99   7.228   7.497  -2.596
  822    H    ASP 100           H        ASP 100  -1.191   5.796  -6.162
  823    HA   ASP 100           HA       ASP 100  -0.870   7.543  -8.444
  824   1HB   ASP 100          1HB       ASP 100  -1.260   4.884  -8.381
  825   2HB   ASP 100          2HB       ASP 100  -2.945   5.352  -8.279
  826    HD2  ASP 100           HD       ASP 100  -1.153   6.583 -11.647
  827    H    ASN 101           H        ASN 101  -1.839   9.497  -7.538
  828    HA   ASN 101           HA       ASN 101  -4.526   9.227  -6.527
  829   1HB   ASN 101          1HB       ASN 101  -3.162  11.904  -6.857
  830   2HB   ASN 101          2HB       ASN 101  -4.224  11.364  -5.573
  831   1HD2  ASN 101          1HD2      ASN 101  -1.430  12.535  -5.745
  832   2HD2  ASN 101          2HD2      ASN 101  -0.447  11.528  -4.736
  833    H    SER 102           H        SER 102  -5.712  11.641  -7.300
  834    HA   SER 102           HA       SER 102  -6.083  11.159 -10.103
  835   1HB   SER 102          1HB       SER 102  -7.642  13.391  -9.172
  836   2HB   SER 102          2HB       SER 102  -8.197  11.793  -9.628
  837    HG   SER 102           HG       SER 102  -7.550  11.109  -7.392
  838    H    LEU 103           H        LEU 103  -3.618  12.550  -8.758
  839    HA   LEU 103           HA       LEU 103  -3.811  15.141 -10.093
  840   1HB   LEU 103          1HB       LEU 103  -3.145  15.086  -7.733
  841   2HB   LEU 103          2HB       LEU 103  -1.780  14.063  -8.133
  842    HG   LEU 103           HG       LEU 103  -1.461  16.262  -9.816
  843   1HD1  LEU 103          1HD1      LEU 103  -3.046  17.657  -8.800
  844   2HD1  LEU 103          2HD1      LEU 103  -2.602  17.124  -7.160
  845   3HD1  LEU 103          3HD1      LEU 103  -1.491  18.156  -8.092
  846   1HD2  LEU 103          1HD2      LEU 103   0.453  16.791  -8.375
  847   2HD2  LEU 103          2HD2      LEU 103  -0.193  15.708  -7.120
  848   3HD2  LEU 103          3HD2      LEU 103   0.321  15.044  -8.690
  849    H    VAL 104           H        VAL 104  -3.146  12.042 -10.946
  850    HA   VAL 104           HA       VAL 104  -1.182  12.949 -12.914
  851    HB   VAL 104           HB       VAL 104  -0.952  10.727 -10.945
  852   1HG1  VAL 104          1HG1      VAL 104  -1.008   9.408 -12.931
  853   2HG1  VAL 104          2HG1      VAL 104   0.016  10.567 -13.813
  854   3HG1  VAL 104          3HG1      VAL 104   0.707   9.597 -12.491
  855   1HG2  VAL 104          1HG2      VAL 104   0.452  12.576 -10.516
  856   2HG2  VAL 104          2HG2      VAL 104   1.511  11.360 -11.268
  857   3HG2  VAL 104          3HG2      VAL 104   0.913  12.734 -12.229
  858    H    GLU 105           H        GLU 105  -4.251  12.061 -12.393
  859    HA   GLU 105           HA       GLU 105  -4.449  10.950 -15.017
  860   1HB   GLU 105          1HB       GLU 105  -4.712   9.268 -12.608
  861   2HB   GLU 105          2HB       GLU 105  -6.134   9.199 -13.631
  862   1HG   GLU 105          1HG       GLU 105  -5.027   7.777 -15.004
  863   2HG   GLU 105          2HG       GLU 105  -3.938   9.082 -15.427
  864    HE2  GLU 105           HE       GLU 105  -1.796   6.818 -14.714
  865    H    GLY 106           H        GLY 106  -5.986  11.953 -11.925
  866   1HA   GLY 106          1HA       GLY 106  -7.631  13.552 -11.722
  867   2HA   GLY 106          2HA       GLY 106  -7.976  13.447 -13.437
  868    H    MET 107           H        MET 107  -7.929  10.329 -13.103
  869    HA   MET 107           HA       MET 107 -10.694  10.218 -12.209
  870   1HB   MET 107          1HB       MET 107  -9.079   8.166 -13.822
  871   2HB   MET 107          2HB       MET 107 -10.818   8.168 -13.600
  872   1HG   MET 107          1HG       MET 107 -11.158   9.782 -15.204
  873   2HG   MET 107          2HG       MET 107  -9.758  10.714 -14.713
  874   1HE   MET 107          1HE       MET 107  -7.434   9.835 -14.888
  875   2HE   MET 107          2HE       MET 107  -7.400   8.062 -15.035
  876   3HE   MET 107          3HE       MET 107  -6.795   9.076 -16.366
  877    H    ARG 108           H        ARG 108  -8.033  10.102 -10.576
  878    HA   ARG 108           HA       ARG 108  -8.451   7.463  -9.442
  879   1HB   ARG 108          1HB       ARG 108  -6.108   9.336  -9.623
  880   2HB   ARG 108          2HB       ARG 108  -6.216   8.381  -8.159
  881   1HG   ARG 108          1HG       ARG 108  -6.111   7.344 -11.026
  882   2HG   ARG 108          2HG       ARG 108  -4.895   7.131  -9.782
  883   1HD   ARG 108          1HD       ARG 108  -6.905   5.983  -8.440
  884   2HD   ARG 108          2HD       ARG 108  -7.598   5.792 -10.039
  885    HE   ARG 108           HE       ARG 108  -4.787   4.915  -9.741
  886   1HH1  ARG 108          2HH2      ARG 108  -8.200   3.972  -9.830
  887   2HH1  ARG 108          1HH2      ARG 108  -7.860   2.305 -10.155
  888   1HH2  ARG 108          1HH       ARG 108  -5.581   1.589 -10.353
  Start of MODEL    5
    1    H    MET   1           H        MET   1 -10.383  -8.642   0.103
    2    HA   MET   1           HA       MET   1  -8.926 -11.068  -0.308
    3   1HB   MET   1          1HB       MET   1 -10.432 -11.246   1.858
    4   2HB   MET   1          2HB       MET   1 -11.786 -11.270   0.746
    5   1HG   MET   1          1HG       MET   1 -11.008 -13.307  -0.312
    6   2HG   MET   1          2HG       MET   1  -9.435 -13.191   0.452
    7   1HE   MET   1          1HE       MET   1 -13.165 -12.749   1.892
    8   2HE   MET   1          2HE       MET   1 -13.103 -14.071   0.701
    9   3HE   MET   1          3HE       MET   1 -13.392 -14.434   2.420
   10    H    ALA   2           H        ALA   2 -10.151 -12.533  -1.928
   11    HA   ALA   2           HA       ALA   2 -12.369 -11.765  -3.316
   12   1HB   ALA   2          1HB       ALA   2 -10.315  -9.877  -3.746
   13   2HB   ALA   2          2HB       ALA   2 -10.351 -10.885  -5.214
   14   3HB   ALA   2          3HB       ALA   2 -11.827 -10.053  -4.670
   15    H    LYS   3           H        LYS   3  -9.039 -13.047  -3.350
   16    HA   LYS   3           HA       LYS   3 -10.020 -15.203  -5.089
   17   1HB   LYS   3          1HB       LYS   3  -8.093 -13.443  -5.803
   18   2HB   LYS   3          2HB       LYS   3  -7.104 -14.637  -4.987
   19   1HG   LYS   3          1HG       LYS   3  -7.244 -15.296  -7.313
   20   2HG   LYS   3          2HG       LYS   3  -8.205 -16.437  -6.397
   21   1HD   LYS   3          1HD       LYS   3  -9.988 -14.319  -7.046
   22   2HD   LYS   3          2HD       LYS   3  -9.050 -14.589  -8.501
   23   1HE   LYS   3          1HE       LYS   3  -9.609 -17.193  -7.669
   24   2HE   LYS   3          2HE       LYS   3 -11.068 -16.338  -7.211
   25   1HZ   LYS   3          1HZ       LYS   3 -11.446 -15.697  -9.428
   26   2HZ   LYS   3          2HZ       LYS   3  -9.915 -15.975  -9.909
   27    H    GLU   4           H        GLU   4 -10.745 -16.492  -3.344
   28    HA   GLU   4           HA       GLU   4  -8.701 -17.164  -1.400
   29   1HB   GLU   4          1HB       GLU   4 -10.738 -18.377  -0.304
   30   2HB   GLU   4          2HB       GLU   4 -10.678 -16.627  -0.249
   31   1HG   GLU   4          1HG       GLU   4 -12.242 -16.421  -2.095
   32   2HG   GLU   4          2HG       GLU   4 -12.123 -18.129  -2.474
   33    HE2  GLU   4           HE       GLU   4 -15.137 -17.980  -0.774
   34    H    PHE   5           H        PHE   5  -7.382 -18.543  -2.716
   35    HA   PHE   5           HA       PHE   5  -8.571 -21.171  -3.089
   36   1HB   PHE   5          1HB       PHE   5  -8.483 -19.526  -5.216
   37   2HB   PHE   5          2HB       PHE   5  -6.768 -19.886  -5.195
   38    HD1  PHE   5           HD1      PHE   5  -9.961 -21.820  -4.915
   39    HD2  PHE   5           HD2      PHE   5  -6.105 -21.522  -6.662
   40    HE1  PHE   5           HE1      PHE   5 -10.389 -23.924  -6.217
   41    HE2  PHE   5           HE2      PHE   5  -6.533 -23.624  -7.964
   42    HZ   PHE   5           HZ       PHE   5  -8.669 -24.800  -7.726
   43    H    GLY   6           H        GLY   6  -6.442 -22.497  -4.253
   44   1HA   GLY   6          1HA       GLY   6  -4.460 -22.345  -2.109
   45   2HA   GLY   6          2HA       GLY   6  -4.708 -23.657  -3.242
   46    H    ARG   7           H        ARG   7  -4.891 -20.784  -5.015
   47    HA   ARG   7           HA       ARG   7  -2.320 -21.294  -6.112
   48   1HB   ARG   7          1HB       ARG   7  -4.777 -20.058  -6.967
   49   2HB   ARG   7          2HB       ARG   7  -3.515 -18.855  -7.140
   50   1HG   ARG   7          1HG       ARG   7  -2.989 -19.878  -9.102
   51   2HG   ARG   7          2HG       ARG   7  -2.283 -21.154  -8.131
   52   1HD   ARG   7          1HD       ARG   7  -4.520 -22.323  -8.089
   53   2HD   ARG   7          2HD       ARG   7  -5.176 -21.066  -9.121
   54    HE   ARG   7           HE       ARG   7  -4.106 -22.049 -10.952
   55   1HH1  ARG   7          2HH2      ARG   7  -2.582 -23.240  -7.984
   56   2HH1  ARG   7          1HH2      ARG   7  -1.587 -24.393  -8.808
   57   1HH2  ARG   7          1HH       ARG   7  -1.729 -24.571 -11.194
   58    HA   PRO   8           HA       PRO   8  -0.220 -17.852  -4.411
   59   1HB   PRO   8          1HB       PRO   8   0.913 -16.466  -6.477
   60   2HB   PRO   8          2HB       PRO   8   1.567 -17.971  -5.858
   61   1HG   PRO   8          1HG       PRO   8   0.061 -17.494  -8.356
   62   2HG   PRO   8          2HG       PRO   8   1.073 -18.858  -7.928
   63   1HD   PRO   8          1HD       PRO   8  -1.794 -18.785  -7.942
   64   2HD   PRO   8          2HD       PRO   8  -0.783 -20.110  -7.403
   65    H    GLN   9           H        GLN   9  -3.005 -17.324  -5.971
   66    HA   GLN   9           HA       GLN   9  -2.880 -14.467  -5.810
   67   1HB   GLN   9          1HB       GLN   9  -4.319 -16.252  -7.369
   68   2HB   GLN   9          2HB       GLN   9  -5.531 -15.735  -6.213
   69   1HG   GLN   9          1HG       GLN   9  -5.803 -13.881  -7.499
   70   2HG   GLN   9          2HG       GLN   9  -4.255 -13.335  -6.886
   71   1HE2  GLN   9          1HE2      GLN   9  -3.910 -12.232  -8.834
   72   2HE2  GLN   9          2HE2      GLN   9  -3.388 -13.036 -10.277
   73    H    ARG  10           H        ARG  10  -3.882 -17.213  -3.852
   74    HA   ARG  10           HA       ARG  10  -5.714 -15.809  -2.269
   75   1HB   ARG  10          1HB       ARG  10  -5.324 -18.401  -2.560
   76   2HB   ARG  10          2HB       ARG  10  -4.105 -18.211  -1.315
   77   1HG   ARG  10          1HG       ARG  10  -6.814 -17.004  -0.790
   78   2HG   ARG  10          2HG       ARG  10  -6.688 -18.750  -0.731
   79   1HD   ARG  10          1HD       ARG  10  -4.731 -16.971   0.783
   80   2HD   ARG  10          2HD       ARG  10  -6.272 -17.430   1.480
   81    HE   ARG  10           HE       ARG  10  -4.995 -19.794   0.499
   82   1HH1  ARG  10          2HH2      ARG  10  -4.615 -17.399   3.082
   83   2HH1  ARG  10          1HH2      ARG  10  -3.818 -18.499   4.154
   84   1HH2  ARG  10          1HH       ARG  10  -3.433 -20.757   3.448
   85    H    VAL  11           H        VAL  11  -2.233 -16.762  -1.866
   86    HA   VAL  11           HA       VAL  11  -1.932 -15.593   0.666
   87    HB   VAL  11           HB       VAL  11  -0.495 -17.261  -0.875
   88   1HG1  VAL  11          1HG1      VAL  11   1.081 -14.672  -0.999
   89   2HG1  VAL  11          2HG1      VAL  11   1.536 -16.258  -1.665
   90   3HG1  VAL  11          3HG1      VAL  11   0.178 -15.352  -2.372
   91   1HG2  VAL  11          1HG2      VAL  11   1.017 -17.357   0.880
   92   2HG2  VAL  11          2HG2      VAL  11   1.003 -15.596   1.133
   93   3HG2  VAL  11          3HG2      VAL  11  -0.385 -16.580   1.654
   94    H    ALA  12           H        ALA  12  -1.533 -14.371  -2.694
   95    HA   ALA  12           HA       ALA  12  -0.341 -11.940  -2.005
   96   1HB   ALA  12          1HB       ALA  12  -0.275 -12.751  -4.268
   97   2HB   ALA  12          2HB       ALA  12  -2.051 -12.836  -4.354
   98   3HB   ALA  12          3HB       ALA  12  -1.238 -11.253  -4.279
   99    H    GLN  13           H        GLN  13  -3.775 -13.000  -2.264
  100    HA   GLN  13           HA       GLN  13  -4.798 -10.418  -1.883
  101   1HB   GLN  13          1HB       GLN  13  -6.004 -13.195  -1.576
  102   2HB   GLN  13          2HB       GLN  13  -6.943 -11.736  -1.327
  103   1HG   GLN  13          1HG       GLN  13  -6.390 -13.017  -3.801
  104   2HG   GLN  13          2HG       GLN  13  -7.226 -11.496  -3.561
  105   1HE2  GLN  13          1HE2      GLN  13  -6.057  -9.536  -3.584
  106   2HE2  GLN  13          2HE2      GLN  13  -4.544  -9.382  -4.414
  107    H    GLU  14           H        GLU  14  -4.792 -13.304   0.342
  108    HA   GLU  14           HA       GLU  14  -5.727 -12.210   2.554
  109   1HB   GLU  14          1HB       GLU  14  -3.750 -14.333   1.964
  110   2HB   GLU  14          2HB       GLU  14  -3.598 -13.677   3.582
  111   1HG   GLU  14          1HG       GLU  14  -6.414 -14.148   2.808
  112   2HG   GLU  14          2HG       GLU  14  -5.450 -15.611   2.764
  113    HE2  GLU  14           HE       GLU  14  -4.426 -16.171   4.973
  114    H    MET  15           H        MET  15  -2.344 -11.838   1.337
  115    HA   MET  15           HA       MET  15  -1.550 -10.304   3.563
  116   1HB   MET  15          1HB       MET  15  -0.335 -11.584   1.358
  117   2HB   MET  15          2HB       MET  15  -0.055  -9.886   1.030
  118   1HG   MET  15          1HG       MET  15   0.454 -10.385   3.846
  119   2HG   MET  15          2HG       MET  15   1.331 -11.569   2.898
  120   1HE   MET  15          1HE       MET  15   4.401  -9.753   2.192
  121   2HE   MET  15          2HE       MET  15   3.758 -10.414   3.714
  122   3HE   MET  15          3HE       MET  15   3.460 -11.264   2.179
  123    H    GLN  16           H        GLN  16  -2.806  -9.583   0.275
  124    HA   GLN  16           HA       GLN  16  -2.226  -6.873   0.314
  125   1HB   GLN  16          1HB       GLN  16  -2.919  -8.305  -1.680
  126   2HB   GLN  16          2HB       GLN  16  -4.570  -8.213  -1.099
  127   1HG   GLN  16          1HG       GLN  16  -3.034  -5.634  -1.415
  128   2HG   GLN  16          2HG       GLN  16  -3.603  -6.435  -2.866
  129   1HE2  GLN  16          1HE2      GLN  16  -4.980  -4.682  -3.256
  130   2HE2  GLN  16          2HE2      GLN  16  -6.485  -4.479  -2.423
  131    H    LYS  17           H        LYS  17  -4.874  -8.800   1.716
  132    HA   LYS  17           HA       LYS  17  -6.513  -6.522   2.255
  133   1HB   LYS  17          1HB       LYS  17  -7.424  -8.787   1.843
  134   2HB   LYS  17          2HB       LYS  17  -6.659  -9.360   3.312
  135   1HG   LYS  17          1HG       LYS  17  -7.965  -7.261   4.387
  136   2HG   LYS  17          2HG       LYS  17  -9.002  -7.487   2.993
  137   1HD   LYS  17          1HD       LYS  17 -10.070  -9.042   4.281
  138   2HD   LYS  17          2HD       LYS  17  -8.734 -10.095   3.857
  139   1HE   LYS  17          1HE       LYS  17  -8.444 -10.271   6.124
  140   2HE   LYS  17          2HE       LYS  17  -7.619  -8.733   5.969
  141   1HZ   LYS  17          1HZ       LYS  17 -10.295  -8.091   6.138
  142   2HZ   LYS  17          2HZ       LYS  17 -10.109  -9.274   7.241
  143    H    GLU  18           H        GLU  18  -4.156  -8.565   4.054
  144    HA   GLU  18           HA       GLU  18  -4.629  -7.330   6.509
  145   1HB   GLU  18          1HB       GLU  18  -3.501  -9.555   6.162
  146   2HB   GLU  18          2HB       GLU  18  -2.093  -8.720   5.538
  147   1HG   GLU  18          1HG       GLU  18  -1.453  -8.902   7.760
  148   2HG   GLU  18          2HG       GLU  18  -2.279  -7.359   7.838
  149    HE2  GLU  18           HE       GLU  18  -1.981  -9.675   9.699
  150    H    ILE  19           H        ILE  19  -2.327  -6.692   3.812
  151    HA   ILE  19           HA       ILE  19  -0.968  -4.632   5.236
  152    HB   ILE  19           HB       ILE  19   0.292  -4.347   3.284
  153   1HG1  ILE  19          1HG1      ILE  19  -2.015  -5.627   1.803
  154   2HG1  ILE  19          2HG1      ILE  19  -1.392  -3.998   1.627
  155   1HG2  ILE  19          1HG2      ILE  19   0.167  -7.058   2.547
  156   2HG2  ILE  19          2HG2      ILE  19   1.260  -6.294   3.725
  157   3HG2  ILE  19          3HG2      ILE  19  -0.285  -6.994   4.268
  158   1HD1  ILE  19          1HD1      ILE  19   0.893  -5.301   1.074
  159   2HD1  ILE  19          2HD1      ILE  19  -0.249  -6.591   0.623
  160   3HD1  ILE  19          3HD1      ILE  19  -0.336  -5.003  -0.179
  161    H    ALA  20           H        ALA  20  -3.583  -4.802   2.755
  162    HA   ALA  20           HA       ALA  20  -3.812  -2.109   2.235
  163   1HB   ALA  20          1HB       ALA  20  -5.004  -3.669   0.894
  164   2HB   ALA  20          2HB       ALA  20  -5.805  -4.396   2.307
  165   3HB   ALA  20          3HB       ALA  20  -6.258  -2.760   1.772
  166    H    LEU  21           H        LEU  21  -5.018  -4.068   4.991
  167    HA   LEU  21           HA       LEU  21  -6.608  -1.977   6.057
  168   1HB   LEU  21          1HB       LEU  21  -7.197  -4.187   6.592
  169   2HB   LEU  21          2HB       LEU  21  -5.570  -4.602   7.091
  170    HG   LEU  21           HG       LEU  21  -6.536  -2.444   8.736
  171   1HD1  LEU  21          1HD1      LEU  21  -8.779  -3.111   8.258
  172   2HD1  LEU  21          2HD1      LEU  21  -8.384  -4.829   8.499
  173   3HD1  LEU  21          3HD1      LEU  21  -8.368  -3.709   9.883
  174   1HD2  LEU  21          1HD2      LEU  21  -4.738  -3.918   9.388
  175   2HD2  LEU  21          2HD2      LEU  21  -6.081  -4.075  10.545
  176   3HD2  LEU  21          3HD2      LEU  21  -5.817  -5.331   9.312
  177    H    ILE  22           H        ILE  22  -3.387  -3.369   7.007
  178    HA   ILE  22           HA       ILE  22  -2.870  -1.473   8.972
  179    HB   ILE  22           HB       ILE  22  -1.000  -3.110   7.259
  180   1HG1  ILE  22          1HG1      ILE  22  -2.148  -3.618  10.019
  181   2HG1  ILE  22          2HG1      ILE  22  -2.628  -4.434   8.544
  182   1HG2  ILE  22          1HG2      ILE  22  -0.425  -1.674   9.865
  183   2HG2  ILE  22          2HG2      ILE  22   0.693  -2.720   8.956
  184   3HG2  ILE  22          3HG2      ILE  22   0.151  -1.176   8.256
  185   1HD1  ILE  22          1HD1      ILE  22   0.170  -4.473   9.768
  186   2HD1  ILE  22          2HD1      ILE  22  -1.005  -5.810   9.790
  187   3HD1  ILE  22          3HD1      ILE  22  -0.292  -5.276   8.249
  188    H    LEU  23           H        LEU  23  -2.896  -1.242   5.486
  189    HA   LEU  23           HA       LEU  23  -1.192   1.101   5.494
  190   1HB   LEU  23          1HB       LEU  23  -1.305  -0.794   3.728
  191   2HB   LEU  23          2HB       LEU  23  -2.734   0.037   3.148
  192    HG   LEU  23           HG       LEU  23  -1.510   1.973   2.543
  193   1HD1  LEU  23          1HD1      LEU  23   1.055   1.981   3.003
  194   2HD1  LEU  23          2HD1      LEU  23  -0.077   2.482   4.282
  195   3HD1  LEU  23          3HD1      LEU  23   0.639   0.853   4.316
  196   1HD2  LEU  23          1HD2      LEU  23  -1.277  -0.102   1.102
  197   2HD2  LEU  23          2HD2      LEU  23  -0.056   1.171   0.864
  198   3HD2  LEU  23          3HD2      LEU  23   0.350  -0.289   1.799
  199    H    GLN  24           H        GLN  24  -4.501   0.271   6.001
  200    HA   GLN  24           HA       GLN  24  -5.267   2.997   5.306
  201   1HB   GLN  24          1HB       GLN  24  -6.535   0.427   4.864
  202   2HB   GLN  24          2HB       GLN  24  -7.582   1.412   5.866
  203   1HG   GLN  24          1HG       GLN  24  -7.499   3.254   4.229
  204   2HG   GLN  24          2HG       GLN  24  -6.319   2.392   3.263
  205   1HE2  GLN  24          1HE2      GLN  24  -6.940   0.909   1.822
  206   2HE2  GLN  24          2HE2      GLN  24  -8.573   0.418   1.517
  207    H    ARG  25           H        ARG  25  -4.371   1.006   7.882
  208    HA   ARG  25           HA       ARG  25  -6.061   2.526   9.700
  209   1HB   ARG  25          1HB       ARG  25  -5.413  -0.295   9.562
  210   2HB   ARG  25          2HB       ARG  25  -4.752   0.338  11.056
  211   1HG   ARG  25          1HG       ARG  25  -7.543   1.200  10.360
  212   2HG   ARG  25          2HG       ARG  25  -7.336  -0.479  10.808
  213   1HD   ARG  25          1HD       ARG  25  -5.873   0.650  12.801
  214   2HD   ARG  25          2HD       ARG  25  -6.949   1.993  12.475
  215    HE   ARG  25           HE       ARG  25  -8.622  -0.253  12.604
  216   1HH1  ARG  25          2HH2      ARG  25  -6.343   1.345  14.796
  217   2HH1  ARG  25          1HH2      ARG  25  -7.181   0.849  16.229
  218   1HH2  ARG  25          1HH       ARG  25  -9.170  -0.474  16.028
  219    H    GLU  26           H        GLU  26  -2.795   0.928   9.439
  220    HA   GLU  26           HA       GLU  26  -1.720   2.475  11.515
  221   1HB   GLU  26          1HB       GLU  26   0.049   1.064  11.298
  222   2HB   GLU  26          2HB       GLU  26  -0.968   0.190  10.170
  223   1HG   GLU  26          1HG       GLU  26   0.936   0.528   8.857
  224   2HG   GLU  26          2HG       GLU  26  -0.027   1.916   8.390
  225    HE2  GLU  26           HE       GLU  26   1.503   3.714  11.043
  226    H    ILE  27           H        ILE  27  -2.592   3.252   8.314
  227    HA   ILE  27           HA       ILE  27  -0.499   5.271   8.069
  228    HB   ILE  27           HB       ILE  27  -1.751   3.558   6.251
  229   1HG1  ILE  27          1HG1      ILE  27   0.183   5.856   6.056
  230   2HG1  ILE  27          2HG1      ILE  27   0.492   4.136   5.935
  231   1HG2  ILE  27          1HG2      ILE  27  -2.916   4.881   4.689
  232   2HG2  ILE  27          2HG2      ILE  27  -3.615   5.289   6.273
  233   3HG2  ILE  27          3HG2      ILE  27  -2.455   6.397   5.501
  234   1HD1  ILE  27          1HD1      ILE  27  -1.195   4.352   3.839
  235   2HD1  ILE  27          2HD1      ILE  27  -0.584   6.025   3.865
  236   3HD1  ILE  27          3HD1      ILE  27   0.551   4.666   3.682
  237    H    LYS  28           H        LYS  28  -1.573   7.377   6.873
  238    HA   LYS  28           HA       LYS  28  -3.619   8.235   8.786
  239   1HB   LYS  28          1HB       LYS  28  -2.833  10.501   8.344
  240   2HB   LYS  28          2HB       LYS  28  -1.519   9.475   8.883
  241   1HG   LYS  28          1HG       LYS  28  -1.734   9.325   5.981
  242   2HG   LYS  28          2HG       LYS  28  -1.660  11.004   6.473
  243   1HD   LYS  28          1HD       LYS  28   0.621  10.419   6.266
  244   2HD   LYS  28          2HD       LYS  28   0.340  10.283   7.991
  245   1HE   LYS  28          1HE       LYS  28   0.093   7.851   7.831
  246   2HE   LYS  28          2HE       LYS  28   0.118   7.912   6.079
  247   1HZ   LYS  28          1HZ       LYS  28   2.343   8.067   7.921
  248   2HZ   LYS  28          2HZ       LYS  28   2.324   7.550   6.378
  249    H    ASP  29           H        ASP  29  -5.137   6.902   7.364
  250    HA   ASP  29           HA       ASP  29  -5.673   8.162   4.837
  251   1HB   ASP  29          1HB       ASP  29  -6.141   5.966   4.432
  252   2HB   ASP  29          2HB       ASP  29  -6.247   5.592   6.141
  253    HD2  ASP  29           HD       ASP  29  -9.631   5.627   6.251
  254    HA   PRO  30           HA       PRO  30  -9.609   8.917   7.445
  255   1HB   PRO  30          1HB       PRO  30  -9.596   8.329  10.114
  256   2HB   PRO  30          2HB       PRO  30 -10.224   7.237   8.895
  257   1HG   PRO  30          1HG       PRO  30  -7.678   7.079  10.389
  258   2HG   PRO  30          2HG       PRO  30  -8.511   5.816   9.505
  259   1HD   PRO  30          1HD       PRO  30  -6.193   7.272   8.644
  260   2HD   PRO  30          2HD       PRO  30  -7.096   6.091   7.714
  261    H    ARG  31           H        ARG  31  -6.539   9.848   8.026
  262    HA   ARG  31           HA       ARG  31  -7.326  11.991   9.776
  263   1HB   ARG  31          1HB       ARG  31  -5.200  11.048  10.350
  264   2HB   ARG  31          2HB       ARG  31  -4.674  10.986   8.680
  265   1HG   ARG  31          1HG       ARG  31  -5.334  13.735   9.464
  266   2HG   ARG  31          2HG       ARG  31  -4.145  13.046  10.551
  267   1HD   ARG  31          1HD       ARG  31  -2.678  12.458   8.657
  268   2HD   ARG  31          2HD       ARG  31  -3.895  12.971   7.505
  269    HE   ARG  31           HE       ARG  31  -2.093  14.701   9.016
  270   1HH1  ARG  31          2HH2      ARG  31  -5.234  14.577   7.378
  271   2HH1  ARG  31          1HH2      ARG  31  -5.295  16.286   7.100
  272   1HH2  ARG  31          1HH       ARG  31  -3.486  17.664   7.856
  273    H    LEU  32           H        LEU  32  -6.372  11.326   6.396
  274    HA   LEU  32           HA       LEU  32  -6.120  14.097   5.719
  275   1HB   LEU  32          1HB       LEU  32  -5.905  11.477   4.324
  276   2HB   LEU  32          2HB       LEU  32  -6.259  12.889   3.348
  277    HG   LEU  32           HG       LEU  32  -4.189  13.910   4.663
  278   1HD1  LEU  32          1HD1      LEU  32  -3.285  11.044   4.555
  279   2HD1  LEU  32          2HD1      LEU  32  -2.576  12.429   5.421
  280   3HD1  LEU  32          3HD1      LEU  32  -4.086  11.692   6.007
  281   1HD2  LEU  32          1HD2      LEU  32  -4.643  13.012   2.120
  282   2HD2  LEU  32          2HD2      LEU  32  -3.160  13.824   2.677
  283   3HD2  LEU  32          3HD2      LEU  32  -3.226  12.046   2.602
  284    H    GLY  33           H        GLY  33  -8.702  11.799   6.119
  285   1HA   GLY  33          1HA       GLY  33 -10.939  12.341   6.142
  286   2HA   GLY  33          2HA       GLY  33 -10.614  13.817   5.255
  287    H    MET  34           H        MET  34  -9.054  10.927   4.028
  288    HA   MET  34           HA       MET  34 -11.177  10.692   2.040
  289   1HB   MET  34          1HB       MET  34  -8.140  10.810   1.712
  290   2HB   MET  34          2HB       MET  34  -9.147  10.096   0.468
  291   1HG   MET  34          1HG       MET  34  -9.031  12.316  -0.278
  292   2HG   MET  34          2HG       MET  34 -10.523  12.357   0.642
  293   1HE   MET  34          1HE       MET  34  -7.217  13.297  -0.018
  294   2HE   MET  34          2HE       MET  34  -7.604  14.990   0.372
  295   3HE   MET  34          3HE       MET  34  -6.481  14.074   1.404
  296    H    MET  35           H        MET  35 -11.003   8.528   0.781
  297    HA   MET  35           HA       MET  35 -10.230   6.486   2.717
  298   1HB   MET  35          1HB       MET  35 -12.705   7.004   1.466
  299   2HB   MET  35          2HB       MET  35 -12.054   5.689   0.510
  300   1HG   MET  35          1HG       MET  35 -11.656   5.208   3.384
  301   2HG   MET  35          2HG       MET  35 -13.348   5.470   3.015
  302   1HE   MET  35          1HE       MET  35 -13.785   1.873   3.020
  303   2HE   MET  35          2HE       MET  35 -12.247   2.195   3.854
  304   3HE   MET  35          3HE       MET  35 -13.600   3.341   4.006
  305    H    THR  36           H        THR  36  -8.008   6.474   1.882
  306    HA   THR  36           HA       THR  36  -7.224   6.232  -0.714
  307    HB   THR  36           HB       THR  36  -5.226   5.086   0.287
  308    HG1  THR  36           HG1      THR  36  -6.437   3.717   1.759
  309   1HG2  THR  36          1HG2      THR  36  -6.122   7.633   0.977
  310   2HG2  THR  36          2HG2      THR  36  -5.926   6.858   2.567
  311   3HG2  THR  36          3HG2      THR  36  -4.545   6.955   1.447
  312    H    THR  37           H        THR  37  -6.236   4.191  -1.770
  313    HA   THR  37           HA       THR  37  -7.818   1.807  -1.285
  314    HB   THR  37           HB       THR  37  -8.084   3.620  -3.713
  315    HG1  THR  37           HG1      THR  37  -9.759   3.698  -2.143
  316   1HG2  THR  37          1HG2      THR  37  -9.280   1.714  -4.829
  317   2HG2  THR  37          2HG2      THR  37  -7.541   1.378  -4.650
  318   3HG2  THR  37          3HG2      THR  37  -8.713   0.625  -3.541
  319    H    VAL  38           H        VAL  38  -7.061  -0.038  -2.681
  320    HA   VAL  38           HA       VAL  38  -4.255   0.371  -3.437
  321    HB   VAL  38           HB       VAL  38  -5.443  -1.885  -1.812
  322   1HG1  VAL  38          1HG1      VAL  38  -3.875  -2.925  -3.242
  323   2HG1  VAL  38          2HG1      VAL  38  -2.726  -1.571  -3.107
  324   3HG1  VAL  38          3HG1      VAL  38  -3.002  -2.648  -1.717
  325   1HG2  VAL  38          1HG2      VAL  38  -4.860   0.379  -0.711
  326   2HG2  VAL  38          2HG2      VAL  38  -4.199  -1.104   0.017
  327   3HG2  VAL  38          3HG2      VAL  38  -3.164  -0.076  -1.001
  328    H    SER  39           H        SER  39  -5.102   0.616  -5.629
  329    HA   SER  39           HA       SER  39  -6.440  -1.705  -6.682
  330   1HB   SER  39          1HB       SER  39  -6.444   1.063  -7.286
  331   2HB   SER  39          2HB       SER  39  -5.664   0.307  -8.661
  332    HG   SER  39           HG       SER  39  -7.671  -1.294  -8.291
  333    H    GLY  40           H        GLY  40  -3.706  -2.048  -5.693
  334   1HA   GLY  40          1HA       GLY  40  -2.571  -3.470  -7.822
  335   2HA   GLY  40          2HA       GLY  40  -1.777  -1.911  -7.733
  336    H    VAL  41           H        VAL  41  -1.103  -4.907  -6.959
  337    HA   VAL  41           HA       VAL  41   0.450  -4.149  -4.661
  338    HB   VAL  41           HB       VAL  41  -1.590  -4.733  -3.551
  339   1HG1  VAL  41          1HG1      VAL  41  -2.178  -7.367  -3.919
  340   2HG1  VAL  41          2HG1      VAL  41  -2.992  -6.028  -4.762
  341   3HG1  VAL  41          3HG1      VAL  41  -1.666  -6.906  -5.560
  342   1HG2  VAL  41          1HG2      VAL  41   0.765  -6.538  -3.359
  343   2HG2  VAL  41          2HG2      VAL  41   0.007  -5.500  -2.128
  344   3HG2  VAL  41          3HG2      VAL  41  -0.717  -7.075  -2.530
  345    H    GLU  42           H        GLU  42   2.406  -5.189  -4.726
  346    HA   GLU  42           HA       GLU  42   2.519  -7.645  -6.258
  347   1HB   GLU  42          1HB       GLU  42   4.505  -5.378  -6.695
  348   2HB   GLU  42          2HB       GLU  42   4.433  -6.896  -7.566
  349   1HG   GLU  42          1HG       GLU  42   2.055  -5.000  -7.539
  350   2HG   GLU  42          2HG       GLU  42   3.373  -4.771  -8.673
  351    HE2  GLU  42           HE       GLU  42   2.062  -7.158 -10.772
  352    H    MET  43           H        MET  43   3.732  -9.188  -5.218
  353    HA   MET  43           HA       MET  43   5.675  -8.208  -3.285
  354   1HB   MET  43          1HB       MET  43   3.941 -10.669  -2.784
  355   2HB   MET  43          2HB       MET  43   4.865  -9.752  -1.610
  356   1HG   MET  43          1HG       MET  43   3.039  -8.478  -1.169
  357   2HG   MET  43          2HG       MET  43   3.032  -7.908  -2.826
  358   1HE   MET  43          1HE       MET  43   1.758 -11.874  -1.485
  359   2HE   MET  43          2HE       MET  43   2.364 -10.561  -0.448
  360   3HE   MET  43          3HE       MET  43   0.612 -10.827  -0.615
  361    H    SER  44           H        SER  44   7.624  -8.857  -4.109
  362    HA   SER  44           HA       SER  44   7.684 -11.505  -5.317
  363   1HB   SER  44          1HB       SER  44   8.729  -8.973  -6.156
  364   2HB   SER  44          2HB       SER  44  10.108  -9.987  -5.780
  365    HG   SER  44           HG       SER  44   9.246 -11.622  -7.213
  366    H    ARG  45           H        ARG  45   8.349 -13.020  -3.830
  367    HA   ARG  45           HA       ARG  45  10.293 -12.143  -1.870
  368   1HB   ARG  45          1HB       ARG  45   8.323 -14.457  -2.008
  369   2HB   ARG  45          2HB       ARG  45   9.670 -14.523  -0.887
  370   1HG   ARG  45          1HG       ARG  45   8.395 -13.322   0.559
  371   2HG   ARG  45          2HG       ARG  45   8.641 -11.941  -0.493
  372   1HD   ARG  45          1HD       ARG  45   6.198 -12.473   0.019
  373   2HD   ARG  45          2HD       ARG  45   6.579 -12.353  -1.688
  374    HE   ARG  45           HE       ARG  45   6.199 -14.667  -1.934
  375   1HH1  ARG  45          2HH2      ARG  45   6.315 -13.840   1.509
  376   2HH1  ARG  45          1HH2      ARG  45   5.734 -15.387   2.029
  377   1HH2  ARG  45          1HH       ARG  45   5.223 -17.059   0.389
  378    H    ASP  46           H        ASP  46  10.209 -13.534  -4.908
  379    HA   ASP  46           HA       ASP  46  11.746 -15.792  -4.685
  380   1HB   ASP  46          1HB       ASP  46  10.918 -13.912  -6.774
  381   2HB   ASP  46          2HB       ASP  46  12.552 -14.470  -7.071
  382    HD2  ASP  46           HD       ASP  46  11.802 -16.225  -8.900
  383    H    LEU  47           H        LEU  47  12.497 -12.453  -4.099
  384    HA   LEU  47           HA       LEU  47  15.305 -13.132  -3.798
  385   1HB   LEU  47          1HB       LEU  47  14.243 -11.436  -5.906
  386   2HB   LEU  47          2HB       LEU  47  15.370 -10.569  -4.882
  387    HG   LEU  47           HG       LEU  47  16.782 -12.850  -5.300
  388   1HD1  LEU  47          1HD1      LEU  47  15.813 -14.093  -6.879
  389   2HD1  LEU  47          2HD1      LEU  47  14.713 -12.782  -7.368
  390   3HD1  LEU  47          3HD1      LEU  47  16.366 -12.847  -8.024
  391   1HD2  LEU  47          1HD2      LEU  47  18.182 -11.242  -5.908
  392   2HD2  LEU  47          2HD2      LEU  47  17.400 -11.199  -7.506
  393   3HD2  LEU  47          3HD2      LEU  47  16.830 -10.124  -6.207
  394    H    ALA  48           H        ALA  48  13.305 -10.102  -3.764
  395    HA   ALA  48           HA       ALA  48  12.665  -9.883  -1.191
  396   1HB   ALA  48          1HB       ALA  48  14.810  -8.430  -0.450
  397   2HB   ALA  48          2HB       ALA  48  14.683 -10.177  -0.137
  398   3HB   ALA  48          3HB       ALA  48  15.622  -9.588  -1.530
  399    H    TYR  49           H        TYR  49  11.378  -8.895  -3.177
  400    HA   TYR  49           HA       TYR  49  11.620  -6.051  -2.869
  401   1HB   TYR  49          1HB       TYR  49  11.941  -5.684  -5.314
  402   2HB   TYR  49          2HB       TYR  49  13.246  -6.702  -4.734
  403    HD1  TYR  49           HD1      TYR  49  13.383  -9.062  -5.368
  404    HD2  TYR  49           HD2      TYR  49  10.186  -6.587  -6.768
  405    HE1  TYR  49           HE1      TYR  49  12.790 -10.806  -7.119
  406    HE2  TYR  49           HE2      TYR  49   9.605  -8.340  -8.515
  407    HH   TYR  49           HH       TYR  49  11.697 -10.948  -9.219
  408    H    ALA  50           H        ALA  50   9.635  -5.049  -3.123
  409    HA   ALA  50           HA       ALA  50   7.546  -6.544  -4.502
  410   1HB   ALA  50          1HB       ALA  50   6.040  -5.942  -2.479
  411   2HB   ALA  50          2HB       ALA  50   7.156  -7.316  -2.303
  412   3HB   ALA  50          3HB       ALA  50   7.563  -5.743  -1.581
  413    H    LYS  51           H        LYS  51   5.581  -5.117  -4.861
  414    HA   LYS  51           HA       LYS  51   6.167  -2.280  -4.648
  415   1HB   LYS  51          1HB       LYS  51   5.189  -2.826  -7.314
  416   2HB   LYS  51          2HB       LYS  51   6.582  -1.895  -6.802
  417   1HG   LYS  51          1HG       LYS  51   7.945  -3.945  -6.618
  418   2HG   LYS  51          2HG       LYS  51   6.551  -4.944  -6.975
  419   1HD   LYS  51          1HD       LYS  51   7.413  -4.830  -9.114
  420   2HD   LYS  51          2HD       LYS  51   6.449  -3.369  -9.167
  421   1HE   LYS  51          1HE       LYS  51   8.324  -1.953  -8.867
  422   2HE   LYS  51          2HE       LYS  51   9.289  -3.215  -8.130
  423   1HZ   LYS  51          1HZ       LYS  51   9.055  -2.570 -10.891
  424   2HZ   LYS  51          2HZ       LYS  51  10.134  -3.555 -10.171
  425    H    VAL  52           H        VAL  52   4.437  -1.618  -3.482
  426    HA   VAL  52           HA       VAL  52   1.848  -2.813  -4.165
  427    HB   VAL  52           HB       VAL  52   3.053  -1.656  -1.680
  428   1HG1  VAL  52          1HG1      VAL  52   1.006  -0.374  -1.927
  429   2HG1  VAL  52          2HG1      VAL  52   0.077  -1.859  -2.244
  430   3HG1  VAL  52          3HG1      VAL  52   0.798  -1.587  -0.640
  431   1HG2  VAL  52          1HG2      VAL  52   3.202  -4.038  -1.904
  432   2HG2  VAL  52          2HG2      VAL  52   1.946  -3.688  -0.691
  433   3HG2  VAL  52          3HG2      VAL  52   1.481  -4.163  -2.342
  434    H    TYR  53           H        TYR  53  -0.002  -1.422  -4.455
  435    HA   TYR  53           HA       TYR  53   0.796   1.290  -5.268
  436   1HB   TYR  53          1HB       TYR  53  -0.526  -0.914  -6.547
  437   2HB   TYR  53          2HB       TYR  53  -1.815   0.209  -6.167
  438    HD1  TYR  53           HD1      TYR  53  -0.762  -0.662  -8.945
  439    HD2  TYR  53           HD2      TYR  53   0.043   2.732  -6.468
  440    HE1  TYR  53           HE1      TYR  53  -0.178   0.711 -11.004
  441    HE2  TYR  53           HE2      TYR  53   0.624   4.094  -8.535
  442    HH   TYR  53           HH       TYR  53   1.507   3.020 -11.208
  443    H    VAL  54           H        VAL  54  -0.475   3.071  -4.638
  444    HA   VAL  54           HA       VAL  54  -2.782   2.514  -2.957
  445    HB   VAL  54           HB       VAL  54  -1.759   4.320  -1.373
  446   1HG1  VAL  54          1HG1      VAL  54  -1.389   2.643   0.134
  447   2HG1  VAL  54          2HG1      VAL  54  -2.195   1.688  -1.133
  448   3HG1  VAL  54          3HG1      VAL  54  -0.421   1.678  -1.005
  449   1HG2  VAL  54          1HG2      VAL  54   0.383   4.029  -3.150
  450   2HG2  VAL  54          2HG2      VAL  54   0.405   4.846  -1.569
  451   3HG2  VAL  54          3HG2      VAL  54   0.881   3.137  -1.693
  452    H    THR  55           H        THR  55  -4.413   3.741  -3.735
  453    HA   THR  55           HA       THR  55  -3.661   6.261  -5.064
  454    HB   THR  55           HB       THR  55  -4.672   4.966  -6.743
  455    HG1  THR  55           HG1      THR  55  -6.808   5.881  -6.834
  456   1HG2  THR  55          1HG2      THR  55  -6.873   3.642  -6.103
  457   2HG2  THR  55          2HG2      THR  55  -5.295   2.912  -5.719
  458   3HG2  THR  55          3HG2      THR  55  -6.232   3.730  -4.444
  459    H    PHE  56           H        PHE  56  -4.362   8.156  -4.272
  460    HA   PHE  56           HA       PHE  56  -6.391   7.977  -2.156
  461   1HB   PHE  56          1HB       PHE  56  -4.147  10.044  -2.527
  462   2HB   PHE  56          2HB       PHE  56  -5.141   9.840  -1.099
  463    HD1  PHE  56           HD1      PHE  56  -4.951   6.725  -1.168
  464    HD2  PHE  56           HD2      PHE  56  -2.064   9.829  -1.354
  465    HE1  PHE  56           HE1      PHE  56  -3.230   5.183  -0.191
  466    HE2  PHE  56           HE2      PHE  56  -0.342   8.286  -0.378
  467    HZ   PHE  56           HZ       PHE  56  -0.945   5.982   0.192
  468    H    LEU  57           H        LEU  57  -7.481  10.228  -1.791
  469    HA   LEU  57           HA       LEU  57  -8.140  11.264  -4.454
  470   1HB   LEU  57          1HB       LEU  57  -9.887  10.121  -3.004
  471   2HB   LEU  57          2HB       LEU  57  -9.778  11.505  -1.935
  472    HG   LEU  57           HG       LEU  57 -10.362  12.959  -3.942
  473   1HD1  LEU  57          1HD1      LEU  57 -11.615  10.608  -5.257
  474   2HD1  LEU  57          2HD1      LEU  57 -10.956  12.109  -5.953
  475   3HD1  LEU  57          3HD1      LEU  57  -9.857  10.799  -5.457
  476   1HD2  LEU  57          1HD2      LEU  57 -12.747  12.568  -3.711
  477   2HD2  LEU  57          2HD2      LEU  57 -12.443  10.953  -3.026
  478   3HD2  LEU  57          3HD2      LEU  57 -11.940  12.408  -2.133
  479    H    ASN  58           H        ASN  58  -5.785  11.947  -2.609
  480    HA   ASN  58           HA       ASN  58  -6.267  14.389  -1.427
  481   1HB   ASN  58          1HB       ASN  58  -3.923  12.776  -2.249
  482   2HB   ASN  58          2HB       ASN  58  -3.597  14.496  -2.330
  483   1HD2  ASN  58          1HD2      ASN  58  -5.116  15.524  -0.331
  484   2HD2  ASN  58          2HD2      ASN  58  -4.585  14.961   1.219
  485    H    ASP  59           H        ASP  59  -5.714  13.380  -4.786
  486    HA   ASP  59           HA       ASP  59  -4.665  15.421  -6.047
  487   1HB   ASP  59          1HB       ASP  59  -5.548  13.557  -7.294
  488   2HB   ASP  59          2HB       ASP  59  -7.182  13.855  -6.733
  489    HD2  ASP  59           HD       ASP  59  -8.220  16.008  -8.170
  490    H    LYS  60           H        LYS  60  -8.031  15.253  -4.728
  491    HA   LYS  60           HA       LYS  60  -9.232  17.407  -5.744
  492   1HB   LYS  60          1HB       LYS  60  -9.287  16.062  -3.097
  493   2HB   LYS  60          2HB       LYS  60 -10.012  17.655  -3.161
  494   1HG   LYS  60          1HG       LYS  60 -10.841  16.207  -5.520
  495   2HG   LYS  60          2HG       LYS  60 -11.090  15.165  -4.135
  496   1HD   LYS  60          1HD       LYS  60 -11.938  17.973  -3.670
  497   2HD   LYS  60          2HD       LYS  60 -12.822  17.180  -4.959
  498   1HE   LYS  60          1HE       LYS  60 -12.846  15.180  -3.084
  499   2HE   LYS  60          2HE       LYS  60 -12.789  16.575  -2.026
  500   1HZ   LYS  60          1HZ       LYS  60 -14.832  16.031  -4.106
  501   2HZ   LYS  60          2HZ       LYS  60 -15.072  16.128  -2.498
  502    H    ASP  61           H        ASP  61  -6.657  17.428  -3.227
  503    HA   ASP  61           HA       ASP  61  -6.446  20.287  -3.748
  504   1HB   ASP  61          1HB       ASP  61  -5.469  19.256  -1.119
  505   2HB   ASP  61          2HB       ASP  61  -6.257  20.776  -1.492
  506    HD2  ASP  61           HD       ASP  61  -8.458  17.497  -0.873
  507    H    GLU  62           H        GLU  62  -4.450  20.679  -4.714
  508    HA   GLU  62           HA       GLU  62  -2.510  18.675  -4.842
  509   1HB   GLU  62          1HB       GLU  62  -3.023  20.702  -6.439
  510   2HB   GLU  62          2HB       GLU  62  -1.940  21.601  -5.395
  511   1HG   GLU  62          1HG       GLU  62  -0.120  19.989  -5.813
  512   2HG   GLU  62          2HG       GLU  62  -1.195  18.960  -6.738
  513    HE2  GLU  62           HE       GLU  62   0.727  22.013  -8.122
  514    H    ASP  63           H        ASP  63  -3.265  21.079  -2.455
  515    HA   ASP  63           HA       ASP  63  -0.642  21.436  -1.495
  516   1HB   ASP  63          1HB       ASP  63  -3.157  22.580  -1.042
  517   2HB   ASP  63          2HB       ASP  63  -2.842  21.745   0.465
  518    HD2  ASP  63           HD       ASP  63  -1.170  23.308   1.911
  519    H    ALA  64           H        ALA  64  -3.492  19.362  -0.680
  520    HA   ALA  64           HA       ALA  64  -2.143  18.137   1.543
  521   1HB   ALA  64          1HB       ALA  64  -4.609  18.559   1.449
  522   2HB   ALA  64          2HB       ALA  64  -4.727  17.379   0.122
  523   3HB   ALA  64          3HB       ALA  64  -4.203  16.851   1.738
  524    H    VAL  65           H        VAL  65  -2.322  17.741  -1.921
  525    HA   VAL  65           HA       VAL  65  -1.768  14.939  -1.917
  526    HB   VAL  65           HB       VAL  65  -2.729  16.757  -3.715
  527   1HG1  VAL  65          1HG1      VAL  65  -0.408  17.611  -4.090
  528   2HG1  VAL  65          2HG1      VAL  65   0.039  16.002  -4.705
  529   3HG1  VAL  65          3HG1      VAL  65  -1.187  16.971  -5.556
  530   1HG2  VAL  65          1HG2      VAL  65  -2.035  13.932  -3.655
  531   2HG2  VAL  65          2HG2      VAL  65  -3.423  14.749  -4.411
  532   3HG2  VAL  65          3HG2      VAL  65  -1.884  14.609  -5.294
  533    H    LYS  66           H        LYS  66   0.118  17.998  -2.193
  534    HA   LYS  66           HA       LYS  66   2.568  16.627  -2.654
  535   1HB   LYS  66          1HB       LYS  66   1.887  19.026  -3.320
  536   2HB   LYS  66          2HB       LYS  66   2.273  19.466  -1.668
  537   1HG   LYS  66          1HG       LYS  66   4.529  18.111  -2.173
  538   2HG   LYS  66          2HG       LYS  66   4.113  18.451  -3.841
  539   1HD   LYS  66          1HD       LYS  66   3.699  20.921  -2.590
  540   2HD   LYS  66          2HD       LYS  66   5.092  20.288  -1.738
  541   1HE   LYS  66          1HE       LYS  66   5.159  19.968  -4.713
  542   2HE   LYS  66          2HE       LYS  66   5.241  21.620  -4.133
  543   1HZ   LYS  66          1HZ       LYS  66   7.286  19.694  -4.092
  544   2HZ   LYS  66          2HZ       LYS  66   7.378  21.246  -3.609
  545    H    ALA  67           H        ALA  67   1.186  18.422   0.191
  546    HA   ALA  67           HA       ALA  67   3.255  17.689   1.925
  547   1HB   ALA  67          1HB       ALA  67   0.403  18.653   2.267
  548   2HB   ALA  67          2HB       ALA  67   1.433  18.278   3.670
  549   3HB   ALA  67          3HB       ALA  67   1.921  19.547   2.521
  550    H    GLY  68           H        GLY  68  -0.078  16.320   1.449
  551   1HA   GLY  68          1HA       GLY  68  -0.015  14.303   3.299
  552   2HA   GLY  68          2HA       GLY  68  -0.861  14.234   1.767
  553    H    ILE  69           H        ILE  69   0.840  13.932  -0.224
  554    HA   ILE  69           HA       ILE  69   1.786  11.356  -0.012
  555    HB   ILE  69           HB       ILE  69   1.261  12.875  -2.044
  556   1HG1  ILE  69          1HG1      ILE  69   3.619  11.012  -2.346
  557   2HG1  ILE  69          2HG1      ILE  69   2.022  10.416  -1.936
  558   1HG2  ILE  69          1HG2      ILE  69   3.334  13.701  -3.169
  559   2HG2  ILE  69          2HG2      ILE  69   2.877  14.608  -1.707
  560   3HG2  ILE  69          3HG2      ILE  69   4.210  13.431  -1.643
  561   1HD1  ILE  69          1HD1      ILE  69   2.757  10.604  -4.476
  562   2HD1  ILE  69          2HD1      ILE  69   1.098  11.037  -4.000
  563   3HD1  ILE  69          3HD1      ILE  69   2.308  12.315  -4.271
  564    H    LYS  70           H        LYS  70   3.286  14.447   0.870
  565    HA   LYS  70           HA       LYS  70   5.930  13.458   0.986
  566   1HB   LYS  70          1HB       LYS  70   4.522  15.941   1.469
  567   2HB   LYS  70          2HB       LYS  70   5.662  15.634   2.763
  568   1HG   LYS  70          1HG       LYS  70   6.728  16.879   0.891
  569   2HG   LYS  70          2HG       LYS  70   7.494  15.323   1.141
  570   1HD   LYS  70          1HD       LYS  70   6.945  14.616  -0.948
  571   2HD   LYS  70          2HD       LYS  70   5.262  15.050  -0.725
  572   1HE   LYS  70          1HE       LYS  70   5.892  16.483  -2.479
  573   2HE   LYS  70          2HE       LYS  70   6.086  17.527  -1.085
  574   1HZ   LYS  70          1HZ       LYS  70   8.031  17.435  -2.686
  575   2HZ   LYS  70          2HZ       LYS  70   8.426  17.193  -1.124
  576    H    ALA  71           H        ALA  71   3.140  13.491   3.208
  577    HA   ALA  71           HA       ALA  71   4.720  12.671   5.454
  578   1HB   ALA  71          1HB       ALA  71   1.758  12.290   5.391
  579   2HB   ALA  71          2HB       ALA  71   2.792  13.019   6.645
  580   3HB   ALA  71          3HB       ALA  71   2.357  13.954   5.194
  581    H    LEU  72           H        LEU  72   2.468  11.143   3.075
  582    HA   LEU  72           HA       LEU  72   2.674   8.580   4.268
  583   1HB   LEU  72          1HB       LEU  72   1.012   9.795   2.472
  584   2HB   LEU  72          2HB       LEU  72   1.951   8.752   1.422
  585    HG   LEU  72           HG       LEU  72   0.745   7.595   3.915
  586   1HD1  LEU  72          1HD1      LEU  72  -0.759   8.702   1.628
  587   2HD1  LEU  72          2HD1      LEU  72  -1.179   7.033   2.082
  588   3HD1  LEU  72          3HD1      LEU  72  -1.281   8.335   3.289
  589   1HD2  LEU  72          1HD2      LEU  72   1.949   5.934   2.942
  590   2HD2  LEU  72          2HD2      LEU  72   0.432   5.725   2.035
  591   3HD2  LEU  72          3HD2      LEU  72   1.789   6.616   1.305
  592    H    GLN  73           H        GLN  73   4.741  10.506   2.242
  593    HA   GLN  73           HA       GLN  73   6.026   8.263   1.050
  594   1HB   GLN  73          1HB       GLN  73   6.405  11.251   1.030
  595   2HB   GLN  73          2HB       GLN  73   7.756  10.249   0.537
  596   1HG   GLN  73          1HG       GLN  73   6.576   9.324  -1.303
  597   2HG   GLN  73          2HG       GLN  73   5.008   9.712  -0.624
  598   1HE2  GLN  73          1HE2      GLN  73   5.863  10.317  -3.235
  599   2HE2  GLN  73          2HE2      GLN  73   5.899  12.037  -3.443
  600    H    GLU  74           H        GLU  74   6.860  10.730   3.582
  601    HA   GLU  74           HA       GLU  74   9.325   9.582   4.172
  602   1HB   GLU  74          1HB       GLU  74   9.344  11.073   6.090
  603   2HB   GLU  74          2HB       GLU  74   8.628  11.925   4.737
  604   1HG   GLU  74          1HG       GLU  74   6.776  12.313   5.983
  605   2HG   GLU  74          2HG       GLU  74   6.468  10.588   6.033
  606    HE2  GLU  74           HE       GLU  74   7.512  12.705   9.055
  607    H    ALA  75           H        ALA  75   6.007   8.842   5.143
  608    HA   ALA  75           HA       ALA  75   6.856   7.228   7.382
  609   1HB   ALA  75          1HB       ALA  75   4.266   8.104   6.134
  610   2HB   ALA  75          2HB       ALA  75   4.268   6.655   7.167
  611   3HB   ALA  75          3HB       ALA  75   4.810   8.218   7.826
  612    H    SER  76           H        SER  76   7.282   6.868   4.169
  613    HA   SER  76           HA       SER  76   6.077   4.550   3.438
  614   1HB   SER  76          1HB       SER  76   8.794   5.726   2.762
  615   2HB   SER  76          2HB       SER  76   8.251   4.231   2.026
  616    HG   SER  76           HG       SER  76   6.222   5.549   1.471
  617    H    GLY  77           H        GLY  77   9.574   4.686   4.435
  618   1HA   GLY  77          1HA       GLY  77  10.005   2.044   4.887
  619   2HA   GLY  77          2HA       GLY  77  10.787   3.336   5.776
  620    H    PHE  78           H        PHE  78   7.922   4.203   6.725
  621    HA   PHE  78           HA       PHE  78   8.043   2.726   9.151
  622   1HB   PHE  78          1HB       PHE  78   6.971   5.163   8.076
  623   2HB   PHE  78          2HB       PHE  78   5.571   4.249   8.600
  624    HD1  PHE  78           HD1      PHE  78   5.271   3.682  10.970
  625    HD2  PHE  78           HD2      PHE  78   8.544   6.052   9.675
  626    HE1  PHE  78           HE1      PHE  78   5.669   4.423  13.335
  627    HE2  PHE  78           HE2      PHE  78   8.943   6.793  12.039
  628    HZ   PHE  78           HZ       PHE  78   7.502   5.970  13.841
  629    H    ILE  79           H        ILE  79   5.805   2.863   6.313
  630    HA   ILE  79           HA       ILE  79   3.982   1.009   7.447
  631    HB   ILE  79           HB       ILE  79   2.814   1.181   5.440
  632   1HG1  ILE  79          1HG1      ILE  79   5.499   1.583   4.221
  633   2HG1  ILE  79          2HG1      ILE  79   4.142   0.620   3.671
  634   1HG2  ILE  79          1HG2      ILE  79   2.529   3.494   5.145
  635   2HG2  ILE  79          2HG2      ILE  79   3.124   3.310   6.812
  636   3HG2  ILE  79          3HG2      ILE  79   4.232   3.844   5.525
  637   1HD1  ILE  79          1HD1      ILE  79   2.920   2.700   3.025
  638   2HD1  ILE  79          2HD1      ILE  79   4.311   3.669   3.569
  639   3HD1  ILE  79          3HD1      ILE  79   4.482   2.562   2.184
  640    H    ARG  80           H        ARG  80   6.866   0.815   5.331
  641    HA   ARG  80           HA       ARG  80   6.449  -1.851   4.629
  642   1HB   ARG  80          1HB       ARG  80   7.966  -0.731   3.218
  643   2HB   ARG  80          2HB       ARG  80   8.768   0.084   4.546
  644   1HG   ARG  80          1HG       ARG  80  10.022  -1.855   5.150
  645   2HG   ARG  80          2HG       ARG  80   8.949  -2.936   4.281
  646   1HD   ARG  80          1HD       ARG  80  10.531  -2.844   2.627
  647   2HD   ARG  80          2HD       ARG  80   9.795  -1.307   2.221
  648    HE   ARG  80           HE       ARG  80  11.862  -1.155   4.315
  649   1HH1  ARG  80          2HH2      ARG  80  11.179  -0.934   0.846
  650   2HH1  ARG  80          1HH2      ARG  80  12.605  -0.015   0.497
  651   1HH2  ARG  80          1HH       ARG  80  14.098   0.559   2.282
  652    H    SER  81           H        SER  81   8.399  -0.207   7.200
  653    HA   SER  81           HA       SER  81   9.441  -2.635   8.178
  654   1HB   SER  81          1HB       SER  81   9.254   0.098   9.522
  655   2HB   SER  81          2HB       SER  81  10.262  -1.229  10.063
  656    HG   SER  81           HG       SER  81  11.219  -1.113   7.790
  657    H    LEU  82           H        LEU  82   6.607  -0.566   8.872
  658    HA   LEU  82           HA       LEU  82   5.934  -1.754  11.330
  659   1HB   LEU  82          1HB       LEU  82   5.130   0.420  10.706
  660   2HB   LEU  82          2HB       LEU  82   4.328  -0.221   9.286
  661    HG   LEU  82           HG       LEU  82   3.474  -1.411  11.863
  662   1HD1  LEU  82          1HD1      LEU  82   3.437   0.619  12.881
  663   2HD1  LEU  82          2HD1      LEU  82   3.337   1.518  11.349
  664   3HD1  LEU  82          3HD1      LEU  82   1.887   0.727  12.012
  665   1HD2  LEU  82          1HD2      LEU  82   1.235  -0.591  10.546
  666   2HD2  LEU  82          2HD2      LEU  82   2.374  -0.810   9.194
  667   3HD2  LEU  82          3HD2      LEU  82   2.041  -2.160  10.306
  668    H    LEU  83           H        LEU  83   5.350  -2.600   7.915
  669    HA   LEU  83           HA       LEU  83   3.353  -4.528   8.483
  670   1HB   LEU  83          1HB       LEU  83   4.930  -3.618   6.149
  671   2HB   LEU  83          2HB       LEU  83   4.349  -5.271   6.083
  672    HG   LEU  83           HG       LEU  83   2.047  -4.533   6.345
  673   1HD1  LEU  83          1HD1      LEU  83   1.380  -2.516   7.058
  674   2HD1  LEU  83          2HD1      LEU  83   3.057  -2.342   7.629
  675   3HD1  LEU  83          3HD1      LEU  83   2.575  -1.653   6.060
  676   1HD2  LEU  83          1HD2      LEU  83   2.997  -4.635   4.087
  677   2HD2  LEU  83          2HD2      LEU  83   1.759  -3.364   4.223
  678   3HD2  LEU  83          3HD2      LEU  83   3.484  -2.928   4.211
  679    H    GLY  84           H        GLY  84   6.827  -4.884   7.456
  680   1HA   GLY  84          1HA       GLY  84   7.150  -7.553   7.712
  681   2HA   GLY  84          2HA       GLY  84   8.383  -6.379   8.131
  682    H    LYS  85           H        LYS  85   7.319  -5.120  10.407
  683    HA   LYS  85           HA       LYS  85   7.812  -7.134  12.354
  684   1HB   LYS  85          1HB       LYS  85   7.433  -4.185  12.297
  685   2HB   LYS  85          2HB       LYS  85   7.042  -4.989  13.805
  686   1HG   LYS  85          1HG       LYS  85   9.262  -5.965  13.966
  687   2HG   LYS  85          2HG       LYS  85   9.660  -5.495  12.325
  688   1HD   LYS  85          1HD       LYS  85  10.739  -3.860  13.679
  689   2HD   LYS  85          2HD       LYS  85   9.303  -3.048  13.087
  690   1HE   LYS  85          1HE       LYS  85   8.387  -2.875  15.178
  691   2HE   LYS  85          2HE       LYS  85   8.810  -4.521  15.603
  692   1HZ   LYS  85          1HZ       LYS  85  11.190  -3.046  15.448
  693   2HZ   LYS  85          2HZ       LYS  85  10.154  -2.171  16.348
  694    H    ALA  86           H        ALA  86   4.938  -5.334  11.151
  695    HA   ALA  86           HA       ALA  86   3.154  -6.233  13.094
  696   1HB   ALA  86          1HB       ALA  86   2.849  -5.332  10.210
  697   2HB   ALA  86          2HB       ALA  86   1.456  -5.717  11.249
  698   3HB   ALA  86          3HB       ALA  86   2.559  -4.393  11.694
  699    H    MET  87           H        MET  87   4.477  -7.737  10.140
  700    HA   MET  87           HA       MET  87   2.778 -10.041  10.697
  701   1HB   MET  87          1HB       MET  87   2.994 -10.599   8.340
  702   2HB   MET  87          2HB       MET  87   2.676  -8.875   8.395
  703   1HG   MET  87          1HG       MET  87   5.085  -8.377   8.134
  704   2HG   MET  87          2HG       MET  87   5.479 -10.083   8.217
  705   1HE   MET  87          1HE       MET  87   3.292  -7.467   6.487
  706   2HE   MET  87          2HE       MET  87   2.955  -8.157   4.880
  707   3HE   MET  87          3HE       MET  87   2.170  -8.840   6.324
  708    H    ARG  88           H        ARG  88   5.599  -9.017  11.741
  709    HA   ARG  88           HA       ARG  88   7.700  -9.811  11.806
  710   1HB   ARG  88          1HB       ARG  88   5.718 -11.425  13.293
  711   2HB   ARG  88          2HB       ARG  88   7.214 -12.300  13.033
  712   1HG   ARG  88          1HG       ARG  88   8.383 -10.079  13.846
  713   2HG   ARG  88          2HG       ARG  88   6.803  -9.661  14.481
  714   1HD   ARG  88          1HD       ARG  88   8.119 -12.338  15.112
  715   2HD   ARG  88          2HD       ARG  88   8.438 -10.908  16.074
  716    HE   ARG  88           HE       ARG  88   5.610 -11.164  15.820
  717   1HH1  ARG  88          2HH2      ARG  88   8.318 -12.861  17.351
  718   2HH1  ARG  88          1HH2      ARG  88   7.346 -13.518  18.625
  719   1HH2  ARG  88          1HH       ARG  88   5.005 -13.016  18.695
  720    H    LEU  89           H        LEU  89   8.406 -10.218   9.619
  721    HA   LEU  89           HA       LEU  89   8.295 -13.059   8.891
  722   1HB   LEU  89          1HB       LEU  89   6.929 -11.141   7.562
  723   2HB   LEU  89          2HB       LEU  89   8.460 -11.064   6.715
  724    HG   LEU  89           HG       LEU  89   8.306 -13.315   5.984
  725   1HD1  LEU  89          1HD1      LEU  89   5.989 -14.493   6.801
  726   2HD1  LEU  89          2HD1      LEU  89   7.589 -14.775   7.530
  727   3HD1  LEU  89          3HD1      LEU  89   6.467 -13.606   8.268
  728   1HD2  LEU  89          1HD2      LEU  89   5.869 -11.630   5.675
  729   2HD2  LEU  89          2HD2      LEU  89   7.029 -12.215   4.459
  730   3HD2  LEU  89          3HD2      LEU  89   5.787 -13.314   5.105
  731    H    ARG  90           H        ARG  90  10.007 -12.446   6.507
  732    HA   ARG  90           HA       ARG  90  12.392 -11.471   7.792
  733   1HB   ARG  90          1HB       ARG  90  13.648 -13.525   6.795
  734   2HB   ARG  90          2HB       ARG  90  12.718 -13.785   8.259
  735   1HG   ARG  90          1HG       ARG  90  11.678 -15.471   7.138
  736   2HG   ARG  90          2HG       ARG  90  10.812 -14.218   6.268
  737   1HD   ARG  90          1HD       ARG  90  12.801 -14.169   4.617
  738   2HD   ARG  90          2HD       ARG  90  13.381 -15.622   5.404
  739    HE   ARG  90           HE       ARG  90  11.175 -15.451   3.539
  740   1HH1  ARG  90          2HH2      ARG  90  12.276 -17.224   6.403
  741   2HH1  ARG  90          1HH2      ARG  90  11.352 -18.641   6.034
  742   1HH2  ARG  90          1HH       ARG  90   9.994 -18.677   4.060
  743    H    ILE  91           H        ILE  91  10.788 -12.844   4.856
  744    HA   ILE  91           HA       ILE  91  12.493 -12.305   2.884
  745    HB   ILE  91           HB       ILE  91  10.375 -11.572   1.581
  746   1HG1  ILE  91          1HG1      ILE  91   8.703 -12.831   3.634
  747   2HG1  ILE  91          2HG1      ILE  91   9.349 -11.282   4.139
  748   1HG2  ILE  91          1HG2      ILE  91   9.779 -14.234   2.607
  749   2HG2  ILE  91          2HG2      ILE  91  10.298 -13.717   0.985
  750   3HG2  ILE  91          3HG2      ILE  91  11.510 -14.013   2.254
  751   1HD1  ILE  91          1HD1      ILE  91   7.118 -11.644   2.518
  752   2HD1  ILE  91          2HD1      ILE  91   8.039 -10.129   2.676
  753   3HD1  ILE  91          3HD1      ILE  91   8.396 -11.254   1.343
  754    H    VAL  92           H        VAL  92  10.679  -9.892   4.809
  755    HA   VAL  92           HA       VAL  92  10.541  -7.633   4.417
  756    HB   VAL  92           HB       VAL  92  13.454  -8.148   5.041
  757   1HG1  VAL  92          1HG1      VAL  92  11.748  -5.719   5.048
  758   2HG1  VAL  92          2HG1      VAL  92  12.790  -5.948   6.473
  759   3HG1  VAL  92          3HG1      VAL  92  13.508  -5.890   4.846
  760   1HG2  VAL  92          1HG2      VAL  92  12.067  -7.583   7.409
  761   2HG2  VAL  92          2HG2      VAL  92  11.028  -8.733   6.532
  762   3HG2  VAL  92          3HG2      VAL  92  12.720  -9.157   6.895
  763    HA   PRO  93           HA       PRO  93  12.343  -7.589   0.216
  764   1HB   PRO  93          1HB       PRO  93  10.037  -7.591  -1.249
  765   2HB   PRO  93          2HB       PRO  93  10.962  -9.042  -0.914
  766   1HG   PRO  93          1HG       PRO  93   8.413  -8.149   0.288
  767   2HG   PRO  93          2HG       PRO  93   9.123  -9.750   0.284
  768   1HD   PRO  93          1HD       PRO  93   9.084  -7.895   2.472
  769   2HD   PRO  93          2HD       PRO  93   9.893  -9.449   2.429
  770    H    GLU  94           H        GLU  94  12.529  -5.855  -1.304
  771    HA   GLU  94           HA       GLU  94  12.032  -3.433  -0.007
  772   1HB   GLU  94          1HB       GLU  94  13.738  -4.220  -1.958
  773   2HB   GLU  94          2HB       GLU  94  12.517  -3.472  -2.968
  774   1HG   GLU  94          1HG       GLU  94  12.698  -1.359  -1.706
  775   2HG   GLU  94          2HG       GLU  94  13.804  -2.096  -0.564
  776    HE2  GLU  94           HE       GLU  94  16.242  -2.767  -2.450
  777    H    LEU  95           H        LEU  95   9.609  -4.019   0.337
  778    HA   LEU  95           HA       LEU  95   7.889  -3.840  -1.903
  779   1HB   LEU  95          1HB       LEU  95   7.555  -4.908   0.437
  780   2HB   LEU  95          2HB       LEU  95   7.086  -3.294   0.937
  781    HG   LEU  95           HG       LEU  95   5.679  -4.023  -1.483
  782   1HD1  LEU  95          1HD1      LEU  95   4.665  -6.005  -1.026
  783   2HD1  LEU  95          2HD1      LEU  95   6.222  -6.310  -0.222
  784   3HD1  LEU  95          3HD1      LEU  95   4.809  -5.809   0.736
  785   1HD2  LEU  95          1HD2      LEU  95   5.262  -2.500   0.795
  786   2HD2  LEU  95          2HD2      LEU  95   4.086  -2.816  -0.502
  787   3HD2  LEU  95          3HD2      LEU  95   4.096  -3.835   0.957
  788    H    THR  96           H        THR  96   8.444  -1.981  -3.108
  789    HA   THR  96           HA       THR  96   8.668   0.571  -1.888
  790    HB   THR  96           HB       THR  96   9.584  -0.388  -4.168
  791    HG1  THR  96           HG1      THR  96   9.956   1.799  -3.766
  792   1HG2  THR  96          1HG2      THR  96   6.770   0.572  -4.889
  793   2HG2  THR  96          2HG2      THR  96   8.099   0.490  -6.069
  794   3HG2  THR  96          3HG2      THR  96   7.505  -0.997  -5.293
  795    H    PHE  97           H        PHE  97   7.235   2.461  -2.551
  796    HA   PHE  97           HA       PHE  97   4.438   1.575  -2.426
  797   1HB   PHE  97          1HB       PHE  97   5.900   2.827  -0.441
  798   2HB   PHE  97          2HB       PHE  97   5.361   4.238  -1.330
  799    HD1  PHE  97           HD1      PHE  97   4.052   1.137   0.262
  800    HD2  PHE  97           HD2      PHE  97   3.265   5.143  -0.896
  801    HE1  PHE  97           HE1      PHE  97   1.845   1.049   1.456
  802    HE2  PHE  97           HE2      PHE  97   1.059   5.055   0.299
  803    HZ   PHE  97           HZ       PHE  97   0.376   3.008   1.460
  804    H    PHE  98           H        PHE  98   3.433   2.074  -4.315
  805    HA   PHE  98           HA       PHE  98   4.418   4.388  -5.791
  806   1HB   PHE  98          1HB       PHE  98   3.321   1.723  -6.329
  807   2HB   PHE  98          2HB       PHE  98   2.288   2.912  -7.095
  808    HD1  PHE  98           HD1      PHE  98   3.003   4.102  -9.032
  809    HD2  PHE  98           HD2      PHE  98   5.730   1.598  -6.958
  810    HE1  PHE  98           HE1      PHE  98   4.614   4.269 -10.949
  811    HE2  PHE  98           HE2      PHE  98   7.341   1.765  -8.875
  812    HZ   PHE  98           HZ       PHE  98   6.764   3.097 -10.848
  813    H    TYR  99           H        TYR  99   3.407   6.297  -5.382
  814    HA   TYR  99           HA       TYR  99   0.704   6.263  -4.350
  815   1HB   TYR  99          1HB       TYR  99   2.279   8.722  -5.202
  816   2HB   TYR  99          2HB       TYR  99   1.288   8.517  -3.771
  817    HD1  TYR  99           HD1      TYR  99   4.625   8.123  -5.205
  818    HD2  TYR  99           HD2      TYR  99   2.190   7.351  -1.773
  819    HE1  TYR  99           HE1      TYR  99   6.708   7.682  -3.817
  820    HE2  TYR  99           HE2      TYR  99   4.282   6.913  -0.396
  821    HH   TYR  99           HH       TYR  99   6.438   6.891  -0.362
  822    H    ASP 100           H        ASP 100  -0.877   5.899  -5.862
  823    HA   ASP 100           HA       ASP 100  -0.593   7.379  -8.353
  824   1HB   ASP 100          1HB       ASP 100  -1.176   4.671  -7.874
  825   2HB   ASP 100          2HB       ASP 100  -2.750   5.364  -8.214
  826    HD2  ASP 100           HD       ASP 100   0.366   6.090  -9.783
  827    H    ASN 101           H        ASN 101  -1.511   9.371  -7.441
  828    HA   ASN 101           HA       ASN 101  -4.145   9.135  -6.295
  829   1HB   ASN 101          1HB       ASN 101  -3.835  11.684  -6.006
  830   2HB   ASN 101          2HB       ASN 101  -2.715  10.676  -5.112
  831   1HD2  ASN 101          1HD2      ASN 101  -0.682  11.216  -5.218
  832   2HD2  ASN 101          2HD2      ASN 101   0.119  12.070  -6.495
  833    H    SER 102           H        SER 102  -5.382  11.509  -7.101
  834    HA   SER 102           HA       SER 102  -5.833  10.940  -9.887
  835   1HB   SER 102          1HB       SER 102  -7.504  13.077  -8.957
  836   2HB   SER 102          2HB       SER 102  -7.967  11.432  -9.349
  837    HG   SER 102           HG       SER 102  -8.499  11.979  -7.145
  838    H    LEU 103           H        LEU 103  -3.425  12.487  -8.601
  839    HA   LEU 103           HA       LEU 103  -3.795  15.025 -10.015
  840   1HB   LEU 103          1HB       LEU 103  -3.130  14.882  -7.549
  841   2HB   LEU 103          2HB       LEU 103  -1.571  14.314  -8.115
  842    HG   LEU 103           HG       LEU 103  -2.003  16.617  -9.619
  843   1HD1  LEU 103          1HD1      LEU 103  -3.930  17.181  -8.193
  844   2HD1  LEU 103          2HD1      LEU 103  -2.868  17.156  -6.766
  845   3HD1  LEU 103          3HD1      LEU 103  -2.606  18.363  -8.046
  846   1HD2  LEU 103          1HD2      LEU 103  -0.385  16.061  -7.131
  847   2HD2  LEU 103          2HD2      LEU 103   0.147  16.070  -8.829
  848   3HD2  LEU 103          3HD2      LEU 103  -0.282  17.598  -8.023
  849    H    VAL 104           H        VAL 104  -2.951  11.988 -10.790
  850    HA   VAL 104           HA       VAL 104  -0.896  12.942 -12.648
  851    HB   VAL 104           HB       VAL 104  -0.775  10.700 -10.695
  852   1HG1  VAL 104          1HG1      VAL 104  -0.731   9.390 -12.686
  853   2HG1  VAL 104          2HG1      VAL 104   0.336  10.553 -13.511
  854   3HG1  VAL 104          3HG1      VAL 104   0.960   9.574 -12.160
  855   1HG2  VAL 104          1HG2      VAL 104   1.677  11.321 -10.816
  856   2HG2  VAL 104          2HG2      VAL 104   1.204  12.657 -11.893
  857   3HG2  VAL 104          3HG2      VAL 104   0.587  12.598 -10.224
  858    H    GLU 105           H        GLU 105  -3.989  11.982 -12.291
  859    HA   GLU 105           HA       GLU 105  -4.054  10.989 -14.962
  860   1HB   GLU 105          1HB       GLU 105  -5.153   9.243 -12.715
  861   2HB   GLU 105          2HB       GLU 105  -5.289   8.912 -14.431
  862   1HG   GLU 105          1HG       GLU 105  -2.743   8.908 -14.561
  863   2HG   GLU 105          2HG       GLU 105  -2.701   9.056 -12.815
  864    HE2  GLU 105           HE       GLU 105  -2.360   5.644 -13.306
  865    H    GLY 106           H        GLY 106  -5.687  11.843 -11.887
  866   1HA   GLY 106          1HA       GLY 106  -7.425  13.310 -11.637
  867   2HA   GLY 106          2HA       GLY 106  -7.690  13.325 -13.369
  868    H    MET 107           H        MET 107  -7.373  10.090 -12.685
  869    HA   MET 107           HA       MET 107 -10.209   9.846 -12.044
  870   1HB   MET 107          1HB       MET 107  -8.550   8.124 -13.968
  871   2HB   MET 107          2HB       MET 107 -10.250   7.887 -13.620
  872   1HG   MET 107          1HG       MET 107 -10.901   9.586 -15.018
  873   2HG   MET 107          2HG       MET 107  -9.633  10.659 -14.461
  874   1HE   MET 107          1HE       MET 107  -6.610   9.974 -16.227
  875   2HE   MET 107          2HE       MET 107  -7.267   9.731 -14.591
  876   3HE   MET 107          3HE       MET 107  -6.830   8.326 -15.593
  877    H    ARG 108           H        ARG 108  -7.717   9.738 -10.335
  878    HA   ARG 108           HA       ARG 108  -7.938   6.945  -9.546
  879   1HB   ARG 108          1HB       ARG 108  -5.643   8.743  -9.861
  880   2HB   ARG 108          2HB       ARG 108  -5.698   8.108  -8.228
  881   1HG   ARG 108          1HG       ARG 108  -4.748   6.211  -9.037
  882   2HG   ARG 108          2HG       ARG 108  -6.281   5.861  -9.811
  883   1HD   ARG 108          1HD       ARG 108  -5.472   7.326 -11.782
  884   2HD   ARG 108          2HD       ARG 108  -3.890   7.319 -11.026
  885    HE   ARG 108           HE       ARG 108  -3.589   5.143 -11.804
  886   1HH1  ARG 108          2HH2      ARG 108  -7.070   5.781 -11.636
  887   2HH1  ARG 108          1HH2      ARG 108  -7.510   4.258 -12.334
  888   1HH2  ARG 108          1HH       ARG 108  -5.787   2.718 -12.968
  Start of MODEL    6
    1    H    MET   1           H        MET   1  -8.459  -7.276  -2.232
    2    HA   MET   1           HA       MET   1 -11.069  -7.931  -2.501
    3   1HB   MET   1          1HB       MET   1 -11.204  -9.053  -4.706
    4   2HB   MET   1          2HB       MET   1 -10.758  -7.376  -4.946
    5   1HG   MET   1          1HG       MET   1  -8.310  -8.830  -4.570
    6   2HG   MET   1          2HG       MET   1  -9.283  -9.765  -5.689
    7   1HE   MET   1          1HE       MET   1  -7.249  -9.422  -6.920
    8   2HE   MET   1          2HE       MET   1  -7.350  -8.362  -8.345
    9   3HE   MET   1          3HE       MET   1  -6.412  -7.852  -6.921
   10    H    ALA   2           H        ALA   2 -11.332 -10.481  -2.856
   11    HA   ALA   2           HA       ALA   2  -8.934 -11.736  -1.704
   12   1HB   ALA   2          1HB       ALA   2 -10.494 -11.668   0.059
   13   2HB   ALA   2          2HB       ALA   2 -11.873 -11.979  -1.024
   14   3HB   ALA   2          3HB       ALA   2 -10.730 -13.289  -0.640
   15    H    LYS   3           H        LYS   3  -8.421 -13.857  -2.440
   16    HA   LYS   3           HA       LYS   3 -10.108 -14.943  -4.541
   17   1HB   LYS   3          1HB       LYS   3  -8.288 -13.310  -5.464
   18   2HB   LYS   3          2HB       LYS   3  -7.171 -14.612  -5.106
   19   1HG   LYS   3          1HG       LYS   3  -7.866 -14.949  -7.384
   20   2HG   LYS   3          2HG       LYS   3  -8.696 -16.174  -6.443
   21   1HD   LYS   3          1HD       LYS   3 -10.411 -13.907  -6.385
   22   2HD   LYS   3          2HD       LYS   3  -9.824 -13.993  -8.034
   23   1HE   LYS   3          1HE       LYS   3 -10.402 -16.557  -7.869
   24   2HE   LYS   3          2HE       LYS   3 -11.357 -16.100  -6.474
   25   1HZ   LYS   3          1HZ       LYS   3 -11.725 -14.561  -8.949
   26   2HZ   LYS   3          2HZ       LYS   3 -12.396 -16.043  -8.867
   27    H    GLU   4           H        GLU   4 -10.608 -16.593  -3.018
   28    HA   GLU   4           HA       GLU   4  -8.517 -17.976  -1.724
   29   1HB   GLU   4          1HB       GLU   4 -10.334 -19.530  -1.012
   30   2HB   GLU   4          2HB       GLU   4 -10.740 -17.852  -0.717
   31   1HG   GLU   4          1HG       GLU   4 -11.728 -18.174  -3.274
   32   2HG   GLU   4          2HG       GLU   4 -11.958 -19.788  -2.630
   33    HE2  GLU   4           HE       GLU   4 -14.560 -17.370  -2.309
   34    H    PHE   5           H        PHE   5  -7.059 -18.668  -3.392
   35    HA   PHE   5           HA       PHE   5  -8.020 -21.045  -4.768
   36   1HB   PHE   5          1HB       PHE   5  -8.181 -18.980  -6.280
   37   2HB   PHE   5          2HB       PHE   5  -6.469 -18.702  -6.025
   38    HD1  PHE   5           HD1      PHE   5  -6.437 -18.750  -8.569
   39    HD2  PHE   5           HD2      PHE   5  -7.315 -22.172  -6.219
   40    HE1  PHE   5           HE1      PHE   5  -5.905 -20.229 -10.525
   41    HE2  PHE   5           HE2      PHE   5  -6.784 -23.652  -8.176
   42    HZ   PHE   5           HZ       PHE   5  -6.085 -22.662 -10.306
   43    H    GLY   6           H        GLY   6  -6.585 -22.695  -4.509
   44   1HA   GLY   6          1HA       GLY   6  -4.440 -22.750  -2.928
   45   2HA   GLY   6          2HA       GLY   6  -4.574 -23.746  -4.363
   46    H    ARG   7           H        ARG   7  -4.576 -21.285  -6.172
   47    HA   ARG   7           HA       ARG   7  -1.911 -21.299  -6.760
   48   1HB   ARG   7          1HB       ARG   7  -4.311 -19.982  -7.704
   49   2HB   ARG   7          2HB       ARG   7  -3.037 -18.782  -7.622
   50   1HG   ARG   7          1HG       ARG   7  -1.629 -20.811  -8.769
   51   2HG   ARG   7          2HG       ARG   7  -3.231 -21.238  -9.341
   52   1HD   ARG   7          1HD       ARG   7  -3.090 -18.445  -9.741
   53   2HD   ARG   7          2HD       ARG   7  -1.490 -19.015 -10.173
   54    HE   ARG   7           HE       ARG   7  -3.401 -20.777 -11.357
   55   1HH1  ARG   7          2HH2      ARG   7  -2.277 -17.432 -11.672
   56   2HH1  ARG   7          1HH2      ARG   7  -2.686 -17.321 -13.351
   57   1HH2  ARG   7          1HH       ARG   7  -3.665 -19.215 -14.448
   58    HA   PRO   8           HA       PRO   8  -0.158 -18.057  -4.397
   59   1HB   PRO   8          1HB       PRO   8   1.139 -16.380  -6.121
   60   2HB   PRO   8          2HB       PRO   8   1.783 -17.934  -5.629
   61   1HG   PRO   8          1HG       PRO   8   0.547 -17.170  -8.204
   62   2HG   PRO   8          2HG       PRO   8   1.559 -18.552  -7.840
   63   1HD   PRO   8          1HD       PRO   8  -1.289 -18.554  -8.177
   64   2HD   PRO   8          2HD       PRO   8  -0.289 -19.912  -7.701
   65    H    GLN   9           H        GLN   9  -2.819 -17.453  -6.060
   66    HA   GLN   9           HA       GLN   9  -2.852 -14.630  -5.772
   67   1HB   GLN   9          1HB       GLN   9  -4.268 -16.456  -7.290
   68   2HB   GLN   9          2HB       GLN   9  -5.449 -16.043  -6.064
   69   1HG   GLN   9          1HG       GLN   9  -5.852 -14.374  -7.659
   70   2HG   GLN   9          2HG       GLN   9  -4.751 -13.547  -6.574
   71   1HE2  GLN   9          1HE2      GLN   9  -4.298 -12.182  -8.381
   72   2HE2  GLN   9          2HE2      GLN   9  -3.142 -12.647  -9.585
   73    H    ARG  10           H        ARG  10  -4.075 -17.481  -3.962
   74    HA   ARG  10           HA       ARG  10  -5.736 -16.149  -2.246
   75   1HB   ARG  10          1HB       ARG  10  -5.358 -18.696  -2.546
   76   2HB   ARG  10          2HB       ARG  10  -3.987 -18.528  -1.466
   77   1HG   ARG  10          1HG       ARG  10  -6.626 -17.374  -0.571
   78   2HG   ARG  10          2HG       ARG  10  -6.449 -19.117  -0.548
   79   1HD   ARG  10          1HD       ARG  10  -4.244 -17.436   0.659
   80   2HD   ARG  10          2HD       ARG  10  -5.733 -17.628   1.563
   81    HE   ARG  10           HE       ARG  10  -5.184 -20.220   0.876
   82   1HH1  ARG  10          2HH2      ARG  10  -3.152 -17.692   2.306
   83   2HH1  ARG  10          1HH2      ARG  10  -2.151 -18.812   3.167
   84   1HH2  ARG  10          1HH       ARG  10  -2.587 -21.162   2.980
   85    H    VAL  11           H        VAL  11  -2.226 -17.024  -1.871
   86    HA   VAL  11           HA       VAL  11  -1.938 -15.803   0.639
   87    HB   VAL  11           HB       VAL  11  -0.474 -17.460  -0.945
   88   1HG1  VAL  11          1HG1      VAL  11   0.949 -14.776  -0.963
   89   2HG1  VAL  11          2HG1      VAL  11   1.670 -16.334  -1.431
   90   3HG1  VAL  11          3HG1      VAL  11   0.326 -15.655  -2.380
   91   1HG2  VAL  11          1HG2      VAL  11   0.479 -15.806   1.417
   92   2HG2  VAL  11          2HG2      VAL  11  -0.354 -17.379   1.476
   93   3HG2  VAL  11          3HG2      VAL  11   1.289 -17.267   0.799
   94    H    ALA  12           H        ALA  12  -1.576 -14.649  -2.746
   95    HA   ALA  12           HA       ALA  12  -0.375 -12.206  -2.143
   96   1HB   ALA  12          1HB       ALA  12  -2.208 -13.064  -4.417
   97   2HB   ALA  12          2HB       ALA  12  -1.256 -11.561  -4.398
   98   3HB   ALA  12          3HB       ALA  12  -0.431 -13.138  -4.391
   99    H    GLN  13           H        GLN  13  -3.806 -13.285  -2.214
  100    HA   GLN  13           HA       GLN  13  -4.818 -10.685  -1.867
  101   1HB   GLN  13          1HB       GLN  13  -6.069 -13.419  -1.353
  102   2HB   GLN  13          2HB       GLN  13  -6.959 -11.910  -1.315
  103   1HG   GLN  13          1HG       GLN  13  -6.210 -13.507  -3.615
  104   2HG   GLN  13          2HG       GLN  13  -7.260 -12.106  -3.553
  105   1HE2  GLN  13          1HE2      GLN  13  -6.241  -9.972  -3.497
  106   2HE2  GLN  13          2HE2      GLN  13  -4.784  -9.699  -4.392
  107    H    GLU  14           H        GLU  14  -4.784 -13.531   0.412
  108    HA   GLU  14           HA       GLU  14  -5.619 -12.379   2.631
  109   1HB   GLU  14          1HB       GLU  14  -3.398 -14.391   2.192
  110   2HB   GLU  14          2HB       GLU  14  -3.811 -13.886   3.818
  111   1HG   GLU  14          1HG       GLU  14  -6.132 -14.622   2.081
  112   2HG   GLU  14          2HG       GLU  14  -5.053 -15.943   2.486
  113    HE2  GLU  14           HE       GLU  14  -4.881 -15.166   5.689
  114    H    MET  15           H        MET  15  -2.287 -12.070   1.276
  115    HA   MET  15           HA       MET  15  -1.378 -10.524   3.451
  116   1HB   MET  15          1HB       MET  15  -0.393 -11.499   0.807
  117   2HB   MET  15          2HB       MET  15   0.299  -9.958   1.277
  118   1HG   MET  15          1HG       MET  15   0.748 -11.102   3.600
  119   2HG   MET  15          2HG       MET  15   0.450 -12.610   2.760
  120   1HE   MET  15          1HE       MET  15   3.771 -12.152   3.843
  121   2HE   MET  15          2HE       MET  15   4.152 -10.516   3.258
  122   3HE   MET  15          3HE       MET  15   2.679 -10.797   4.216
  123    H    GLN  16           H        GLN  16  -2.730  -9.818   0.194
  124    HA   GLN  16           HA       GLN  16  -2.123  -7.118   0.185
  125   1HB   GLN  16          1HB       GLN  16  -2.886  -8.514  -1.780
  126   2HB   GLN  16          2HB       GLN  16  -4.512  -8.490  -1.124
  127   1HG   GLN  16          1HG       GLN  16  -3.430  -5.777  -1.206
  128   2HG   GLN  16          2HG       GLN  16  -3.286  -6.524  -2.784
  129   1HE2  GLN  16          1HE2      GLN  16  -4.831  -5.057  -3.566
  130   2HE2  GLN  16          2HE2      GLN  16  -6.528  -5.272  -3.299
  131    H    LYS  17           H        LYS  17  -4.739  -8.991   1.713
  132    HA   LYS  17           HA       LYS  17  -6.323  -6.682   2.291
  133   1HB   LYS  17          1HB       LYS  17  -7.374  -8.844   1.953
  134   2HB   LYS  17          2HB       LYS  17  -6.448  -9.551   3.260
  135   1HG   LYS  17          1HG       LYS  17  -7.558  -7.441   4.595
  136   2HG   LYS  17          2HG       LYS  17  -8.796  -7.690   3.381
  137   1HD   LYS  17          1HD       LYS  17  -9.607  -9.305   4.770
  138   2HD   LYS  17          2HD       LYS  17  -8.284 -10.296   4.186
  139   1HE   LYS  17          1HE       LYS  17  -7.382 -10.338   6.266
  140   2HE   LYS  17          2HE       LYS  17  -7.199  -8.595   6.231
  141   1HZ   LYS  17          1HZ       LYS  17  -8.611  -9.073   8.054
  142   2HZ   LYS  17          2HZ       LYS  17  -9.634  -8.521   6.914
  143    H    GLU  18           H        GLU  18  -3.891  -8.716   3.990
  144    HA   GLU  18           HA       GLU  18  -4.261  -7.462   6.459
  145   1HB   GLU  18          1HB       GLU  18  -3.132  -9.719   5.954
  146   2HB   GLU  18          2HB       GLU  18  -1.709  -8.808   5.485
  147   1HG   GLU  18          1HG       GLU  18  -1.148  -8.985   7.698
  148   2HG   GLU  18          2HG       GLU  18  -2.239  -7.629   7.903
  149    HE2  GLU  18           HE       GLU  18  -2.107 -11.134   8.384
  150    H    ILE  19           H        ILE  19  -2.196  -6.802   3.607
  151    HA   ILE  19           HA       ILE  19  -0.674  -4.793   4.952
  152    HB   ILE  19           HB       ILE  19   0.415  -4.485   2.897
  153   1HG1  ILE  19          1HG1      ILE  19  -1.979  -5.810   1.595
  154   2HG1  ILE  19          2HG1      ILE  19  -1.455  -4.146   1.417
  155   1HG2  ILE  19          1HG2      ILE  19  -0.083  -7.142   3.910
  156   2HG2  ILE  19          2HG2      ILE  19   0.242  -7.188   2.161
  157   3HG2  ILE  19          3HG2      ILE  19   1.415  -6.431   3.264
  158   1HD1  ILE  19          1HD1      ILE  19  -0.199  -6.661   0.307
  159   2HD1  ILE  19          2HD1      ILE  19  -0.561  -5.124  -0.516
  160   3HD1  ILE  19          3HD1      ILE  19   0.822  -5.234   0.600
  161    H    ALA  20           H        ALA  20  -3.479  -4.892   2.682
  162    HA   ALA  20           HA       ALA  20  -3.698  -2.158   2.284
  163   1HB   ALA  20          1HB       ALA  20  -6.152  -2.784   1.853
  164   2HB   ALA  20          2HB       ALA  20  -4.927  -3.653   0.895
  165   3HB   ALA  20          3HB       ALA  20  -5.692  -4.446   2.292
  166    H    LEU  21           H        LEU  21  -4.688  -4.257   5.001
  167    HA   LEU  21           HA       LEU  21  -6.307  -2.270   6.230
  168   1HB   LEU  21          1HB       LEU  21  -6.813  -4.515   6.689
  169   2HB   LEU  21          2HB       LEU  21  -5.151  -4.911   7.083
  170    HG   LEU  21           HG       LEU  21  -6.004  -2.877   8.898
  171   1HD1  LEU  21          1HD1      LEU  21  -8.288  -3.351   8.541
  172   2HD1  LEU  21          2HD1      LEU  21  -8.003  -5.107   8.505
  173   3HD1  LEU  21          3HD1      LEU  21  -7.841  -4.211  10.034
  174   1HD2  LEU  21          1HD2      LEU  21  -5.791  -5.728   9.747
  175   2HD2  LEU  21          2HD2      LEU  21  -4.364  -4.967   9.004
  176   3HD2  LEU  21          3HD2      LEU  21  -5.093  -4.255  10.464
  177    H    ILE  22           H        ILE  22  -3.014  -3.623   6.985
  178    HA   ILE  22           HA       ILE  22  -2.453  -1.803   9.002
  179    HB   ILE  22           HB       ILE  22  -0.594  -3.267   7.124
  180   1HG1  ILE  22          1HG1      ILE  22  -1.447  -4.073   9.912
  181   2HG1  ILE  22          2HG1      ILE  22  -2.282  -4.622   8.474
  182   1HG2  ILE  22          1HG2      ILE  22   1.161  -2.889   8.674
  183   2HG2  ILE  22          2HG2      ILE  22   0.409  -1.307   8.359
  184   3HG2  ILE  22          3HG2      ILE  22   0.052  -2.177   9.870
  185   1HD1  ILE  22          1HD1      ILE  22  -0.200  -5.620   7.594
  186   2HD1  ILE  22          2HD1      ILE  22   0.703  -4.999   8.996
  187   3HD1  ILE  22          3HD1      ILE  22  -0.544  -6.248   9.224
  188    H    LEU  23           H        LEU  23  -2.563  -1.443   5.511
  189    HA   LEU  23           HA       LEU  23  -0.974   0.974   5.587
  190   1HB   LEU  23          1HB       LEU  23  -1.037  -0.855   3.750
  191   2HB   LEU  23          2HB       LEU  23  -2.509  -0.061   3.225
  192    HG   LEU  23           HG       LEU  23  -1.182   2.089   3.054
  193   1HD1  LEU  23          1HD1      LEU  23   0.779   0.594   4.381
  194   2HD1  LEU  23          2HD1      LEU  23   1.387   0.801   2.720
  195   3HD1  LEU  23          3HD1      LEU  23   0.940   2.226   3.688
  196   1HD2  LEU  23          1HD2      LEU  23  -1.758   0.386   1.180
  197   2HD2  LEU  23          2HD2      LEU  23  -0.559   1.663   0.863
  198   3HD2  LEU  23          3HD2      LEU  23  -0.020   0.005   1.224
  199    H    GLN  24           H        GLN  24  -4.216  -0.007   6.161
  200    HA   GLN  24           HA       GLN  24  -5.129   2.692   5.547
  201   1HB   GLN  24          1HB       GLN  24  -6.400   0.004   5.375
  202   2HB   GLN  24          2HB       GLN  24  -7.430   1.258   6.039
  203   1HG   GLN  24          1HG       GLN  24  -7.864   1.599   3.787
  204   2HG   GLN  24          2HG       GLN  24  -6.489   2.671   3.960
  205   1HE2  GLN  24          1HE2      GLN  24  -7.799   0.055   2.329
  206   2HE2  GLN  24          2HE2      GLN  24  -6.399  -0.516   1.482
  207    H    ARG  25           H        ARG  25  -4.050   0.705   8.053
  208    HA   ARG  25           HA       ARG  25  -5.734   2.125   9.955
  209   1HB   ARG  25          1HB       ARG  25  -4.824  -0.675   9.789
  210   2HB   ARG  25          2HB       ARG  25  -4.431   0.035  11.343
  211   1HG   ARG  25          1HG       ARG  25  -6.609  -0.794  11.702
  212   2HG   ARG  25          2HG       ARG  25  -6.901   0.899  11.357
  213   1HD   ARG  25          1HD       ARG  25  -6.844  -0.938   8.983
  214   2HD   ARG  25          2HD       ARG  25  -8.204  -1.128  10.074
  215    HE   ARG  25           HE       ARG  25  -7.781   1.066   8.250
  216   1HH1  ARG  25          2HH2      ARG  25  -9.055   0.371  11.483
  217   2HH1  ARG  25          1HH2      ARG  25 -10.135   1.724  11.483
  218   1HH2  ARG  25          1HH       ARG  25 -10.206   3.171   9.573
  219    H    GLU  26           H        GLU  26  -2.414   0.767   9.373
  220    HA   GLU  26           HA       GLU  26  -1.322   2.289  11.499
  221   1HB   GLU  26          1HB       GLU  26   0.488   0.939  11.219
  222   2HB   GLU  26          2HB       GLU  26  -0.549   0.021  10.144
  223   1HG   GLU  26          1HG       GLU  26   1.294   0.407   8.753
  224   2HG   GLU  26          2HG       GLU  26   0.260   1.749   8.306
  225    HE2  GLU  26           HE       GLU  26   2.729   3.739   8.624
  226    H    ILE  27           H        ILE  27  -2.328   3.022   8.326
  227    HA   ILE  27           HA       ILE  27  -0.301   5.091   7.982
  228    HB   ILE  27           HB       ILE  27  -1.557   3.351   6.231
  229   1HG1  ILE  27          1HG1      ILE  27   0.148   5.813   5.893
  230   2HG1  ILE  27          2HG1      ILE  27   0.616   4.127   5.791
  231   1HG2  ILE  27          1HG2      ILE  27  -3.573   4.808   6.330
  232   2HG2  ILE  27          2HG2      ILE  27  -2.590   6.144   5.681
  233   3HG2  ILE  27          3HG2      ILE  27  -2.853   4.678   4.706
  234   1HD1  ILE  27          1HD1      ILE  27   0.517   4.846   3.525
  235   2HD1  ILE  27          2HD1      ILE  27  -1.013   3.971   3.768
  236   3HD1  ILE  27          3HD1      ILE  27  -0.994   5.750   3.791
  237    H    LYS  28           H        LYS  28  -1.467   7.183   6.861
  238    HA   LYS  28           HA       LYS  28  -3.437   7.994   8.874
  239   1HB   LYS  28          1HB       LYS  28  -2.707  10.300   8.330
  240   2HB   LYS  28          2HB       LYS  28  -1.423   9.298   8.973
  241   1HG   LYS  28          1HG       LYS  28  -1.442   8.959   6.107
  242   2HG   LYS  28          2HG       LYS  28  -1.518  10.679   6.439
  243   1HD   LYS  28          1HD       LYS  28   0.817  10.167   6.378
  244   2HD   LYS  28          2HD       LYS  28   0.436  10.333   8.081
  245   1HE   LYS  28          1HE       LYS  28   0.405   7.631   6.665
  246   2HE   LYS  28          2HE       LYS  28   1.853   8.279   7.410
  247   1HZ   LYS  28          1HZ       LYS  28   0.218   6.797   8.792
  248   2HZ   LYS  28          2HZ       LYS  28   0.944   8.064   9.514
  249    H    ASP  29           H        ASP  29  -5.046   6.717   7.555
  250    HA   ASP  29           HA       ASP  29  -5.636   7.810   4.989
  251   1HB   ASP  29          1HB       ASP  29  -6.491   5.718   4.797
  252   2HB   ASP  29          2HB       ASP  29  -6.295   5.443   6.517
  253    HD2  ASP  29           HD       ASP  29  -9.513   5.545   7.242
  254    HA   PRO  30           HA       PRO  30  -9.339   9.298   7.620
  255   1HB   PRO  30          1HB       PRO  30  -9.308   8.957  10.330
  256   2HB   PRO  30          2HB       PRO  30 -10.105   7.846   9.234
  257   1HG   PRO  30          1HG       PRO  30  -7.549   7.509  10.680
  258   2HG   PRO  30          2HG       PRO  30  -8.559   6.285   9.937
  259   1HD   PRO  30          1HD       PRO  30  -6.111   7.357   8.893
  260   2HD   PRO  30          2HD       PRO  30  -7.181   6.219   8.098
  261    H    ARG  31           H        ARG  31  -6.179   9.918   7.974
  262    HA   ARG  31           HA       ARG  31  -6.584  12.243   9.605
  263   1HB   ARG  31          1HB       ARG  31  -4.434  10.534   9.244
  264   2HB   ARG  31          2HB       ARG  31  -3.968  11.871   8.213
  265   1HG   ARG  31          1HG       ARG  31  -3.934  13.424  10.006
  266   2HG   ARG  31          2HG       ARG  31  -4.979  12.440  11.012
  267   1HD   ARG  31          1HD       ARG  31  -3.107  10.706  11.135
  268   2HD   ARG  31          2HD       ARG  31  -2.072  11.837  10.288
  269    HE   ARG  31           HE       ARG  31  -3.259  13.174  12.533
  270   1HH1  ARG  31          2HH2      ARG  31  -0.833  10.695  11.810
  271   2HH1  ARG  31          1HH2      ARG  31   0.085  10.997  13.249
  272   1HH2  ARG  31          1HH       ARG  31  -0.649  12.693  14.775
  273    H    LEU  32           H        LEU  32  -6.153  11.279   6.206
  274    HA   LEU  32           HA       LEU  32  -5.680  13.978   5.326
  275   1HB   LEU  32          1HB       LEU  32  -5.878  11.282   4.049
  276   2HB   LEU  32          2HB       LEU  32  -6.076  12.711   3.054
  277    HG   LEU  32           HG       LEU  32  -3.865  13.507   3.645
  278   1HD1  LEU  32          1HD1      LEU  32  -4.075  11.451   5.749
  279   2HD1  LEU  32          2HD1      LEU  32  -2.488  11.557   4.947
  280   3HD1  LEU  32          3HD1      LEU  32  -3.191  12.995   5.726
  281   1HD2  LEU  32          1HD2      LEU  32  -2.746  12.163   2.205
  282   2HD2  LEU  32          2HD2      LEU  32  -3.248  10.667   3.029
  283   3HD2  LEU  32          3HD2      LEU  32  -4.379  11.506   1.940
  284    H    GLY  33           H        GLY  33  -8.393  11.852   5.984
  285   1HA   GLY  33          1HA       GLY  33 -10.576  12.563   6.185
  286   2HA   GLY  33          2HA       GLY  33 -10.217  14.001   5.250
  287    H    MET  34           H        MET  34  -9.021  10.922   4.019
  288    HA   MET  34           HA       MET  34 -11.353  10.641   2.332
  289   1HB   MET  34          1HB       MET  34  -8.472  10.997   1.335
  290   2HB   MET  34          2HB       MET  34  -9.787  10.460   0.310
  291   1HG   MET  34          1HG       MET  34  -9.956  12.720  -0.138
  292   2HG   MET  34          2HG       MET  34 -10.957  12.697   1.300
  293   1HE   MET  34          1HE       MET  34  -7.986  13.789  -0.480
  294   2HE   MET  34          2HE       MET  34  -6.910  14.596   0.686
  295   3HE   MET  34          3HE       MET  34  -6.903  12.821   0.550
  296    H    MET  35           H        MET  35 -11.494   8.509   1.285
  297    HA   MET  35           HA       MET  35 -10.096   6.552   2.875
  298   1HB   MET  35          1HB       MET  35 -12.707   6.800   1.818
  299   2HB   MET  35          2HB       MET  35 -11.976   5.586   0.790
  300   1HG   MET  35          1HG       MET  35 -12.653   4.162   2.474
  301   2HG   MET  35          2HG       MET  35 -11.131   4.641   3.200
  302   1HE   MET  35          1HE       MET  35 -14.789   5.419   2.724
  303   2HE   MET  35          2HE       MET  35 -15.289   6.319   4.176
  304   3HE   MET  35          3HE       MET  35 -14.356   7.136   2.898
  305    H    THR  36           H        THR  36  -8.248   5.598   2.151
  306    HA   THR  36           HA       THR  36  -7.495   5.919  -0.616
  307    HB   THR  36           HB       THR  36  -5.344   5.259   0.182
  308    HG1  THR  36           HG1      THR  36  -6.887   4.115   2.404
  309   1HG2  THR  36          1HG2      THR  36  -6.427   7.281   1.524
  310   2HG2  THR  36          2HG2      THR  36  -6.514   6.103   2.854
  311   3HG2  THR  36          3HG2      THR  36  -4.939   6.528   2.144
  312    H    THR  37           H        THR  37  -6.771   4.120  -1.982
  313    HA   THR  37           HA       THR  37  -8.150   1.607  -1.347
  314    HB   THR  37           HB       THR  37  -8.497   3.448  -3.738
  315    HG1  THR  37           HG1      THR  37 -10.713   2.720  -3.198
  316   1HG2  THR  37          1HG2      THR  37  -7.847   1.177  -4.656
  317   2HG2  THR  37          2HG2      THR  37  -9.132   0.450  -3.660
  318   3HG2  THR  37          3HG2      THR  37  -9.552   1.583  -4.969
  319    H    VAL  38           H        VAL  38  -7.431  -0.178  -2.926
  320    HA   VAL  38           HA       VAL  38  -4.631   0.256  -3.668
  321    HB   VAL  38           HB       VAL  38  -5.787  -1.942  -1.957
  322   1HG1  VAL  38          1HG1      VAL  38  -3.100  -1.876  -3.368
  323   2HG1  VAL  38          2HG1      VAL  38  -3.558  -3.032  -2.094
  324   3HG1  VAL  38          3HG1      VAL  38  -4.427  -3.027  -3.647
  325   1HG2  VAL  38          1HG2      VAL  38  -3.251  -0.467  -1.357
  326   2HG2  VAL  38          2HG2      VAL  38  -4.803   0.371  -1.105
  327   3HG2  VAL  38          3HG2      VAL  38  -4.465  -1.154  -0.251
  328    H    SER  39           H        SER  39  -5.187   0.399  -5.875
  329    HA   SER  39           HA       SER  39  -6.699  -1.824  -6.938
  330   1HB   SER  39          1HB       SER  39  -6.718   0.872  -7.528
  331   2HB   SER  39          2HB       SER  39  -5.670   0.263  -8.793
  332    HG   SER  39           HG       SER  39  -7.692   0.044  -9.664
  333    H    GLY  40           H        GLY  40  -3.770  -1.830  -5.891
  334   1HA   GLY  40          1HA       GLY  40  -2.721  -3.514  -7.960
  335   2HA   GLY  40          2HA       GLY  40  -1.885  -1.977  -7.865
  336    H    VAL  41           H        VAL  41  -1.440  -5.032  -6.982
  337    HA   VAL  41           HA       VAL  41   0.003  -4.261  -4.576
  338    HB   VAL  41           HB       VAL  41  -2.050  -5.043  -3.665
  339   1HG1  VAL  41          1HG1      VAL  41  -1.988  -6.886  -5.928
  340   2HG1  VAL  41          2HG1      VAL  41  -2.376  -7.710  -4.399
  341   3HG1  VAL  41          3HG1      VAL  41  -3.363  -6.331  -4.941
  342   1HG2  VAL  41          1HG2      VAL  41  -0.025  -5.815  -2.526
  343   2HG2  VAL  41          2HG2      VAL  41  -1.323  -7.025  -2.399
  344   3HG2  VAL  41          3HG2      VAL  41   0.012  -7.270  -3.550
  345    H    GLU  42           H        GLU  42   2.051  -5.049  -4.648
  346    HA   GLU  42           HA       GLU  42   2.463  -7.387  -6.334
  347   1HB   GLU  42          1HB       GLU  42   4.302  -4.954  -6.251
  348   2HB   GLU  42          2HB       GLU  42   4.532  -6.390  -7.229
  349   1HG   GLU  42          1HG       GLU  42   1.857  -5.227  -7.632
  350   2HG   GLU  42          2HG       GLU  42   3.122  -4.062  -7.971
  351    HE2  GLU  42           HE       GLU  42   4.255  -5.573 -10.762
  352    H    MET  43           H        MET  43   3.483  -9.014  -5.243
  353    HA   MET  43           HA       MET  43   5.195  -8.202  -3.028
  354   1HB   MET  43          1HB       MET  43   3.750 -10.809  -2.763
  355   2HB   MET  43          2HB       MET  43   4.059  -9.592  -1.541
  356   1HG   MET  43          1HG       MET  43   1.986  -9.261  -3.762
  357   2HG   MET  43          2HG       MET  43   1.603  -9.868  -2.163
  358   1HE   MET  43          1HE       MET  43   1.777  -6.937   0.160
  359   2HE   MET  43          2HE       MET  43   0.726  -8.275  -0.361
  360   3HE   MET  43          3HE       MET  43   2.436  -8.585   0.022
  361    H    SER  44           H        SER  44   7.226  -8.702  -3.783
  362    HA   SER  44           HA       SER  44   7.485 -11.284  -5.110
  363   1HB   SER  44          1HB       SER  44   8.451  -8.676  -5.788
  364   2HB   SER  44          2HB       SER  44   9.854  -9.630  -5.353
  365    HG   SER  44           HG       SER  44   7.915 -10.839  -7.061
  366    H    ARG  45           H        ARG  45   8.059 -12.802  -3.577
  367    HA   ARG  45           HA       ARG  45   9.920 -11.927  -1.535
  368   1HB   ARG  45          1HB       ARG  45   8.605 -14.646  -1.480
  369   2HB   ARG  45          2HB       ARG  45   9.041 -13.608  -0.137
  370   1HG   ARG  45          1HG       ARG  45   7.169 -12.063  -1.538
  371   2HG   ARG  45          2HG       ARG  45   6.539 -13.691  -1.709
  372   1HD   ARG  45          1HD       ARG  45   7.490 -13.105   1.037
  373   2HD   ARG  45          2HD       ARG  45   6.194 -12.045   0.522
  374    HE   ARG  45           HE       ARG  45   6.024 -14.966   0.917
  375   1HH1  ARG  45          2HH2      ARG  45   4.453 -12.064  -0.372
  376   2HH1  ARG  45          1HH2      ARG  45   2.873 -12.775  -0.388
  377   1HH2  ARG  45          1HH       ARG  45   2.594 -15.034   0.363
  378    H    ASP  46           H        ASP  46   9.894 -13.384  -4.561
  379    HA   ASP  46           HA       ASP  46  11.347 -15.650  -4.348
  380   1HB   ASP  46          1HB       ASP  46  11.542 -13.419  -6.422
  381   2HB   ASP  46          2HB       ASP  46  12.285 -14.991  -6.636
  382    HD2  ASP  46           HD       ASP  46  10.549 -16.720  -7.446
  383    H    LEU  47           H        LEU  47  12.248 -12.343  -3.636
  384    HA   LEU  47           HA       LEU  47  14.924 -13.215  -2.961
  385   1HB   LEU  47          1HB       LEU  47  14.323 -11.611  -5.301
  386   2HB   LEU  47          2HB       LEU  47  15.356 -10.743  -4.182
  387    HG   LEU  47           HG       LEU  47  16.237 -13.505  -4.604
  388   1HD1  LEU  47          1HD1      LEU  47  17.154 -12.959  -6.921
  389   2HD1  LEU  47          2HD1      LEU  47  15.428 -13.378  -6.806
  390   3HD1  LEU  47          3HD1      LEU  47  15.921 -11.677  -6.984
  391   1HD2  LEU  47          1HD2      LEU  47  17.337 -10.846  -4.163
  392   2HD2  LEU  47          2HD2      LEU  47  18.018 -12.448  -3.790
  393   3HD2  LEU  47          3HD2      LEU  47  18.232 -11.746  -5.412
  394    H    ALA  48           H        ALA  48  13.171 -10.059  -3.376
  395    HA   ALA  48           HA       ALA  48  12.339  -9.678  -0.831
  396   1HB   ALA  48          1HB       ALA  48  14.509  -8.056  -0.307
  397   2HB   ALA  48          2HB       ALA  48  14.246  -9.672   0.390
  398   3HB   ALA  48          3HB       ALA  48  15.276  -9.481  -1.048
  399    H    TYR  49           H        TYR  49  11.093  -8.927  -2.947
  400    HA   TYR  49           HA       TYR  49  11.403  -6.038  -2.993
  401   1HB   TYR  49          1HB       TYR  49  11.028  -7.647  -5.563
  402   2HB   TYR  49          2HB       TYR  49  11.633  -6.010  -5.407
  403    HD1  TYR  49           HD1      TYR  49  12.584  -9.220  -6.237
  404    HD2  TYR  49           HD2      TYR  49  13.897  -5.934  -3.833
  405    HE1  TYR  49           HE1      TYR  49  14.972 -10.084  -6.348
  406    HE2  TYR  49           HE2      TYR  49  16.281  -6.809  -3.953
  407    HH   TYR  49           HH       TYR  49  17.618  -8.190  -5.409
  408    H    ALA  50           H        ALA  50   9.452  -4.936  -3.408
  409    HA   ALA  50           HA       ALA  50   7.164  -6.399  -4.327
  410   1HB   ALA  50          1HB       ALA  50   5.875  -5.832  -2.188
  411   2HB   ALA  50          2HB       ALA  50   7.042  -7.170  -2.072
  412   3HB   ALA  50          3HB       ALA  50   7.459  -5.569  -1.421
  413    H    LYS  51           H        LYS  51   5.221  -4.891  -4.449
  414    HA   LYS  51           HA       LYS  51   5.874  -2.086  -4.223
  415   1HB   LYS  51          1HB       LYS  51   4.826  -2.543  -6.886
  416   2HB   LYS  51          2HB       LYS  51   6.215  -1.607  -6.372
  417   1HG   LYS  51          1HG       LYS  51   7.599  -3.662  -6.264
  418   2HG   LYS  51          2HG       LYS  51   6.211  -4.647  -6.678
  419   1HD   LYS  51          1HD       LYS  51   6.647  -4.330  -8.877
  420   2HD   LYS  51          2HD       LYS  51   6.365  -2.612  -8.683
  421   1HE   LYS  51          1HE       LYS  51   8.619  -2.106  -8.597
  422   2HE   LYS  51          2HE       LYS  51   9.024  -3.560  -7.706
  423   1HZ   LYS  51          1HZ       LYS  51   8.959  -4.830  -9.710
  424   2HZ   LYS  51          2HZ       LYS  51   8.262  -3.636 -10.571
  425    H    VAL  52           H        VAL  52   4.179  -1.427  -3.011
  426    HA   VAL  52           HA       VAL  52   1.564  -2.592  -3.646
  427    HB   VAL  52           HB       VAL  52   2.630  -2.775  -1.334
  428   1HG1  VAL  52          1HG1      VAL  52   3.465  -0.460  -1.193
  429   2HG1  VAL  52          2HG1      VAL  52   1.790   0.142  -1.201
  430   3HG1  VAL  52          3HG1      VAL  52   2.372  -0.851   0.157
  431   1HG2  VAL  52          1HG2      VAL  52   0.554  -3.149  -0.567
  432   2HG2  VAL  52          2HG2      VAL  52   0.057  -1.460  -0.825
  433   3HG2  VAL  52          3HG2      VAL  52   0.003  -2.620  -2.175
  434    H    TYR  53           H        TYR  53  -0.046  -1.333  -4.486
  435    HA   TYR  53           HA       TYR  53   0.647   1.478  -4.928
  436   1HB   TYR  53          1HB       TYR  53  -0.424  -0.710  -6.452
  437   2HB   TYR  53          2HB       TYR  53  -1.797   0.343  -6.168
  438    HD1  TYR  53           HD1      TYR  53  -0.521   3.030  -6.268
  439    HD2  TYR  53           HD2      TYR  53   0.090  -0.424  -8.718
  440    HE1  TYR  53           HE1      TYR  53   0.231   4.517  -8.188
  441    HE2  TYR  53           HE2      TYR  53   0.839   1.074 -10.630
  442    HH   TYR  53           HH       TYR  53   1.831   3.320 -10.873
  443    H    VAL  54           H        VAL  54  -0.766   3.172  -4.367
  444    HA   VAL  54           HA       VAL  54  -3.225   2.445  -2.998
  445    HB   VAL  54           HB       VAL  54  -2.313   4.318  -1.286
  446   1HG1  VAL  54          1HG1      VAL  54  -1.575   1.427  -0.834
  447   2HG1  VAL  54          2HG1      VAL  54  -2.228   2.617   0.318
  448   3HG1  VAL  54          3HG1      VAL  54  -3.277   1.934  -0.948
  449   1HG2  VAL  54          1HG2      VAL  54  -0.047   4.064  -2.603
  450   2HG2  VAL  54          2HG2      VAL  54  -0.052   4.221  -0.830
  451   3HG2  VAL  54          3HG2      VAL  54   0.144   2.619  -1.583
  452    H    THR  55           H        THR  55  -4.821   3.711  -3.791
  453    HA   THR  55           HA       THR  55  -4.002   6.248  -5.035
  454    HB   THR  55           HB       THR  55  -5.018   4.973  -6.732
  455    HG1  THR  55           HG1      THR  55  -6.637   6.471  -6.890
  456   1HG2  THR  55          1HG2      THR  55  -7.282   3.736  -6.119
  457   2HG2  THR  55          2HG2      THR  55  -5.737   2.945  -5.725
  458   3HG2  THR  55          3HG2      THR  55  -6.652   3.795  -4.456
  459    H    PHE  56           H        PHE  56  -4.701   8.162  -4.273
  460    HA   PHE  56           HA       PHE  56  -6.783   8.026  -2.208
  461   1HB   PHE  56          1HB       PHE  56  -4.466  10.026  -2.412
  462   2HB   PHE  56          2HB       PHE  56  -5.486   9.744  -1.017
  463    HD1  PHE  56           HD1      PHE  56  -4.750   8.327   0.668
  464    HD2  PHE  56           HD2      PHE  56  -3.001   8.010  -3.186
  465    HE1  PHE  56           HE1      PHE  56  -3.069   6.693   1.565
  466    HE2  PHE  56           HE2      PHE  56  -1.321   6.377  -2.288
  467    HZ   PHE  56           HZ       PHE  56  -1.373   5.737   0.077
  468    H    LEU  57           H        LEU  57  -7.919  10.191  -1.881
  469    HA   LEU  57           HA       LEU  57  -8.426  11.317  -4.520
  470   1HB   LEU  57          1HB       LEU  57 -10.226  10.334  -3.012
  471   2HB   LEU  57          2HB       LEU  57 -10.005  11.741  -1.988
  472    HG   LEU  57           HG       LEU  57 -10.489  13.147  -4.084
  473   1HD1  LEU  57          1HD1      LEU  57 -11.406  10.432  -5.059
  474   2HD1  LEU  57          2HD1      LEU  57 -11.939  11.978  -5.764
  475   3HD1  LEU  57          3HD1      LEU  57 -10.220  11.525  -5.812
  476   1HD2  LEU  57          1HD2      LEU  57 -13.063  12.353  -3.833
  477   2HD2  LEU  57          2HD2      LEU  57 -12.359  11.621  -2.372
  478   3HD2  LEU  57          3HD2      LEU  57 -12.212  13.373  -2.650
  479    H    ASN  58           H        ASN  58  -6.054  11.851  -2.555
  480    HA   ASN  58           HA       ASN  58  -6.334  14.351  -1.487
  481   1HB   ASN  58          1HB       ASN  58  -4.116  12.547  -2.261
  482   2HB   ASN  58          2HB       ASN  58  -3.661  14.234  -2.382
  483   1HD2  ASN  58          1HD2      ASN  58  -5.122  15.413  -0.412
  484   2HD2  ASN  58          2HD2      ASN  58  -4.634  14.853   1.152
  485    H    ASP  59           H        ASP  59  -5.766  13.225  -4.821
  486    HA   ASP  59           HA       ASP  59  -4.594  15.192  -6.093
  487   1HB   ASP  59          1HB       ASP  59  -5.414  13.490  -7.480
  488   2HB   ASP  59          2HB       ASP  59  -7.010  13.525  -6.757
  489    HD2  ASP  59           HD       ASP  59  -8.402  15.170  -7.484
  490    H    LYS  60           H        LYS  60  -8.005  15.188  -4.887
  491    HA   LYS  60           HA       LYS  60  -9.078  17.371  -5.988
  492   1HB   LYS  60          1HB       LYS  60  -9.304  16.044  -3.350
  493   2HB   LYS  60          2HB       LYS  60  -9.911  17.687  -3.409
  494   1HG   LYS  60          1HG       LYS  60 -10.896  16.601  -5.787
  495   2HG   LYS  60          2HG       LYS  60 -10.981  15.239  -4.688
  496   1HD   LYS  60          1HD       LYS  60 -11.961  17.902  -3.677
  497   2HD   LYS  60          2HD       LYS  60 -12.956  17.069  -4.854
  498   1HE   LYS  60          1HE       LYS  60 -13.115  15.088  -3.426
  499   2HE   LYS  60          2HE       LYS  60 -11.921  15.727  -2.314
  500   1HZ   LYS  60          1HZ       LYS  60 -13.466  17.060  -1.347
  501   2HZ   LYS  60          2HZ       LYS  60 -14.195  17.469  -2.745
  502    H    ASP  61           H        ASP  61  -6.605  17.333  -3.367
  503    HA   ASP  61           HA       ASP  61  -6.257  20.171  -3.927
  504   1HB   ASP  61          1HB       ASP  61  -5.452  19.088  -1.246
  505   2HB   ASP  61          2HB       ASP  61  -6.060  20.678  -1.659
  506    HD2  ASP  61           HD       ASP  61  -7.096  17.538  -0.617
  507    H    GLU  62           H        GLU  62  -4.214  20.468  -4.829
  508    HA   GLU  62           HA       GLU  62  -2.354  18.385  -4.858
  509   1HB   GLU  62          1HB       GLU  62  -2.700  20.325  -6.546
  510   2HB   GLU  62          2HB       GLU  62  -1.735  21.300  -5.455
  511   1HG   GLU  62          1HG       GLU  62   0.191  19.862  -5.707
  512   2HG   GLU  62          2HG       GLU  62  -0.754  18.604  -6.477
  513    HE2  GLU  62           HE       GLU  62   1.527  20.338  -7.568
  514    H    ASP  63           H        ASP  63  -3.081  20.882  -2.550
  515    HA   ASP  63           HA       ASP  63  -0.492  21.164  -1.506
  516   1HB   ASP  63          1HB       ASP  63  -3.028  22.331  -1.113
  517   2HB   ASP  63          2HB       ASP  63  -2.694  21.549   0.419
  518    HD2  ASP  63           HD       ASP  63   0.138  23.338   1.080
  519    H    ALA  64           H        ALA  64  -3.413  19.167  -0.747
  520    HA   ALA  64           HA       ALA  64  -2.149  17.927   1.517
  521   1HB   ALA  64          1HB       ALA  64  -4.726  17.254   0.041
  522   2HB   ALA  64          2HB       ALA  64  -4.248  16.682   1.658
  523   3HB   ALA  64          3HB       ALA  64  -4.591  18.408   1.391
  524    H    VAL  65           H        VAL  65  -2.246  17.513  -1.944
  525    HA   VAL  65           HA       VAL  65  -1.795  14.697  -1.922
  526    HB   VAL  65           HB       VAL  65  -2.579  16.586  -3.756
  527   1HG1  VAL  65          1HG1      VAL  65  -0.204  17.261  -4.077
  528   2HG1  VAL  65          2HG1      VAL  65   0.164  15.605  -4.613
  529   3HG1  VAL  65          3HG1      VAL  65  -0.956  16.617  -5.557
  530   1HG2  VAL  65          1HG2      VAL  65  -3.422  14.597  -4.369
  531   2HG2  VAL  65          2HG2      VAL  65  -1.932  14.403  -5.324
  532   3HG2  VAL  65          3HG2      VAL  65  -2.040  13.701  -3.692
  533    H    LYS  66           H        LYS  66   0.223  17.676  -2.127
  534    HA   LYS  66           HA       LYS  66   2.631  16.184  -2.464
  535   1HB   LYS  66          1HB       LYS  66   1.808  18.846  -2.793
  536   2HB   LYS  66          2HB       LYS  66   2.976  18.902  -1.489
  537   1HG   LYS  66          1HG       LYS  66   4.716  18.007  -2.823
  538   2HG   LYS  66          2HG       LYS  66   3.605  17.260  -3.953
  539   1HD   LYS  66          1HD       LYS  66   2.954  19.967  -4.177
  540   2HD   LYS  66          2HD       LYS  66   4.687  20.017  -3.924
  541   1HE   LYS  66          1HE       LYS  66   3.797  17.928  -5.852
  542   2HE   LYS  66          2HE       LYS  66   3.461  19.570  -6.368
  543   1HZ   LYS  66          1HZ       LYS  66   5.616  19.600  -6.986
  544   2HZ   LYS  66          2HZ       LYS  66   6.018  19.705  -5.412
  545    H    ALA  67           H        ALA  67   1.122  18.044   0.265
  546    HA   ALA  67           HA       ALA  67   3.107  17.350   2.118
  547   1HB   ALA  67          1HB       ALA  67   0.250  18.344   2.285
  548   2HB   ALA  67          2HB       ALA  67   1.192  17.981   3.751
  549   3HB   ALA  67          3HB       ALA  67   1.761  19.226   2.614
  550    H    GLY  68           H        GLY  68  -0.206  15.989   1.494
  551   1HA   GLY  68          1HA       GLY  68  -0.205  13.997   3.394
  552   2HA   GLY  68          2HA       GLY  68  -1.039  13.933   1.855
  553    H    ILE  69           H        ILE  69   0.674  13.595  -0.120
  554    HA   ILE  69           HA       ILE  69   1.603  11.002   0.157
  555    HB   ILE  69           HB       ILE  69   1.016  12.431  -1.915
  556   1HG1  ILE  69          1HG1      ILE  69   3.277  10.412  -1.891
  557   2HG1  ILE  69          2HG1      ILE  69   1.563  10.068  -2.012
  558   1HG2  ILE  69          1HG2      ILE  69   3.969  12.817  -2.185
  559   2HG2  ILE  69          2HG2      ILE  69   2.621  13.685  -2.959
  560   3HG2  ILE  69          3HG2      ILE  69   3.025  14.007  -1.256
  561   1HD1  ILE  69          1HD1      ILE  69   2.722  11.971  -4.032
  562   2HD1  ILE  69          2HD1      ILE  69   3.125  10.244  -4.192
  563   3HD1  ILE  69          3HD1      ILE  69   1.423  10.769  -4.222
  564    H    LYS  70           H        LYS  70   3.089  14.117   0.933
  565    HA   LYS  70           HA       LYS  70   5.752  13.181   0.988
  566   1HB   LYS  70          1HB       LYS  70   4.275  15.617   1.861
  567   2HB   LYS  70          2HB       LYS  70   5.820  15.311   2.626
  568   1HG   LYS  70          1HG       LYS  70   6.977  15.273   0.495
  569   2HG   LYS  70          2HG       LYS  70   5.472  15.215  -0.401
  570   1HD   LYS  70          1HD       LYS  70   5.068  17.481  -0.156
  571   2HD   LYS  70          2HD       LYS  70   5.763  17.545   1.451
  572   1HE   LYS  70          1HE       LYS  70   8.068  17.266   0.376
  573   2HE   LYS  70          2HE       LYS  70   7.295  17.427  -1.188
  574   1HZ   LYS  70          1HZ       LYS  70   7.011  19.646  -0.870
  575   2HZ   LYS  70          2HZ       LYS  70   6.605  19.514   0.702
  576    H    ALA  71           H        ALA  71   3.019  13.135   3.271
  577    HA   ALA  71           HA       ALA  71   4.679  12.368   5.481
  578   1HB   ALA  71          1HB       ALA  71   2.570  13.698   5.693
  579   2HB   ALA  71          2HB       ALA  71   1.655  12.276   5.138
  580   3HB   ALA  71          3HB       ALA  71   2.556  12.210   6.670
  581    H    LEU  72           H        LEU  72   2.505  10.791   3.081
  582    HA   LEU  72           HA       LEU  72   2.703   8.237   4.291
  583   1HB   LEU  72          1HB       LEU  72   1.164   9.459   2.327
  584   2HB   LEU  72          2HB       LEU  72   2.091   8.262   1.446
  585    HG   LEU  72           HG       LEU  72   1.291   6.658   3.392
  586   1HD1  LEU  72          1HD1      LEU  72  -0.245   7.420   4.795
  587   2HD1  LEU  72          2HD1      LEU  72  -0.069   9.037   4.072
  588   3HD1  LEU  72          3HD1      LEU  72  -1.294   7.909   3.443
  589   1HD2  LEU  72          1HD2      LEU  72   0.612   7.033   0.762
  590   2HD2  LEU  72          2HD2      LEU  72   0.052   5.698   1.797
  591   3HD2  LEU  72          3HD2      LEU  72  -0.965   7.142   1.579
  592    H    GLN  73           H        GLN  73   4.753  10.166   2.203
  593    HA   GLN  73           HA       GLN  73   6.146   7.915   1.165
  594   1HB   GLN  73          1HB       GLN  73   5.933  10.071  -0.076
  595   2HB   GLN  73          2HB       GLN  73   6.881  10.876   1.158
  596   1HG   GLN  73          1HG       GLN  73   8.475   8.670   0.479
  597   2HG   GLN  73          2HG       GLN  73   7.776   9.137  -1.058
  598   1HE2  GLN  73          1HE2      GLN  73  10.503   9.364   0.221
  599   2HE2  GLN  73          2HE2      GLN  73  10.986  11.013  -0.003
  600    H    GLU  74           H        GLU  74   6.849  10.542   3.574
  601    HA   GLU  74           HA       GLU  74   9.348   9.579   4.260
  602   1HB   GLU  74          1HB       GLU  74   9.299  11.178   6.001
  603   2HB   GLU  74          2HB       GLU  74   8.239  11.860   4.785
  604   1HG   GLU  74          1HG       GLU  74   6.261  10.855   5.999
  605   2HG   GLU  74          2HG       GLU  74   7.351  10.281   7.245
  606    HE2  GLU  74           HE       GLU  74   7.016  13.287   8.869
  607    H    ALA  75           H        ALA  75   6.076   8.603   5.206
  608    HA   ALA  75           HA       ALA  75   7.122   6.965   7.375
  609   1HB   ALA  75          1HB       ALA  75   4.968   6.954   8.185
  610   2HB   ALA  75          2HB       ALA  75   4.895   8.460   7.239
  611   3HB   ALA  75          3HB       ALA  75   4.241   6.950   6.560
  612    H    SER  76           H        SER  76   7.416   6.675   4.223
  613    HA   SER  76           HA       SER  76   6.006   4.464   3.443
  614   1HB   SER  76          1HB       SER  76   8.708   5.593   2.660
  615   2HB   SER  76          2HB       SER  76   8.140   4.102   1.934
  616    HG   SER  76           HG       SER  76   6.732   5.193   0.731
  617    H    GLY  77           H        GLY  77   9.557   4.382   4.232
  618   1HA   GLY  77          1HA       GLY  77   9.861   1.701   4.565
  619   2HA   GLY  77          2HA       GLY  77  10.775   2.915   5.437
  620    H    PHE  78           H        PHE  78   8.157   3.971   6.689
  621    HA   PHE  78           HA       PHE  78   8.315   2.387   9.022
  622   1HB   PHE  78          1HB       PHE  78   7.096   4.858   7.976
  623   2HB   PHE  78          2HB       PHE  78   5.922   3.991   8.946
  624    HD1  PHE  78           HD1      PHE  78   9.085   5.814   8.986
  625    HD2  PHE  78           HD2      PHE  78   6.280   3.669  11.338
  626    HE1  PHE  78           HE1      PHE  78  10.127   6.740  11.072
  627    HE2  PHE  78           HE2      PHE  78   7.322   4.594  13.425
  628    HZ   PHE  78           HZ       PHE  78   9.233   6.118  13.268
  629    H    ILE  79           H        ILE  79   5.888   2.739   6.367
  630    HA   ILE  79           HA       ILE  79   3.999   1.025   7.564
  631    HB   ILE  79           HB       ILE  79   2.763   1.318   5.654
  632   1HG1  ILE  79          1HG1      ILE  79   5.389   1.287   4.210
  633   2HG1  ILE  79          2HG1      ILE  79   3.947   0.333   3.928
  634   1HG2  ILE  79          1HG2      ILE  79   4.312   3.731   5.007
  635   2HG2  ILE  79          2HG2      ILE  79   2.632   3.551   5.570
  636   3HG2  ILE  79          3HG2      ILE  79   3.972   3.519   6.741
  637   1HD1  ILE  79          1HD1      ILE  79   3.848   1.850   2.146
  638   2HD1  ILE  79          2HD1      ILE  79   2.840   2.679   3.355
  639   3HD1  ILE  79          3HD1      ILE  79   4.529   3.183   3.110
  640    H    ARG  80           H        ARG  80   6.769   0.544   5.329
  641    HA   ARG  80           HA       ARG  80   6.160  -2.065   4.676
  642   1HB   ARG  80          1HB       ARG  80   7.831  -0.816   3.413
  643   2HB   ARG  80          2HB       ARG  80   8.814  -0.566   4.842
  644   1HG   ARG  80          1HG       ARG  80   8.484  -3.379   4.669
  645   2HG   ARG  80          2HG       ARG  80   8.754  -2.858   3.019
  646   1HD   ARG  80          1HD       ARG  80  10.617  -1.388   4.610
  647   2HD   ARG  80          2HD       ARG  80  10.667  -3.032   5.214
  648    HE   ARG  80           HE       ARG  80  10.713  -2.890   2.290
  649   1HH1  ARG  80          2HH2      ARG  80  12.715  -2.804   5.212
  650   2HH1  ARG  80          1HH2      ARG  80  14.157  -3.296   4.389
  651   1HH2  ARG  80          1HH       ARG  80  14.074  -3.724   2.033
  652    H    SER  81           H        SER  81   8.089  -0.616   7.364
  653    HA   SER  81           HA       SER  81   8.885  -3.146   8.346
  654   1HB   SER  81          1HB       SER  81  10.195  -1.039   8.684
  655   2HB   SER  81          2HB       SER  81   8.911  -0.409   9.697
  656    HG   SER  81           HG       SER  81   9.707  -1.504  11.347
  657    H    LEU  82           H        LEU  82   6.171  -0.902   8.829
  658    HA   LEU  82           HA       LEU  82   5.295  -1.851  11.305
  659   1HB   LEU  82          1HB       LEU  82   4.634   0.261  10.142
  660   2HB   LEU  82          2HB       LEU  82   3.643  -0.696   9.059
  661    HG   LEU  82           HG       LEU  82   1.984  -0.288  10.494
  662   1HD1  LEU  82          1HD1      LEU  82   2.254  -2.618  10.965
  663   2HD1  LEU  82          2HD1      LEU  82   3.527  -2.289  12.164
  664   3HD1  LEU  82          3HD1      LEU  82   1.848  -1.791  12.487
  665   1HD2  LEU  82          1HD2      LEU  82   3.670   1.363  11.618
  666   2HD2  LEU  82          2HD2      LEU  82   2.163   0.915  12.452
  667   3HD2  LEU  82          3HD2      LEU  82   3.699   0.146  12.915
  668    H    LEU  83           H        LEU  83   4.582  -2.879   7.917
  669    HA   LEU  83           HA       LEU  83   2.727  -4.860   8.727
  670   1HB   LEU  83          1HB       LEU  83   4.172  -4.186   6.187
  671   2HB   LEU  83          2HB       LEU  83   3.254  -5.674   6.317
  672    HG   LEU  83           HG       LEU  83   1.257  -4.241   6.995
  673   1HD1  LEU  83          1HD1      LEU  83   2.781  -2.233   7.494
  674   2HD1  LEU  83          2HD1      LEU  83   2.766  -1.956   5.736
  675   3HD1  LEU  83          3HD1      LEU  83   1.241  -1.932   6.655
  676   1HD2  LEU  83          1HD2      LEU  83   2.473  -4.070   4.231
  677   2HD2  LEU  83          2HD2      LEU  83   1.282  -5.243   4.841
  678   3HD2  LEU  83          3HD2      LEU  83   0.817  -3.540   4.613
  679    H    GLY  84           H        GLY  84   6.222  -4.893   7.783
  680   1HA   GLY  84          1HA       GLY  84   6.694  -7.601   7.886
  681   2HA   GLY  84          2HA       GLY  84   7.858  -6.353   8.283
  682    H    LYS  85           H        LYS  85   6.678  -5.186  10.593
  683    HA   LYS  85           HA       LYS  85   7.355  -7.206  12.507
  684   1HB   LYS  85          1HB       LYS  85   7.054  -4.285  12.431
  685   2HB   LYS  85          2HB       LYS  85   6.464  -5.001  13.917
  686   1HG   LYS  85          1HG       LYS  85   8.720  -6.373  13.874
  687   2HG   LYS  85          2HG       LYS  85   9.254  -5.157  12.729
  688   1HD   LYS  85          1HD       LYS  85   7.946  -4.127  15.223
  689   2HD   LYS  85          2HD       LYS  85   9.511  -4.886  15.436
  690   1HE   LYS  85          1HE       LYS  85   9.741  -3.199  13.131
  691   2HE   LYS  85          2HE       LYS  85   8.900  -2.261  14.349
  692   1HZ   LYS  85          1HZ       LYS  85  11.302  -2.055  14.607
  693   2HZ   LYS  85          2HZ       LYS  85  10.699  -2.810  15.918
  694    H    ALA  86           H        ALA  86   4.403  -5.447  11.429
  695    HA   ALA  86           HA       ALA  86   2.706  -6.439  13.406
  696   1HB   ALA  86          1HB       ALA  86   1.962  -4.592  12.135
  697   2HB   ALA  86          2HB       ALA  86   2.333  -5.392  10.589
  698   3HB   ALA  86          3HB       ALA  86   0.950  -5.941  11.566
  699    H    MET  87           H        MET  87   4.023  -7.849  10.421
  700    HA   MET  87           HA       MET  87   2.437 -10.231  11.011
  701   1HB   MET  87          1HB       MET  87   2.677  -8.685   8.601
  702   2HB   MET  87          2HB       MET  87   3.560 -10.170   8.304
  703   1HG   MET  87          1HG       MET  87   1.515 -11.455   9.157
  704   2HG   MET  87          2HG       MET  87   0.652  -9.932   9.207
  705   1HE   MET  87          1HE       MET  87   0.870  -8.697   5.556
  706   2HE   MET  87          2HE       MET  87   1.195  -8.241   7.245
  707   3HE   MET  87          3HE       MET  87   2.518  -8.831   6.214
  708    H    ARG  88           H        ARG  88   5.200  -9.228  11.957
  709    HA   ARG  88           HA       ARG  88   7.354  -9.847  11.796
  710   1HB   ARG  88          1HB       ARG  88   5.695 -12.156  12.869
  711   2HB   ARG  88          2HB       ARG  88   7.441 -12.296  12.827
  712   1HG   ARG  88          1HG       ARG  88   7.601 -10.121  14.118
  713   2HG   ARG  88          2HG       ARG  88   5.852 -10.099  14.237
  714   1HD   ARG  88          1HD       ARG  88   6.235 -11.224  16.208
  715   2HD   ARG  88          2HD       ARG  88   6.323 -12.628  15.162
  716    HE   ARG  88           HE       ARG  88   8.914 -11.472  15.201
  717   1HH1  ARG  88          2HH2      ARG  88   6.697 -13.038  17.480
  718   2HH1  ARG  88          1HH2      ARG  88   7.967 -13.648  18.487
  719   1HH2  ARG  88          1HH       ARG  88  10.247 -13.187  17.910
  720    H    LEU  89           H        LEU  89   8.029  -9.886   9.580
  721    HA   LEU  89           HA       LEU  89   8.008 -12.574   8.398
  722   1HB   LEU  89          1HB       LEU  89   7.142 -11.866   6.483
  723   2HB   LEU  89          2HB       LEU  89   6.538 -10.522   7.432
  724    HG   LEU  89           HG       LEU  89   9.100 -10.511   5.812
  725   1HD1  LEU  89          1HD1      LEU  89   6.999 -10.607   4.466
  726   2HD1  LEU  89          2HD1      LEU  89   6.498  -9.078   5.228
  727   3HD1  LEU  89          3HD1      LEU  89   7.962  -9.131   4.219
  728   1HD2  LEU  89          1HD2      LEU  89   8.165  -7.894   6.469
  729   2HD2  LEU  89          2HD2      LEU  89   8.278  -8.849   7.967
  730   3HD2  LEU  89          3HD2      LEU  89   9.700  -8.682   6.909
  731    H    ARG  90           H        ARG  90   9.821 -12.756   6.669
  732    HA   ARG  90           HA       ARG  90  12.126 -11.347   7.758
  733   1HB   ARG  90          1HB       ARG  90  13.263 -13.523   6.566
  734   2HB   ARG  90          2HB       ARG  90  12.753 -13.518   8.242
  735   1HG   ARG  90          1HG       ARG  90  10.666 -14.614   7.722
  736   2HG   ARG  90          2HG       ARG  90  10.849 -14.316   6.004
  737   1HD   ARG  90          1HD       ARG  90  12.625 -15.929   5.797
  738   2HD   ARG  90          2HD       ARG  90  12.880 -15.996   7.530
  739    HE   ARG  90           HE       ARG  90  10.805 -17.407   6.012
  740   1HH1  ARG  90          2HH2      ARG  90  11.753 -16.231   9.216
  741   2HH1  ARG  90          1HH2      ARG  90  10.746 -17.355  10.064
  742   1HH2  ARG  90          1HH       ARG  90   9.414 -18.911   8.818
  743    H    ILE  91           H        ILE  91  10.494 -12.695   4.843
  744    HA   ILE  91           HA       ILE  91  12.235 -12.251   2.865
  745    HB   ILE  91           HB       ILE  91  10.200 -11.555   1.498
  746   1HG1  ILE  91          1HG1      ILE  91   8.426 -12.433   3.696
  747   2HG1  ILE  91          2HG1      ILE  91   9.127 -10.840   3.907
  748   1HG2  ILE  91          1HG2      ILE  91  10.485 -14.109   3.054
  749   2HG2  ILE  91          2HG2      ILE  91   9.118 -13.879   1.939
  750   3HG2  ILE  91          3HG2      ILE  91  10.788 -13.788   1.332
  751   1HD1  ILE  91          1HD1      ILE  91   7.835  -9.940   2.266
  752   2HD1  ILE  91          2HD1      ILE  91   8.199 -11.274   1.145
  753   3HD1  ILE  91          3HD1      ILE  91   6.892 -11.449   2.342
  754    H    VAL  92           H        VAL  92  10.628  -9.785   4.861
  755    HA   VAL  92           HA       VAL  92  10.532  -7.520   4.481
  756    HB   VAL  92           HB       VAL  92  13.411  -8.283   4.994
  757   1HG1  VAL  92          1HG1      VAL  92  13.189  -5.869   6.171
  758   2HG1  VAL  92          2HG1      VAL  92  13.793  -6.094   4.511
  759   3HG1  VAL  92          3HG1      VAL  92  12.099  -5.622   4.786
  760   1HG2  VAL  92          1HG2      VAL  92  11.242  -7.411   6.929
  761   2HG2  VAL  92          2HG2      VAL  92  11.696  -9.103   6.616
  762   3HG2  VAL  92          3HG2      VAL  92  12.880  -7.982   7.328
  763    HA   PRO  93           HA       PRO  93  12.044  -7.522   0.163
  764   1HB   PRO  93          1HB       PRO  93   9.644  -7.464  -1.143
  765   2HB   PRO  93          2HB       PRO  93  10.552  -8.939  -0.871
  766   1HG   PRO  93          1HG       PRO  93   8.114  -7.985   0.500
  767   2HG   PRO  93          2HG       PRO  93   8.782  -9.603   0.449
  768   1HD   PRO  93          1HD       PRO  93   8.937  -7.752   2.634
  769   2HD   PRO  93          2HD       PRO  93   9.702  -9.325   2.536
  770    H    GLU  94           H        GLU  94  12.223  -5.781  -1.325
  771    HA   GLU  94           HA       GLU  94  11.816  -3.356   0.001
  772   1HB   GLU  94          1HB       GLU  94  13.418  -4.201  -2.050
  773   2HB   GLU  94          2HB       GLU  94  12.207  -3.321  -2.961
  774   1HG   GLU  94          1HG       GLU  94  12.576  -1.304  -1.567
  775   2HG   GLU  94          2HG       GLU  94  13.717  -2.177  -0.563
  776    HE2  GLU  94           HE       GLU  94  15.579  -0.949  -1.257
  777    H    LEU  95           H        LEU  95   9.409  -3.801   0.434
  778    HA   LEU  95           HA       LEU  95   7.620  -3.622  -1.762
  779   1HB   LEU  95          1HB       LEU  95   7.424  -4.531   0.750
  780   2HB   LEU  95          2HB       LEU  95   6.756  -2.930   0.995
  781    HG   LEU  95           HG       LEU  95   5.571  -4.145  -1.348
  782   1HD1  LEU  95          1HD1      LEU  95   6.278  -6.198   0.084
  783   2HD1  LEU  95          2HD1      LEU  95   4.932  -5.704   1.140
  784   3HD1  LEU  95          3HD1      LEU  95   4.625  -6.105  -0.568
  785   1HD2  LEU  95          1HD2      LEU  95   4.381  -2.402  -0.409
  786   2HD2  LEU  95          2HD2      LEU  95   3.494  -3.823   0.193
  787   3HD2  LEU  95          3HD2      LEU  95   4.642  -2.975   1.256
  788    H    THR  96           H        THR  96   8.187  -1.793  -3.005
  789    HA   THR  96           HA       THR  96   8.533   0.762  -1.831
  790    HB   THR  96           HB       THR  96   9.245  -0.327  -4.176
  791    HG1  THR  96           HG1      THR  96   8.187   2.396  -4.002
  792   1HG2  THR  96          1HG2      THR  96   7.845   0.303  -6.013
  793   2HG2  THR  96          2HG2      THR  96   6.710  -0.427  -4.853
  794   3HG2  THR  96          3HG2      THR  96   6.830   1.344  -4.987
  795    H    PHE  97           H        PHE  97   7.135   2.690  -2.447
  796    HA   PHE  97           HA       PHE  97   4.325   1.891  -2.134
  797   1HB   PHE  97          1HB       PHE  97   5.999   3.284  -0.381
  798   2HB   PHE  97          2HB       PHE  97   5.303   4.609  -1.292
  799    HD1  PHE  97           HD1      PHE  97   4.077   5.544   0.533
  800    HD2  PHE  97           HD2      PHE  97   3.471   1.495  -0.578
  801    HE1  PHE  97           HE1      PHE  97   2.023   5.457   1.974
  802    HE2  PHE  97           HE2      PHE  97   1.418   1.406   0.861
  803    HZ   PHE  97           HZ       PHE  97   0.719   3.388   2.122
  804    H    PHE  98           H        PHE  98   3.207   2.291  -3.983
  805    HA   PHE  98           HA       PHE  98   4.086   4.571  -5.597
  806   1HB   PHE  98          1HB       PHE  98   3.227   1.811  -6.052
  807   2HB   PHE  98          2HB       PHE  98   2.077   2.875  -6.835
  808    HD1  PHE  98           HD1      PHE  98   3.474   4.976  -8.034
  809    HD2  PHE  98           HD2      PHE  98   4.811   0.985  -7.493
  810    HE1  PHE  98           HE1      PHE  98   5.040   5.237  -9.978
  811    HE2  PHE  98           HE2      PHE  98   6.376   1.247  -9.436
  812    HZ   PHE  98           HZ       PHE  98   6.473   3.368 -10.656
  813    H    TYR  99           H        TYR  99   2.905   6.405  -5.363
  814    HA   TYR  99           HA       TYR  99   0.189   6.164  -4.341
  815   1HB   TYR  99          1HB       TYR  99   1.656   8.724  -5.098
  816   2HB   TYR  99          2HB       TYR  99   0.577   8.464  -3.741
  817    HD1  TYR  99           HD1      TYR  99   1.397   7.617  -1.627
  818    HD2  TYR  99           HD2      TYR  99   4.022   7.987  -4.985
  819    HE1  TYR  99           HE1      TYR  99   3.406   7.294  -0.102
  820    HE2  TYR  99           HE2      TYR  99   6.021   7.661  -3.449
  821    HH   TYR  99           HH       TYR  99   6.706   7.386  -1.424
  822    H    ASP 100           H        ASP 100  -1.401   5.866  -5.829
  823    HA   ASP 100           HA       ASP 100  -1.055   7.279  -8.354
  824   1HB   ASP 100          1HB       ASP 100  -1.762   4.576  -7.748
  825   2HB   ASP 100          2HB       ASP 100  -3.227   5.330  -8.343
  826    HD2  ASP 100           HD       ASP 100  -0.141   5.264 -10.915
  827    H    ASN 101           H        ASN 101  -2.010   9.291  -7.575
  828    HA   ASN 101           HA       ASN 101  -4.683   9.065  -6.492
  829   1HB   ASN 101          1HB       ASN 101  -4.350  11.635  -6.221
  830   2HB   ASN 101          2HB       ASN 101  -3.355  10.598  -5.219
  831   1HD2  ASN 101          1HD2      ASN 101  -1.420  11.408  -5.020
  832   2HD2  ASN 101          2HD2      ASN 101  -0.432  12.096  -6.267
  833    H    SER 102           H        SER 102  -5.874  11.441  -7.342
  834    HA   SER 102           HA       SER 102  -6.209  10.888 -10.143
  835   1HB   SER 102          1HB       SER 102  -8.322  11.158  -9.269
  836   2HB   SER 102          2HB       SER 102  -7.779  12.225  -7.990
  837    HG   SER 102           HG       SER 102  -8.593  13.797  -9.190
  838    H    LEU 103           H        LEU 103  -3.827  12.396  -8.754
  839    HA   LEU 103           HA       LEU 103  -4.084  14.946 -10.163
  840   1HB   LEU 103          1HB       LEU 103  -3.501  14.896  -7.740
  841   2HB   LEU 103          2HB       LEU 103  -2.018  14.056  -8.148
  842    HG   LEU 103           HG       LEU 103  -1.953  16.297  -9.794
  843   1HD1  LEU 103          1HD1      LEU 103  -3.059  18.008  -8.917
  844   2HD1  LEU 103          2HD1      LEU 103  -3.823  16.878  -7.774
  845   3HD1  LEU 103          3HD1      LEU 103  -2.327  17.727  -7.319
  846   1HD2  LEU 103          1HD2      LEU 103   0.089  15.918  -8.952
  847   2HD2  LEU 103          2HD2      LEU 103  -0.410  17.038  -7.662
  848   3HD2  LEU 103          3HD2      LEU 103  -0.549  15.281  -7.417
  849    H    VAL 104           H        VAL 104  -3.269  11.866 -10.914
  850    HA   VAL 104           HA       VAL 104  -1.180  12.794 -12.751
  851    HB   VAL 104           HB       VAL 104  -1.177  10.477 -10.865
  852   1HG1  VAL 104          1HG1      VAL 104   0.574   9.366 -12.260
  853   2HG1  VAL 104          2HG1      VAL 104  -1.050   9.337 -12.989
  854   3HG1  VAL 104          3HG1      VAL 104   0.172  10.486 -13.584
  855   1HG2  VAL 104          1HG2      VAL 104   0.617  11.522 -10.048
  856   2HG2  VAL 104          2HG2      VAL 104   1.397  11.539 -11.648
  857   3HG2  VAL 104          3HG2      VAL 104   0.298  12.858 -11.179
  858    H    GLU 105           H        GLU 105  -4.301  11.767 -12.363
  859    HA   GLU 105           HA       GLU 105  -4.330  10.801 -15.072
  860   1HB   GLU 105          1HB       GLU 105  -5.857   9.202 -13.004
  861   2HB   GLU 105          2HB       GLU 105  -5.440   8.748 -14.644
  862   1HG   GLU 105          1HG       GLU 105  -2.956   8.888 -13.870
  863   2HG   GLU 105          2HG       GLU 105  -3.587   8.935 -12.236
  864    HE2  GLU 105           HE       GLU 105  -2.463   6.767 -12.144
  865    H    GLY 106           H        GLY 106  -6.083  11.752 -12.076
  866   1HA   GLY 106          1HA       GLY 106  -7.722  13.354 -11.935
  867   2HA   GLY 106          2HA       GLY 106  -7.907  13.350 -13.678
  868    H    MET 107           H        MET 107  -7.774  10.137 -12.464
  869    HA   MET 107           HA       MET 107 -10.661  10.066 -12.130
  870   1HB   MET 107          1HB       MET 107  -8.989   8.186 -13.892
  871   2HB   MET 107          2HB       MET 107 -10.704   7.995 -13.583
  872   1HG   MET 107          1HG       MET 107 -11.268   9.580 -15.130
  873   2HG   MET 107          2HG       MET 107 -10.078  10.715 -14.526
  874   1HE   MET 107          1HE       MET 107  -7.654   9.769 -14.449
  875   2HE   MET 107          2HE       MET 107  -7.283   8.228 -15.257
  876   3HE   MET 107          3HE       MET 107  -6.836   9.767 -16.031
  877    H    ARG 108           H        ARG 108  -7.970   9.773 -10.509
  878    HA   ARG 108           HA       ARG 108  -8.481   7.099  -9.512
  879   1HB   ARG 108          1HB       ARG 108  -6.090   8.728  -9.871
  880   2HB   ARG 108          2HB       ARG 108  -6.229   8.279  -8.182
  881   1HG   ARG 108          1HG       ARG 108  -5.188   6.355  -8.888
  882   2HG   ARG 108          2HG       ARG 108  -6.820   5.870  -9.304
  883   1HD   ARG 108          1HD       ARG 108  -5.871   7.427 -11.511
  884   2HD   ARG 108          2HD       ARG 108  -4.556   6.353 -11.073
  885    HE   ARG 108           HE       ARG 108  -7.222   5.553 -12.072
  886   1HH1  ARG 108          2HH2      ARG 108  -4.156   4.504 -10.642
  887   2HH1  ARG 108          1HH2      ARG 108  -4.352   2.852 -11.125
  888   1HH2  ARG 108          1HH       ARG 108  -6.317   2.210 -12.340
  Start of MODEL    7
    1    H    MET   1           H        MET   1 -15.026 -10.625  -2.227
    2    HA   MET   1           HA       MET   1 -13.386 -10.593  -3.801
    3   1HB   MET   1          1HB       MET   1 -12.085  -8.353  -3.266
    4   2HB   MET   1          2HB       MET   1 -13.831  -8.284  -3.407
    5   1HG   MET   1          1HG       MET   1 -14.005  -8.543  -0.894
    6   2HG   MET   1          2HG       MET   1 -12.257  -8.500  -0.794
    7   1HE   MET   1          1HE       MET   1 -14.419  -5.050   0.127
    8   2HE   MET   1          2HE       MET   1 -14.842  -6.776   0.232
    9   3HE   MET   1          3HE       MET   1 -13.335  -6.183   0.970
   10    H    ALA   2           H        ALA   2 -12.159 -12.585  -3.357
   11    HA   ALA   2           HA       ALA   2  -9.429 -11.973  -2.728
   12   1HB   ALA   2          1HB       ALA   2 -11.228 -13.275  -0.769
   13   2HB   ALA   2          2HB       ALA   2  -9.711 -14.152  -1.081
   14   3HB   ALA   2          3HB       ALA   2  -9.665 -12.461  -0.523
   15    H    LYS   3           H        LYS   3  -8.370 -14.512  -2.571
   16    HA   LYS   3           HA       LYS   3  -9.635 -16.109  -4.632
   17   1HB   LYS   3          1HB       LYS   3  -8.130 -14.353  -5.735
   18   2HB   LYS   3          2HB       LYS   3  -6.777 -15.202  -5.016
   19   1HG   LYS   3          1HG       LYS   3  -6.849 -16.434  -6.952
   20   2HG   LYS   3          2HG       LYS   3  -8.096 -17.330  -6.105
   21   1HD   LYS   3          1HD       LYS   3  -9.211 -14.931  -7.376
   22   2HD   LYS   3          2HD       LYS   3  -8.377 -15.930  -8.549
   23   1HE   LYS   3          1HE       LYS   3  -9.689 -17.926  -7.753
   24   2HE   LYS   3          2HE       LYS   3 -10.547 -16.895  -6.626
   25   1HZ   LYS   3          1HZ       LYS   3 -10.930 -17.153  -9.462
   26   2HZ   LYS   3          2HZ       LYS   3 -11.959 -16.571  -8.342
   27    H    GLU   4           H        GLU   4  -9.976 -17.606  -2.909
   28    HA   GLU   4           HA       GLU   4  -7.701 -18.464  -1.423
   29   1HB   GLU   4          1HB       GLU   4  -9.352 -20.109  -0.438
   30   2HB   GLU   4          2HB       GLU   4  -9.822 -18.430  -0.275
   31   1HG   GLU   4          1HG       GLU   4 -10.838 -19.371  -2.804
   32   2HG   GLU   4          2HG       GLU   4 -11.248 -20.569  -1.592
   33    HE2  GLU   4           HE       GLU   4 -12.931 -17.374  -2.365
   34    H    PHE   5           H        PHE   5  -6.250 -19.254  -3.066
   35    HA   PHE   5           HA       PHE   5  -6.962 -21.936  -3.933
   36   1HB   PHE   5          1HB       PHE   5  -7.265 -19.792  -5.638
   37   2HB   PHE   5          2HB       PHE   5  -5.551 -20.077  -5.867
   38    HD1  PHE   5           HD1      PHE   5  -4.770 -21.948  -7.123
   39    HD2  PHE   5           HD2      PHE   5  -8.899 -21.575  -6.223
   40    HE1  PHE   5           HE1      PHE   5  -5.293 -23.768  -8.771
   41    HE2  PHE   5           HE2      PHE   5  -9.423 -23.395  -7.871
   42    HZ   PHE   5           HZ       PHE   5  -7.614 -24.469  -9.126
   43    H    GLY   6           H        GLY   6  -5.225 -23.347  -3.882
   44   1HA   GLY   6          1HA       GLY   6  -3.048 -22.974  -2.371
   45   2HA   GLY   6          2HA       GLY   6  -3.067 -24.042  -3.760
   46    H    ARG   7           H        ARG   7  -3.576 -21.643  -5.621
   47    HA   ARG   7           HA       ARG   7  -0.978 -21.264  -6.371
   48   1HB   ARG   7          1HB       ARG   7  -3.606 -20.335  -7.174
   49   2HB   ARG   7          2HB       ARG   7  -2.511 -18.967  -7.202
   50   1HG   ARG   7          1HG       ARG   7  -0.895 -20.756  -8.419
   51   2HG   ARG   7          2HG       ARG   7  -2.425 -21.507  -8.823
   52   1HD   ARG   7          1HD       ARG   7  -2.884 -19.922 -10.393
   53   2HD   ARG   7          2HD       ARG   7  -2.581 -18.619  -9.262
   54    HE   ARG   7           HE       ARG   7  -0.053 -19.697  -9.977
   55   1HH1  ARG   7          2HH2      ARG   7  -2.721 -17.970 -11.542
   56   2HH1  ARG   7          1HH2      ARG   7  -1.708 -17.229 -12.735
   57   1HH2  ARG   7          1HH       ARG   7   0.646 -17.683 -12.719
   58    HA   PRO   8           HA       PRO   8   0.396 -17.755  -4.146
   59   1HB   PRO   8          1HB       PRO   8   1.365 -15.960  -5.963
   60   2HB   PRO   8          2HB       PRO   8   2.243 -17.393  -5.471
   61   1HG   PRO   8          1HG       PRO   8   0.800 -16.883  -8.000
   62   2HG   PRO   8          2HG       PRO   8   2.015 -18.097  -7.655
   63   1HD   PRO   8          1HD       PRO   8  -0.817 -18.510  -7.857
   64   2HD   PRO   8          2HD       PRO   8   0.386 -19.700  -7.399
   65    H    GLN   9           H        GLN   9  -2.392 -17.574  -5.705
   66    HA   GLN   9           HA       GLN   9  -2.810 -14.778  -5.466
   67   1HB   GLN   9          1HB       GLN   9  -4.032 -16.859  -6.856
   68   2HB   GLN   9          2HB       GLN   9  -5.213 -16.497  -5.614
   69   1HG   GLN   9          1HG       GLN   9  -5.607 -14.339  -6.406
   70   2HG   GLN   9          2HG       GLN   9  -3.980 -14.149  -7.030
   71   1HE2  GLN   9          1HE2      GLN   9  -6.113 -13.387  -8.517
   72   2HE2  GLN   9          2HE2      GLN   9  -6.334 -14.423  -9.886
   73    H    ARG  10           H        ARG  10  -3.567 -17.731  -3.562
   74    HA   ARG  10           HA       ARG  10  -5.321 -16.596  -1.797
   75   1HB   ARG  10          1HB       ARG  10  -4.633 -19.074  -2.068
   76   2HB   ARG  10          2HB       ARG  10  -3.238 -18.711  -1.072
   77   1HG   ARG  10          1HG       ARG  10  -6.013 -17.969  -0.098
   78   2HG   ARG  10          2HG       ARG  10  -5.453 -19.623   0.054
   79   1HD   ARG  10          1HD       ARG  10  -3.318 -17.909   0.959
   80   2HD   ARG  10          2HD       ARG  10  -4.796 -17.349   1.716
   81    HE   ARG  10           HE       ARG  10  -4.980 -20.063   2.072
   82   1HH1  ARG  10          2HH2      ARG  10  -2.365 -17.763   2.721
   83   2HH1  ARG  10          1HH2      ARG  10  -1.718 -18.679   4.041
   84   1HH2  ARG  10          1HH       ARG  10  -2.771 -20.740   4.666
   85    H    VAL  11           H        VAL  11  -1.708 -16.790  -1.746
   86    HA   VAL  11           HA       VAL  11  -1.510 -15.507   0.794
   87    HB   VAL  11           HB       VAL  11   0.419 -16.280  -1.385
   88   1HG1  VAL  11          1HG1      VAL  11   2.271 -15.501  -0.078
   89   2HG1  VAL  11          2HG1      VAL  11   1.142 -14.137  -0.272
   90   3HG1  VAL  11          3HG1      VAL  11   1.202 -15.030   1.266
   91   1HG2  VAL  11          1HG2      VAL  11   1.279 -17.795   0.412
   92   2HG2  VAL  11          2HG2      VAL  11  -0.066 -17.258   1.448
   93   3HG2  VAL  11          3HG2      VAL  11  -0.402 -18.127  -0.069
   94    H    ALA  12           H        ALA  12  -1.530 -14.530  -2.642
   95    HA   ALA  12           HA       ALA  12  -0.510 -11.953  -2.285
   96   1HB   ALA  12          1HB       ALA  12  -2.432 -13.131  -4.332
   97   2HB   ALA  12          2HB       ALA  12  -1.654 -11.535  -4.480
   98   3HB   ALA  12          3HB       ALA  12  -0.661 -13.014  -4.468
   99    H    GLN  13           H        GLN  13  -3.873 -13.283  -2.179
  100    HA   GLN  13           HA       GLN  13  -5.052 -10.781  -1.792
  101   1HB   GLN  13          1HB       GLN  13  -6.047 -13.582  -1.105
  102   2HB   GLN  13          2HB       GLN  13  -7.051 -12.145  -1.074
  103   1HG   GLN  13          1HG       GLN  13  -6.001 -13.675  -3.410
  104   2HG   GLN  13          2HG       GLN  13  -7.503 -12.789  -3.243
  105   1HE2  GLN  13          1HE2      GLN  13  -7.078 -10.325  -2.828
  106   2HE2  GLN  13          2HE2      GLN  13  -6.022  -9.555  -3.965
  107    H    GLU  14           H        GLU  14  -4.644 -13.531   0.565
  108    HA   GLU  14           HA       GLU  14  -5.428 -12.346   2.795
  109   1HB   GLU  14          1HB       GLU  14  -3.333 -14.378   2.164
  110   2HB   GLU  14          2HB       GLU  14  -3.236 -13.674   3.768
  111   1HG   GLU  14          1HG       GLU  14  -5.964 -14.516   2.834
  112   2HG   GLU  14          2HG       GLU  14  -4.826 -15.802   3.182
  113    HE2  GLU  14           HE       GLU  14  -6.805 -13.429   4.999
  114    H    MET  15           H        MET  15  -2.249 -11.855   1.172
  115    HA   MET  15           HA       MET  15  -1.288 -10.189   3.248
  116   1HB   MET  15          1HB       MET  15  -0.427 -11.046   0.475
  117   2HB   MET  15          2HB       MET  15   0.333  -9.610   1.132
  118   1HG   MET  15          1HG       MET  15   1.166 -10.830   3.069
  119   2HG   MET  15          2HG       MET  15   0.193 -12.237   2.681
  120   1HE   MET  15          1HE       MET  15   4.364 -11.455   1.523
  121   2HE   MET  15          2HE       MET  15   3.342 -10.027   1.232
  122   3HE   MET  15          3HE       MET  15   3.337 -10.813   2.828
  123    H    GLN  16           H        GLN  16  -2.965  -9.723   0.117
  124    HA   GLN  16           HA       GLN  16  -2.490  -6.991  -0.075
  125   1HB   GLN  16          1HB       GLN  16  -3.338  -8.571  -1.890
  126   2HB   GLN  16          2HB       GLN  16  -4.918  -8.501  -1.133
  127   1HG   GLN  16          1HG       GLN  16  -3.956  -5.793  -1.420
  128   2HG   GLN  16          2HG       GLN  16  -3.721  -6.608  -2.952
  129   1HE2  GLN  16          1HE2      GLN  16  -5.347  -4.962  -3.558
  130   2HE2  GLN  16          2HE2      GLN  16  -7.028  -5.362  -3.436
  131    H    LYS  17           H        LYS  17  -4.890  -8.935   1.709
  132    HA   LYS  17           HA       LYS  17  -6.537  -6.678   2.321
  133   1HB   LYS  17          1HB       LYS  17  -7.092  -9.262   2.155
  134   2HB   LYS  17          2HB       LYS  17  -6.635  -9.256   3.847
  135   1HG   LYS  17          1HG       LYS  17  -8.257  -7.001   3.690
  136   2HG   LYS  17          2HG       LYS  17  -9.021  -8.071   2.530
  137   1HD   LYS  17          1HD       LYS  17 -10.061  -8.574   4.628
  138   2HD   LYS  17          2HD       LYS  17  -8.955  -9.902   4.332
  139   1HE   LYS  17          1HE       LYS  17  -7.252  -8.837   5.807
  140   2HE   LYS  17          2HE       LYS  17  -8.317  -7.470   6.073
  141   1HZ   LYS  17          1HZ       LYS  17  -9.544 -10.025   6.644
  142   2HZ   LYS  17          2HZ       LYS  17  -8.282  -9.685   7.616
  143    H    GLU  18           H        GLU  18  -3.952  -8.592   3.944
  144    HA   GLU  18           HA       GLU  18  -4.202  -7.254   6.379
  145   1HB   GLU  18          1HB       GLU  18  -3.060  -9.490   5.951
  146   2HB   GLU  18          2HB       GLU  18  -1.713  -8.609   5.261
  147   1HG   GLU  18          1HG       GLU  18  -0.988  -8.806   7.469
  148   2HG   GLU  18          2HG       GLU  18  -1.792  -7.250   7.547
  149    HE2  GLU  18           HE       GLU  18  -2.736  -9.689  10.136
  150    H    ILE  19           H        ILE  19  -2.216  -6.706   3.429
  151    HA   ILE  19           HA       ILE  19  -0.731  -4.579   4.605
  152    HB   ILE  19           HB       ILE  19   0.230  -4.308   2.457
  153   1HG1  ILE  19          1HG1      ILE  19  -2.151  -5.863   1.424
  154   2HG1  ILE  19          2HG1      ILE  19  -1.671  -4.227   1.019
  155   1HG2  ILE  19          1HG2      ILE  19   1.387  -6.130   2.985
  156   2HG2  ILE  19          2HG2      ILE  19  -0.044  -6.922   3.688
  157   3HG2  ILE  19          3HG2      ILE  19   0.277  -7.051   1.941
  158   1HD1  ILE  19          1HD1      ILE  19  -0.490  -6.838   0.106
  159   2HD1  ILE  19          2HD1      ILE  19  -0.802  -5.350  -0.818
  160   3HD1  ILE  19          3HD1      ILE  19   0.604  -5.444   0.270
  161    H    ALA  20           H        ALA  20  -3.526  -4.814   2.315
  162    HA   ALA  20           HA       ALA  20  -3.857  -2.127   1.846
  163   1HB   ALA  20          1HB       ALA  20  -5.069  -3.808   0.605
  164   2HB   ALA  20          2HB       ALA  20  -5.866  -4.399   2.082
  165   3HB   ALA  20          3HB       ALA  20  -6.265  -2.787   1.441
  166    H    LEU  21           H        LEU  21  -4.777  -4.121   4.676
  167    HA   LEU  21           HA       LEU  21  -6.392  -2.119   5.858
  168   1HB   LEU  21          1HB       LEU  21  -6.702  -4.442   6.377
  169   2HB   LEU  21          2HB       LEU  21  -5.049  -4.595   6.941
  170    HG   LEU  21           HG       LEU  21  -6.109  -2.556   8.528
  171   1HD1  LEU  21          1HD1      LEU  21  -8.342  -3.522   7.488
  172   2HD1  LEU  21          2HD1      LEU  21  -8.114  -4.759   8.747
  173   3HD1  LEU  21          3HD1      LEU  21  -8.237  -3.042   9.199
  174   1HD2  LEU  21          1HD2      LEU  21  -5.676  -3.999  10.318
  175   2HD2  LEU  21          2HD2      LEU  21  -6.046  -5.453   9.361
  176   3HD2  LEU  21          3HD2      LEU  21  -4.556  -4.533   9.041
  177    H    ILE  22           H        ILE  22  -3.064  -3.338   6.680
  178    HA   ILE  22           HA       ILE  22  -2.523  -1.330   8.515
  179    HB   ILE  22           HB       ILE  22  -0.642  -2.935   6.780
  180   1HG1  ILE  22          1HG1      ILE  22  -1.436  -3.514   9.637
  181   2HG1  ILE  22          2HG1      ILE  22  -2.346  -4.151   8.281
  182   1HG2  ILE  22          1HG2      ILE  22  -0.038  -1.566   9.411
  183   2HG2  ILE  22          2HG2      ILE  22   1.094  -2.413   8.329
  184   3HG2  ILE  22          3HG2      ILE  22   0.353  -0.878   7.816
  185   1HD1  ILE  22          1HD1      ILE  22  -0.363  -5.288   7.397
  186   2HD1  ILE  22          2HD1      ILE  22   0.662  -4.531   8.641
  187   3HD1  ILE  22          3HD1      ILE  22  -0.569  -5.728   9.110
  188    H    LEU  23           H        LEU  23  -2.752  -1.254   5.037
  189    HA   LEU  23           HA       LEU  23  -1.124   1.132   4.837
  190   1HB   LEU  23          1HB       LEU  23  -1.252  -0.814   3.161
  191   2HB   LEU  23          2HB       LEU  23  -2.780  -0.118   2.660
  192    HG   LEU  23           HG       LEU  23  -1.582   2.030   2.167
  193   1HD1  LEU  23          1HD1      LEU  23   0.741   0.408   3.117
  194   2HD1  LEU  23          2HD1      LEU  23   0.993   1.554   1.778
  195   3HD1  LEU  23          3HD1      LEU  23   0.374   2.136   3.340
  196   1HD2  LEU  23          1HD2      LEU  23  -0.837   1.353   0.032
  197   2HD2  LEU  23          2HD2      LEU  23  -0.419  -0.280   0.605
  198   3HD2  LEU  23          3HD2      LEU  23  -2.127   0.210   0.482
  199    H    GLN  24           H        GLN  24  -4.380   0.228   5.563
  200    HA   GLN  24           HA       GLN  24  -5.243   2.923   4.857
  201   1HB   GLN  24          1HB       GLN  24  -6.531   0.274   4.657
  202   2HB   GLN  24          2HB       GLN  24  -7.554   1.462   5.440
  203   1HG   GLN  24          1HG       GLN  24  -7.098   3.046   3.506
  204   2HG   GLN  24          2HG       GLN  24  -6.210   1.760   2.712
  205   1HE2  GLN  24          1HE2      GLN  24  -7.276   0.551   1.351
  206   2HE2  GLN  24          2HE2      GLN  24  -8.985   0.276   1.300
  207    H    ARG  25           H        ARG  25  -4.178   1.002   7.408
  208    HA   ARG  25           HA       ARG  25  -5.860   2.464   9.282
  209   1HB   ARG  25          1HB       ARG  25  -5.185  -0.316   9.128
  210   2HB   ARG  25          2HB       ARG  25  -4.338   0.310  10.528
  211   1HG   ARG  25          1HG       ARG  25  -6.428  -0.271  11.441
  212   2HG   ARG  25          2HG       ARG  25  -6.626   1.445  11.141
  213   1HD   ARG  25          1HD       ARG  25  -8.034   1.106   9.284
  214   2HD   ARG  25          2HD       ARG  25  -7.372  -0.478   8.932
  215    HE   ARG  25           HE       ARG  25  -8.807  -1.444  10.552
  216   1HH1  ARG  25          2HH2      ARG  25  -8.997   2.092  10.692
  217   2HH1  ARG  25          1HH2      ARG  25 -10.404   2.100  11.702
  218   1HH2  ARG  25          1HH       ARG  25 -11.367   0.016  12.391
  219    H    GLU  26           H        GLU  26  -2.538   1.004   8.924
  220    HA   GLU  26           HA       GLU  26  -1.452   2.627  10.931
  221   1HB   GLU  26          1HB       GLU  26   0.350   1.274  10.663
  222   2HB   GLU  26          2HB       GLU  26  -0.647   0.374   9.536
  223   1HG   GLU  26          1HG       GLU  26   1.281   0.830   8.256
  224   2HG   GLU  26          2HG       GLU  26   0.179   2.094   7.740
  225    HE2  GLU  26           HE       GLU  26   3.206   3.065  10.208
  226    H    ILE  27           H        ILE  27  -2.323   3.205   7.628
  227    HA   ILE  27           HA       ILE  27  -0.369   5.306   7.264
  228    HB   ILE  27           HB       ILE  27  -1.746   3.588   5.583
  229   1HG1  ILE  27          1HG1      ILE  27   0.086   5.929   5.258
  230   2HG1  ILE  27          2HG1      ILE  27   0.356   4.235   4.902
  231   1HG2  ILE  27          1HG2      ILE  27  -3.111   4.907   4.135
  232   2HG2  ILE  27          2HG2      ILE  27  -3.717   5.119   5.796
  233   3HG2  ILE  27          3HG2      ILE  27  -2.735   6.396   5.036
  234   1HD1  ILE  27          1HD1      ILE  27  -1.491   6.084   3.321
  235   2HD1  ILE  27          2HD1      ILE  27   0.139   5.575   2.819
  236   3HD1  ILE  27          3HD1      ILE  27  -1.169   4.373   2.949
  237    H    LYS  28           H        LYS  28  -1.529   7.425   6.196
  238    HA   LYS  28           HA       LYS  28  -3.327   8.316   8.324
  239   1HB   LYS  28          1HB       LYS  28  -2.637  10.590   7.622
  240   2HB   LYS  28          2HB       LYS  28  -1.301   9.599   8.167
  241   1HG   LYS  28          1HG       LYS  28  -1.615   9.154   5.334
  242   2HG   LYS  28          2HG       LYS  28  -1.644  10.886   5.606
  243   1HD   LYS  28          1HD       LYS  28   0.651  10.596   5.485
  244   2HD   LYS  28          2HD       LYS  28   0.445  10.323   7.203
  245   1HE   LYS  28          1HE       LYS  28   0.309   7.857   6.799
  246   2HE   LYS  28          2HE       LYS  28   0.501   8.126   5.079
  247   1HZ   LYS  28          1HZ       LYS  28   2.562   9.408   6.615
  248   2HZ   LYS  28          2HZ       LYS  28   2.548   7.796   6.849
  249    H    ASP  29           H        ASP  29  -5.068   7.006   7.220
  250    HA   ASP  29           HA       ASP  29  -5.906   8.026   4.690
  251   1HB   ASP  29          1HB       ASP  29  -6.668   5.880   4.676
  252   2HB   ASP  29          2HB       ASP  29  -6.483   5.732   6.413
  253    HD2  ASP  29           HD       ASP  29  -8.879   5.211   7.222
  254    HA   PRO  30           HA       PRO  30  -9.304   9.584   7.676
  255   1HB   PRO  30          1HB       PRO  30  -8.904   9.414  10.374
  256   2HB   PRO  30          2HB       PRO  30  -9.812   8.224   9.462
  257   1HG   PRO  30          1HG       PRO  30  -7.078   8.021  10.571
  258   2HG   PRO  30          2HG       PRO  30  -8.147   6.736  10.044
  259   1HD   PRO  30          1HD       PRO  30  -5.887   7.781   8.620
  260   2HD   PRO  30          2HD       PRO  30  -7.025   6.578   8.044
  261    H    ARG  31           H        ARG  31  -6.005  10.133   8.078
  262    HA   ARG  31           HA       ARG  31  -6.368  12.628   9.380
  263   1HB   ARG  31          1HB       ARG  31  -4.185  10.859   8.783
  264   2HB   ARG  31          2HB       ARG  31  -3.793  12.398   8.042
  265   1HG   ARG  31          1HG       ARG  31  -3.904  13.572  10.121
  266   2HG   ARG  31          2HG       ARG  31  -4.816  12.294  10.900
  267   1HD   ARG  31          1HD       ARG  31  -2.853  10.799  10.864
  268   2HD   ARG  31          2HD       ARG  31  -1.936  11.962   9.928
  269    HE   ARG  31           HE       ARG  31  -2.936  13.128  12.400
  270   1HH1  ARG  31          2HH2      ARG  31  -0.351  11.111  11.059
  271   2HH1  ARG  31          1HH2      ARG  31   0.772  11.491  12.322
  272   1HH2  ARG  31          1HH       ARG  31   0.101  12.975  14.080
  273    H    LEU  32           H        LEU  32  -5.689  11.423   6.046
  274    HA   LEU  32           HA       LEU  32  -5.374  14.021   4.944
  275   1HB   LEU  32          1HB       LEU  32  -5.963  11.376   3.605
  276   2HB   LEU  32          2HB       LEU  32  -5.445  12.844   2.800
  277    HG   LEU  32           HG       LEU  32  -3.726  11.685   4.972
  278   1HD1  LEU  32          1HD1      LEU  32  -4.452   9.876   3.290
  279   2HD1  LEU  32          2HD1      LEU  32  -3.441  10.757   2.121
  280   3HD1  LEU  32          3HD1      LEU  32  -2.714  10.092   3.604
  281   1HD2  LEU  32          1HD2      LEU  32  -2.775  12.918   2.408
  282   2HD2  LEU  32          2HD2      LEU  32  -3.406  13.951   3.713
  283   3HD2  LEU  32          3HD2      LEU  32  -2.009  12.889   4.014
  284    H    GLY  33           H        GLY  33  -8.092  11.992   5.838
  285   1HA   GLY  33          1HA       GLY  33 -10.273  12.679   5.994
  286   2HA   GLY  33          2HA       GLY  33  -9.916  14.097   5.027
  287    H    MET  34           H        MET  34  -8.899  10.833   4.005
  288    HA   MET  34           HA       MET  34 -11.178  10.660   2.242
  289   1HB   MET  34          1HB       MET  34  -8.255  10.908   1.380
  290   2HB   MET  34          2HB       MET  34  -9.433  10.134   0.340
  291   1HG   MET  34          1HG       MET  34  -9.577  12.335  -0.434
  292   2HG   MET  34          2HG       MET  34 -10.852  12.345   0.766
  293   1HE   MET  34          1HE       MET  34  -7.119  14.626   0.425
  294   2HE   MET  34          2HE       MET  34  -6.610  13.099   1.186
  295   3HE   MET  34          3HE       MET  34  -7.524  13.072  -0.342
  296    H    MET  35           H        MET  35 -10.919   8.489   0.856
  297    HA   MET  35           HA       MET  35  -9.827   6.515   2.710
  298   1HB   MET  35          1HB       MET  35 -12.453   6.805   2.090
  299   2HB   MET  35          2HB       MET  35 -11.993   5.853   0.693
  300   1HG   MET  35          1HG       MET  35 -11.014   4.110   2.235
  301   2HG   MET  35          2HG       MET  35 -11.556   5.050   3.610
  302   1HE   MET  35          1HE       MET  35 -13.372   5.161   4.558
  303   2HE   MET  35          2HE       MET  35 -15.027   4.927   3.945
  304   3HE   MET  35          3HE       MET  35 -14.136   3.556   4.648
  305    H    THR  36           H        THR  36  -7.887   5.834   1.868
  306    HA   THR  36           HA       THR  36  -7.408   5.831  -0.946
  307    HB   THR  36           HB       THR  36  -5.216   4.830  -0.162
  308    HG1  THR  36           HG1      THR  36  -5.870   3.629   1.656
  309   1HG2  THR  36          1HG2      THR  36  -5.874   6.936   1.901
  310   2HG2  THR  36          2HG2      THR  36  -4.428   6.780   0.875
  311   3HG2  THR  36          3HG2      THR  36  -5.944   7.406   0.186
  312    H    THR  37           H        THR  37  -6.757   3.935  -2.220
  313    HA   THR  37           HA       THR  37  -8.011   1.455  -1.281
  314    HB   THR  37           HB       THR  37  -8.628   3.070  -3.789
  315    HG1  THR  37           HG1      THR  37 -10.057   1.544  -1.726
  316   1HG2  THR  37          1HG2      THR  37  -8.217   0.806  -4.651
  317   2HG2  THR  37          2HG2      THR  37  -9.086   0.086  -3.274
  318   3HG2  THR  37          3HG2      THR  37  -9.975   1.028  -4.494
  319    H    VAL  38           H        VAL  38  -7.333  -0.461  -2.586
  320    HA   VAL  38           HA       VAL  38  -4.585  -0.026  -3.533
  321    HB   VAL  38           HB       VAL  38  -5.814  -2.422  -2.154
  322   1HG1  VAL  38          1HG1      VAL  38  -2.882  -2.050  -2.772
  323   2HG1  VAL  38          2HG1      VAL  38  -3.759  -3.536  -2.333
  324   3HG1  VAL  38          3HG1      VAL  38  -3.988  -2.810  -3.941
  325   1HG2  VAL  38          1HG2      VAL  38  -5.372  -1.287  -0.277
  326   2HG2  VAL  38          2HG2      VAL  38  -3.647  -1.512  -0.659
  327   3HG2  VAL  38          3HG2      VAL  38  -4.483  -0.022  -1.159
  328    H    SER  39           H        SER  39  -5.199   0.356  -5.718
  329    HA   SER  39           HA       SER  39  -6.803  -1.678  -6.968
  330   1HB   SER  39          1HB       SER  39  -6.387   1.077  -7.398
  331   2HB   SER  39          2HB       SER  39  -5.599   0.311  -8.763
  332    HG   SER  39           HG       SER  39  -8.350   0.328  -8.030
  333    H    GLY  40           H        GLY  40  -4.002  -2.178  -5.852
  334   1HA   GLY  40          1HA       GLY  40  -3.045  -3.801  -7.969
  335   2HA   GLY  40          2HA       GLY  40  -2.077  -2.346  -7.845
  336    H    VAL  41           H        VAL  41  -1.672  -5.363  -7.127
  337    HA   VAL  41           HA       VAL  41  -0.251  -4.789  -4.675
  338    HB   VAL  41           HB       VAL  41  -2.333  -5.442  -3.748
  339   1HG1  VAL  41          1HG1      VAL  41  -2.478  -7.178  -6.083
  340   2HG1  VAL  41          2HG1      VAL  41  -2.879  -8.052  -4.584
  341   3HG1  VAL  41          3HG1      VAL  41  -3.777  -6.579  -5.023
  342   1HG2  VAL  41          1HG2      VAL  41  -1.160  -8.120  -3.481
  343   2HG2  VAL  41          2HG2      VAL  41   0.018  -6.805  -3.261
  344   3HG2  VAL  41          3HG2      VAL  41  -1.447  -6.864  -2.253
  345    H    GLU  42           H        GLU  42   1.749  -5.665  -4.848
  346    HA   GLU  42           HA       GLU  42   1.981  -8.104  -6.397
  347   1HB   GLU  42          1HB       GLU  42   3.652  -5.595  -6.852
  348   2HB   GLU  42          2HB       GLU  42   4.047  -7.165  -7.521
  349   1HG   GLU  42          1HG       GLU  42   1.237  -6.401  -8.027
  350   2HG   GLU  42          2HG       GLU  42   2.373  -5.247  -8.697
  351    HE2  GLU  42           HE       GLU  42   1.832  -7.050 -11.249
  352    H    MET  43           H        MET  43   3.513  -9.551  -5.572
  353    HA   MET  43           HA       MET  43   5.283  -8.507  -3.526
  354   1HB   MET  43          1HB       MET  43   4.060 -11.177  -2.941
  355   2HB   MET  43          2HB       MET  43   4.415  -9.861  -1.838
  356   1HG   MET  43          1HG       MET  43   2.420  -8.618  -3.033
  357   2HG   MET  43          2HG       MET  43   1.982 -10.207  -3.625
  358   1HE   MET  43          1HE       MET  43   1.374  -8.204   0.188
  359   2HE   MET  43          2HE       MET  43   1.492  -7.709  -1.517
  360   3HE   MET  43          3HE       MET  43   0.003  -8.477  -0.914
  361    H    SER  44           H        SER  44   7.267  -8.951  -4.415
  362    HA   SER  44           HA       SER  44   7.538 -11.521  -5.746
  363   1HB   SER  44          1HB       SER  44   8.416  -8.894  -6.403
  364   2HB   SER  44          2HB       SER  44   9.867  -9.785  -5.982
  365    HG   SER  44           HG       SER  44   9.642 -11.079  -7.712
  366    H    ARG  45           H        ARG  45   8.222 -13.094  -4.325
  367    HA   ARG  45           HA       ARG  45  10.057 -12.259  -2.248
  368   1HB   ARG  45          1HB       ARG  45   8.137 -14.563  -2.606
  369   2HB   ARG  45          2HB       ARG  45   9.530 -14.821  -1.573
  370   1HG   ARG  45          1HG       ARG  45   8.391 -13.796   0.098
  371   2HG   ARG  45          2HG       ARG  45   8.559 -12.291  -0.785
  372   1HD   ARG  45          1HD       ARG  45   6.158 -12.931  -0.170
  373   2HD   ARG  45          2HD       ARG  45   6.417 -12.558  -1.862
  374    HE   ARG  45           HE       ARG  45   6.026 -14.813  -2.417
  375   1HH1  ARG  45          2HH2      ARG  45   6.406 -14.503   1.093
  376   2HH1  ARG  45          1HH2      ARG  45   5.877 -16.121   1.418
  377   1HH2  ARG  45          1HH       ARG  45   5.249 -17.540  -0.410
  378    H    ASP  46           H        ASP  46  10.063 -13.568  -5.371
  379    HA   ASP  46           HA       ASP  46  11.672 -15.708  -5.350
  380   1HB   ASP  46          1HB       ASP  46  11.016 -13.549  -7.203
  381   2HB   ASP  46          2HB       ASP  46  12.688 -14.026  -7.421
  382    HD2  ASP  46           HD       ASP  46   9.751 -16.072  -8.895
  383    H    LEU  47           H        LEU  47  12.401 -12.390  -4.421
  384    HA   LEU  47           HA       LEU  47  15.121 -13.189  -3.781
  385   1HB   LEU  47          1HB       LEU  47  14.390 -11.317  -5.906
  386   2HB   LEU  47          2HB       LEU  47  15.478 -10.620  -4.722
  387    HG   LEU  47           HG       LEU  47  16.939 -11.467  -6.292
  388   1HD1  LEU  47          1HD1      LEU  47  16.864 -14.016  -4.746
  389   2HD1  LEU  47          2HD1      LEU  47  18.234 -12.953  -5.153
  390   3HD1  LEU  47          3HD1      LEU  47  17.111 -12.496  -3.850
  391   1HD2  LEU  47          1HD2      LEU  47  16.486 -14.042  -7.007
  392   2HD2  LEU  47          2HD2      LEU  47  14.817 -13.464  -6.776
  393   3HD2  LEU  47          3HD2      LEU  47  15.899 -12.628  -7.915
  394    H    ALA  48           H        ALA  48  13.214 -10.097  -3.883
  395    HA   ALA  48           HA       ALA  48  12.345 -10.025  -1.321
  396   1HB   ALA  48          1HB       ALA  48  14.412 -10.255  -0.270
  397   2HB   ALA  48          2HB       ALA  48  15.276  -9.357  -1.540
  398   3HB   ALA  48          3HB       ALA  48  14.264  -8.484  -0.365
  399    H    TYR  49           H        TYR  49  11.115  -9.121  -3.411
  400    HA   TYR  49           HA       TYR  49  11.258  -6.233  -3.124
  401   1HB   TYR  49          1HB       TYR  49  11.022  -7.536  -5.873
  402   2HB   TYR  49          2HB       TYR  49  11.580  -5.917  -5.498
  403    HD1  TYR  49           HD1      TYR  49  13.798  -5.997  -3.850
  404    HD2  TYR  49           HD2      TYR  49  12.635  -8.969  -6.699
  405    HE1  TYR  49           HE1      TYR  49  16.204  -6.800  -4.005
  406    HE2  TYR  49           HE2      TYR  49  15.046  -9.763  -6.845
  407    HH   TYR  49           HH       TYR  49  17.625  -7.974  -5.341
  408    H    ALA  50           H        ALA  50   9.236  -5.351  -3.026
  409    HA   ALA  50           HA       ALA  50   7.048  -6.890  -4.214
  410   1HB   ALA  50          1HB       ALA  50   6.329  -7.498  -2.172
  411   2HB   ALA  50          2HB       ALA  50   7.604  -6.538  -1.384
  412   3HB   ALA  50          3HB       ALA  50   6.055  -5.776  -1.817
  413    H    LYS  51           H        LYS  51   5.064  -5.526  -4.512
  414    HA   LYS  51           HA       LYS  51   5.605  -2.667  -4.427
  415   1HB   LYS  51          1HB       LYS  51   4.445  -3.625  -6.983
  416   2HB   LYS  51          2HB       LYS  51   5.517  -2.277  -6.662
  417   1HG   LYS  51          1HG       LYS  51   7.374  -3.996  -6.212
  418   2HG   LYS  51          2HG       LYS  51   6.278  -5.229  -6.808
  419   1HD   LYS  51          1HD       LYS  51   6.846  -4.721  -8.940
  420   2HD   LYS  51          2HD       LYS  51   6.241  -3.091  -8.724
  421   1HE   LYS  51          1HE       LYS  51   8.357  -2.216  -8.199
  422   2HE   LYS  51          2HE       LYS  51   8.956  -3.741  -7.581
  423   1HZ   LYS  51          1HZ       LYS  51   9.385  -4.510  -9.718
  424   2HZ   LYS  51          2HZ       LYS  51   8.294  -3.544 -10.442
  425    H    VAL  52           H        VAL  52   3.940  -1.805  -3.322
  426    HA   VAL  52           HA       VAL  52   1.324  -3.105  -3.660
  427    HB   VAL  52           HB       VAL  52   2.666  -3.053  -1.392
  428   1HG1  VAL  52          1HG1      VAL  52   3.060  -0.668  -1.285
  429   2HG1  VAL  52          2HG1      VAL  52   1.319  -0.332  -1.443
  430   3HG1  VAL  52          3HG1      VAL  52   1.943  -1.129   0.022
  431   1HG2  VAL  52          1HG2      VAL  52   0.677  -3.515  -0.296
  432   2HG2  VAL  52          2HG2      VAL  52  -0.228  -2.261  -1.177
  433   3HG2  VAL  52          3HG2      VAL  52   0.219  -3.777  -1.996
  434    H    TYR  53           H        TYR  53  -0.125  -1.932  -4.795
  435    HA   TYR  53           HA       TYR  53   0.468   0.843  -5.333
  436   1HB   TYR  53          1HB       TYR  53  -0.375  -0.930  -6.997
  437   2HB   TYR  53          2HB       TYR  53  -1.854  -1.050  -6.066
  438    HD1  TYR  53           HD1      TYR  53  -3.347   1.024  -5.878
  439    HD2  TYR  53           HD2      TYR  53  -0.125   0.720  -8.678
  440    HE1  TYR  53           HE1      TYR  53  -4.363   2.899  -7.263
  441    HE2  TYR  53           HE2      TYR  53  -1.152   2.596 -10.053
  442    HH   TYR  53           HH       TYR  53  -3.980   3.441 -10.114
  443    H    VAL  54           H        VAL  54  -1.077   2.591  -4.999
  444    HA   VAL  54           HA       VAL  54  -3.324   2.107  -3.291
  445    HB   VAL  54           HB       VAL  54  -1.723   4.098  -1.965
  446   1HG1  VAL  54          1HG1      VAL  54  -2.268   2.795   0.007
  447   2HG1  VAL  54          2HG1      VAL  54  -3.698   2.896  -1.049
  448   3HG1  VAL  54          3HG1      VAL  54  -2.733   1.402  -1.000
  449   1HG2  VAL  54          1HG2      VAL  54   0.098   2.779  -1.121
  450   2HG2  VAL  54          2HG2      VAL  54  -0.477   1.331  -1.983
  451   3HG2  VAL  54          3HG2      VAL  54   0.160   2.719  -2.898
  452    H    THR  55           H        THR  55  -4.889   3.587  -3.775
  453    HA   THR  55           HA       THR  55  -3.990   5.978  -5.248
  454    HB   THR  55           HB       THR  55  -5.203   4.858  -6.888
  455    HG1  THR  55           HG1      THR  55  -7.416   5.650  -5.150
  456   1HG2  THR  55          1HG2      THR  55  -6.918   3.648  -4.653
  457   2HG2  THR  55          2HG2      THR  55  -7.111   3.318  -6.392
  458   3HG2  THR  55          3HG2      THR  55  -5.637   2.792  -5.545
  459    H    PHE  56           H        PHE  56  -4.524   7.943  -4.487
  460    HA   PHE  56           HA       PHE  56  -6.458   7.964  -2.277
  461   1HB   PHE  56          1HB       PHE  56  -4.149   9.921  -2.733
  462   2HB   PHE  56          2HB       PHE  56  -5.006   9.623  -1.233
  463    HD1  PHE  56           HD1      PHE  56  -1.955   9.569  -1.873
  464    HD2  PHE  56           HD2      PHE  56  -4.900   6.542  -1.461
  465    HE1  PHE  56           HE1      PHE  56  -0.179   7.935  -1.184
  466    HE2  PHE  56           HE2      PHE  56  -3.125   4.909  -0.770
  467    HZ   PHE  56           HZ       PHE  56  -0.785   5.624  -0.640
  468    H    LEU  57           H        LEU  57  -7.597  10.084  -1.979
  469    HA   LEU  57           HA       LEU  57  -8.066  11.290  -4.607
  470   1HB   LEU  57          1HB       LEU  57  -9.922  10.089  -3.407
  471   2HB   LEU  57          2HB       LEU  57  -9.852  11.335  -2.176
  472    HG   LEU  57           HG       LEU  57 -10.096  12.845  -4.455
  473   1HD1  LEU  57          1HD1      LEU  57 -12.208  11.584  -5.477
  474   2HD1  LEU  57          2HD1      LEU  57 -10.557  11.343  -6.099
  475   3HD1  LEU  57          3HD1      LEU  57 -11.268  10.156  -4.979
  476   1HD2  LEU  57          1HD2      LEU  57 -12.465  13.124  -3.775
  477   2HD2  LEU  57          2HD2      LEU  57 -12.277  11.748  -2.661
  478   3HD2  LEU  57          3HD2      LEU  57 -11.322  13.229  -2.414
  479    H    ASN  58           H        ASN  58  -5.764  11.900  -2.811
  480    HA   ASN  58           HA       ASN  58  -6.318  14.250  -1.424
  481   1HB   ASN  58          1HB       ASN  58  -3.964  12.647  -2.182
  482   2HB   ASN  58          2HB       ASN  58  -3.603  14.360  -2.254
  483   1HD2  ASN  58          1HD2      ASN  58  -5.212  15.396  -0.304
  484   2HD2  ASN  58          2HD2      ASN  58  -4.727  14.835   1.262
  485    H    ASP  59           H        ASP  59  -5.743  13.436  -4.812
  486    HA   ASP  59           HA       ASP  59  -4.598  15.556  -5.902
  487   1HB   ASP  59          1HB       ASP  59  -5.335  13.862  -7.383
  488   2HB   ASP  59          2HB       ASP  59  -6.971  13.887  -6.757
  489    HD2  ASP  59           HD       ASP  59  -5.670  16.849  -9.033
  490    H    LYS  60           H        LYS  60  -7.969  15.294  -4.652
  491    HA   LYS  60           HA       LYS  60  -9.204  17.458  -5.621
  492   1HB   LYS  60          1HB       LYS  60  -9.283  15.978  -3.065
  493   2HB   LYS  60          2HB       LYS  60  -9.956  17.594  -2.992
  494   1HG   LYS  60          1HG       LYS  60 -10.851  16.347  -5.449
  495   2HG   LYS  60          2HG       LYS  60 -11.136  15.229  -4.130
  496   1HD   LYS  60          1HD       LYS  60 -11.908  18.143  -3.806
  497   2HD   LYS  60          2HD       LYS  60 -12.949  17.075  -4.724
  498   1HE   LYS  60          1HE       LYS  60 -12.056  15.923  -2.134
  499   2HE   LYS  60          2HE       LYS  60 -13.008  17.385  -1.960
  500   1HZ   LYS  60          1HZ       LYS  60 -14.457  15.458  -2.054
  501   2HZ   LYS  60          2HZ       LYS  60 -14.713  16.342  -3.398
  502    H    ASP  61           H        ASP  61  -6.681  17.449  -3.044
  503    HA   ASP  61           HA       ASP  61  -6.495  20.322  -3.497
  504   1HB   ASP  61          1HB       ASP  61  -5.602  19.177  -0.869
  505   2HB   ASP  61          2HB       ASP  61  -6.289  20.752  -1.213
  506    HD2  ASP  61           HD       ASP  61  -8.342  20.966  -0.570
  507    H    GLU  62           H        GLU  62  -4.472  20.793  -4.370
  508    HA   GLU  62           HA       GLU  62  -2.508  18.814  -4.538
  509   1HB   GLU  62          1HB       GLU  62  -2.944  20.793  -6.126
  510   2HB   GLU  62          2HB       GLU  62  -2.096  21.800  -4.969
  511   1HG   GLU  62          1HG       GLU  62  -0.116  20.199  -5.139
  512   2HG   GLU  62          2HG       GLU  62  -0.966  19.363  -6.424
  513    HE2  GLU  62           HE       GLU  62  -0.359  20.370  -8.553
  514    H    ASP  63           H        ASP  63  -3.349  21.113  -2.070
  515    HA   ASP  63           HA       ASP  63  -0.759  21.451  -1.025
  516   1HB   ASP  63          1HB       ASP  63  -3.323  22.514  -0.574
  517   2HB   ASP  63          2HB       ASP  63  -2.980  21.652   0.912
  518    HD2  ASP  63           HD       ASP  63  -1.911  25.165   0.282
  519    H    ALA  64           H        ALA  64  -3.591  19.292  -0.403
  520    HA   ALA  64           HA       ALA  64  -2.288  17.988   1.805
  521   1HB   ALA  64          1HB       ALA  64  -4.335  16.690   1.912
  522   2HB   ALA  64          2HB       ALA  64  -4.765  18.395   1.637
  523   3HB   ALA  64          3HB       ALA  64  -4.817  17.236   0.288
  524    H    VAL  65           H        VAL  65  -2.363  17.756  -1.675
  525    HA   VAL  65           HA       VAL  65  -1.760  14.962  -1.774
  526    HB   VAL  65           HB       VAL  65  -2.751  16.818  -3.513
  527   1HG1  VAL  65          1HG1      VAL  65  -0.426  17.732  -3.813
  528   2HG1  VAL  65          2HG1      VAL  65   0.034  16.168  -4.528
  529   3HG1  VAL  65          3HG1      VAL  65  -1.205  17.176  -5.314
  530   1HG2  VAL  65          1HG2      VAL  65  -1.891  14.792  -5.193
  531   2HG2  VAL  65          2HG2      VAL  65  -1.909  14.013  -3.593
  532   3HG2  VAL  65          3HG2      VAL  65  -3.383  14.786  -4.223
  533    H    LYS  66           H        LYS  66   0.044  18.076  -1.880
  534    HA   LYS  66           HA       LYS  66   2.537  16.766  -2.353
  535   1HB   LYS  66          1HB       LYS  66   1.650  19.257  -2.826
  536   2HB   LYS  66          2HB       LYS  66   2.413  19.545  -1.276
  537   1HG   LYS  66          1HG       LYS  66   4.396  19.667  -2.372
  538   2HG   LYS  66          2HG       LYS  66   4.279  17.939  -2.640
  539   1HD   LYS  66          1HD       LYS  66   3.563  18.178  -4.840
  540   2HD   LYS  66          2HD       LYS  66   2.721  19.680  -4.522
  541   1HE   LYS  66          1HE       LYS  66   4.648  20.223  -5.887
  542   2HE   LYS  66          2HE       LYS  66   4.975  20.826  -4.275
  543   1HZ   LYS  66          1HZ       LYS  66   6.541  19.053  -5.695
  544   2HZ   LYS  66          2HZ       LYS  66   6.734  19.453  -4.128
  545    H    ALA  67           H        ALA  67   0.924  18.338   0.488
  546    HA   ALA  67           HA       ALA  67   3.026  17.711   2.261
  547   1HB   ALA  67          1HB       ALA  67   1.560  18.565   3.935
  548   2HB   ALA  67          2HB       ALA  67   1.196  19.498   2.463
  549   3HB   ALA  67          3HB       ALA  67   0.113  18.179   2.974
  550    H    GLY  68           H        GLY  68  -0.199  16.191   1.580
  551   1HA   GLY  68          1HA       GLY  68  -0.077  14.133   3.422
  552   2HA   GLY  68          2HA       GLY  68  -0.932  14.091   1.894
  553    H    ILE  69           H        ILE  69   0.766  13.927  -0.117
  554    HA   ILE  69           HA       ILE  69   1.797  11.378  -0.013
  555    HB   ILE  69           HB       ILE  69   1.202  12.895  -1.992
  556   1HG1  ILE  69          1HG1      ILE  69   3.713  11.477  -2.667
  557   2HG1  ILE  69          2HG1      ILE  69   2.530  10.525  -1.792
  558   1HG2  ILE  69          1HG2      ILE  69   4.143  13.578  -1.910
  559   2HG2  ILE  69          2HG2      ILE  69   2.880  14.208  -2.995
  560   3HG2  ILE  69          3HG2      ILE  69   2.884  14.665  -1.274
  561   1HD1  ILE  69          1HD1      ILE  69   1.078  12.010  -3.765
  562   2HD1  ILE  69          2HD1      ILE  69   2.502  11.312  -4.572
  563   3HD1  ILE  69          3HD1      ILE  69   1.361  10.254  -3.709
  564    H    LYS  70           H        LYS  70   3.317  14.535   0.746
  565    HA   LYS  70           HA       LYS  70   5.945  13.593   0.897
  566   1HB   LYS  70          1HB       LYS  70   5.523  15.935   0.715
  567   2HB   LYS  70          2HB       LYS  70   4.517  15.947   2.150
  568   1HG   LYS  70          1HG       LYS  70   6.504  15.290   3.538
  569   2HG   LYS  70          2HG       LYS  70   7.506  15.315   2.100
  570   1HD   LYS  70          1HD       LYS  70   6.042  17.813   2.242
  571   2HD   LYS  70          2HD       LYS  70   6.792  17.521   3.798
  572   1HE   LYS  70          1HE       LYS  70   8.765  18.228   2.930
  573   2HE   LYS  70          2HE       LYS  70   8.777  16.815   1.894
  574   1HZ   LYS  70          1HZ       LYS  70   7.855  19.531   1.243
  575   2HZ   LYS  70          2HZ       LYS  70   8.811  18.544   0.368
  576    H    ALA  71           H        ALA  71   3.183  13.481   3.149
  577    HA   ALA  71           HA       ALA  71   4.807  12.666   5.364
  578   1HB   ALA  71          1HB       ALA  71   2.637  13.944   5.515
  579   2HB   ALA  71          2HB       ALA  71   1.794  12.471   4.980
  580   3HB   ALA  71          3HB       ALA  71   2.690  12.476   6.519
  581    H    LEU  72           H        LEU  72   2.719  11.109   2.874
  582    HA   LEU  72           HA       LEU  72   2.885   8.534   4.004
  583   1HB   LEU  72          1HB       LEU  72   1.372   9.715   2.107
  584   2HB   LEU  72          2HB       LEU  72   2.495   8.840   1.085
  585    HG   LEU  72           HG       LEU  72   1.521   7.110   3.192
  586   1HD1  LEU  72          1HD1      LEU  72  -0.572   7.852   3.425
  587   2HD1  LEU  72          2HD1      LEU  72  -0.454   8.919   2.006
  588   3HD1  LEU  72          3HD1      LEU  72  -0.849   7.197   1.793
  589   1HD2  LEU  72          1HD2      LEU  72   1.952   7.107   0.291
  590   2HD2  LEU  72          2HD2      LEU  72   2.177   5.815   1.492
  591   3HD2  LEU  72          3HD2      LEU  72   0.561   6.128   0.815
  592    H    GLN  73           H        GLN  73   5.125  10.540   2.246
  593    HA   GLN  73           HA       GLN  73   6.610   8.303   1.258
  594   1HB   GLN  73          1HB       GLN  73   6.398  11.032   0.591
  595   2HB   GLN  73          2HB       GLN  73   8.013  10.883   1.251
  596   1HG   GLN  73          1HG       GLN  73   8.114   8.707  -0.301
  597   2HG   GLN  73          2HG       GLN  73   6.818   9.512  -1.164
  598   1HE2  GLN  73          1HE2      GLN  73  10.162   9.594  -0.217
  599   2HE2  GLN  73          2HE2      GLN  73  10.700  10.848  -1.287
  600    H    GLU  74           H        GLU  74   7.014  10.903   3.757
  601    HA   GLU  74           HA       GLU  74   9.486  10.038   4.634
  602   1HB   GLU  74          1HB       GLU  74   9.228  11.603   6.370
  603   2HB   GLU  74          2HB       GLU  74   8.178  12.241   5.121
  604   1HG   GLU  74          1HG       GLU  74   6.614  12.290   6.797
  605   2HG   GLU  74          2HG       GLU  74   6.407  10.596   6.402
  606    HE2  GLU  74           HE       GLU  74   6.892  12.208   9.388
  607    H    ALA  75           H        ALA  75   6.217   8.836   5.215
  608    HA   ALA  75           HA       ALA  75   7.154   7.193   7.436
  609   1HB   ALA  75          1HB       ALA  75   4.376   6.848   6.577
  610   2HB   ALA  75          2HB       ALA  75   5.024   7.333   8.162
  611   3HB   ALA  75          3HB       ALA  75   4.772   8.554   6.893
  612    H    SER  76           H        SER  76   7.809   6.996   4.372
  613    HA   SER  76           HA       SER  76   6.548   4.816   3.323
  614   1HB   SER  76          1HB       SER  76   8.699   4.526   1.986
  615   2HB   SER  76          2HB       SER  76   7.986   6.125   1.923
  616    HG   SER  76           HG       SER  76  10.479   5.471   2.686
  617    H    GLY  77           H        GLY  77   9.946   4.694   4.616
  618   1HA   GLY  77          1HA       GLY  77  10.130   1.971   4.910
  619   2HA   GLY  77          2HA       GLY  77  11.016   3.151   5.854
  620    H    PHE  78           H        PHE  78   8.224   4.256   6.783
  621    HA   PHE  78           HA       PHE  78   8.164   2.723   9.169
  622   1HB   PHE  78          1HB       PHE  78   7.074   5.191   7.967
  623   2HB   PHE  78          2HB       PHE  78   5.820   4.357   8.864
  624    HD1  PHE  78           HD1      PHE  78   8.430   6.676   9.100
  625    HD2  PHE  78           HD2      PHE  78   6.550   3.563  11.285
  626    HE1  PHE  78           HE1      PHE  78   9.320   7.641  11.240
  627    HE2  PHE  78           HE2      PHE  78   7.440   4.528  13.426
  628    HZ   PHE  78           HZ       PHE  78   8.814   6.555  13.377
  629    H    ILE  79           H        ILE  79   5.946   3.134   6.334
  630    HA   ILE  79           HA       ILE  79   3.970   1.413   7.367
  631    HB   ILE  79           HB       ILE  79   3.206   1.403   4.960
  632   1HG1  ILE  79          1HG1      ILE  79   5.326   3.510   4.531
  633   2HG1  ILE  79          2HG1      ILE  79   5.599   1.831   4.112
  634   1HG2  ILE  79          1HG2      ILE  79   2.059   2.922   6.226
  635   2HG2  ILE  79          2HG2      ILE  79   3.525   3.813   6.698
  636   3HG2  ILE  79          3HG2      ILE  79   2.847   4.015   5.064
  637   1HD1  ILE  79          1HD1      ILE  79   4.744   2.674   2.101
  638   2HD1  ILE  79          2HD1      ILE  79   3.267   2.041   2.866
  639   3HD1  ILE  79          3HD1      ILE  79   3.624   3.784   2.926
  640    H    ARG  80           H        ARG  80   6.870   0.949   5.299
  641    HA   ARG  80           HA       ARG  80   6.286  -1.642   4.561
  642   1HB   ARG  80          1HB       ARG  80   8.040  -0.439   3.407
  643   2HB   ARG  80          2HB       ARG  80   8.909  -0.125   4.896
  644   1HG   ARG  80          1HG       ARG  80   8.993  -2.785   5.065
  645   2HG   ARG  80          2HG       ARG  80   8.689  -2.712   3.340
  646   1HD   ARG  80          1HD       ARG  80  10.995  -2.583   3.249
  647   2HD   ARG  80          2HD       ARG  80  10.680  -0.873   3.463
  648    HE   ARG  80           HE       ARG  80  10.879  -2.306   6.004
  649   1HH1  ARG  80          2HH2      ARG  80  12.749  -0.696   3.461
  650   2HH1  ARG  80          1HH2      ARG  80  14.101  -0.365   4.492
  651   1HH2  ARG  80          1HH       ARG  80  14.027  -1.064   6.783
  652    H    SER  81           H        SER  81   8.113  -0.274   7.368
  653    HA   SER  81           HA       SER  81   8.817  -2.817   8.357
  654   1HB   SER  81          1HB       SER  81   9.634  -0.218   8.830
  655   2HB   SER  81          2HB       SER  81   8.714  -0.555  10.284
  656    HG   SER  81           HG       SER  81  11.008  -1.149  10.424
  657    H    LEU  82           H        LEU  82   6.024  -0.669   8.616
  658    HA   LEU  82           HA       LEU  82   4.998  -1.657  11.039
  659   1HB   LEU  82          1HB       LEU  82   4.418   0.481   9.830
  660   2HB   LEU  82          2HB       LEU  82   3.457  -0.483   8.728
  661    HG   LEU  82           HG       LEU  82   1.794   0.077  10.142
  662   1HD1  LEU  82          1HD1      LEU  82   3.039  -2.152  11.777
  663   2HD1  LEU  82          2HD1      LEU  82   1.344  -1.611  11.849
  664   3HD1  LEU  82          3HD1      LEU  82   1.980  -2.354  10.361
  665   1HD2  LEU  82          1HD2      LEU  82   3.757   1.293  11.565
  666   2HD2  LEU  82          2HD2      LEU  82   2.046   1.239  12.051
  667   3HD2  LEU  82          3HD2      LEU  82   3.205   0.074  12.737
  668    H    LEU  83           H        LEU  83   4.606  -2.631   7.591
  669    HA   LEU  83           HA       LEU  83   2.659  -4.598   8.153
  670   1HB   LEU  83          1HB       LEU  83   4.532  -4.532   5.793
  671   2HB   LEU  83          2HB       LEU  83   2.939  -5.256   5.892
  672    HG   LEU  83           HG       LEU  83   2.937  -2.370   6.450
  673   1HD1  LEU  83          1HD1      LEU  83   3.746  -1.498   4.525
  674   2HD1  LEU  83          2HD1      LEU  83   4.768  -2.954   4.574
  675   3HD1  LEU  83          3HD1      LEU  83   3.308  -2.927   3.557
  676   1HD2  LEU  83          1HD2      LEU  83   1.385  -3.524   4.208
  677   2HD2  LEU  83          2HD2      LEU  83   1.066  -4.215   5.817
  678   3HD2  LEU  83          3HD2      LEU  83   0.874  -2.466   5.546
  679    H    GLY  84           H        GLY  84   6.184  -4.893   7.300
  680   1HA   GLY  84          1HA       GLY  84   6.563  -7.546   7.631
  681   2HA   GLY  84          2HA       GLY  84   7.740  -6.331   8.091
  682    H    LYS  85           H        LYS  85   6.408  -5.059  10.265
  683    HA   LYS  85           HA       LYS  85   6.878  -7.025  12.284
  684   1HB   LYS  85          1HB       LYS  85   6.418  -4.083  12.160
  685   2HB   LYS  85          2HB       LYS  85   6.002  -4.885  13.660
  686   1HG   LYS  85          1HG       LYS  85   8.297  -5.938  13.697
  687   2HG   LYS  85          2HG       LYS  85   8.704  -5.048  12.244
  688   1HD   LYS  85          1HD       LYS  85   7.707  -3.045  13.919
  689   2HD   LYS  85          2HD       LYS  85   8.537  -4.100  15.045
  690   1HE   LYS  85          1HE       LYS  85   9.893  -3.260  12.460
  691   2HE   LYS  85          2HE       LYS  85   9.893  -2.185  13.844
  692   1HZ   LYS  85          1HZ       LYS  85  10.655  -4.927  14.429
  693   2HZ   LYS  85          2HZ       LYS  85  11.710  -4.115  13.491
  694    H    ALA  86           H        ALA  86   4.053  -5.367  10.817
  695    HA   ALA  86           HA       ALA  86   2.156  -6.195  12.678
  696   1HB   ALA  86          1HB       ALA  86   0.562  -5.783  10.780
  697   2HB   ALA  86          2HB       ALA  86   1.719  -4.454  11.040
  698   3HB   ALA  86          3HB       ALA  86   1.964  -5.599   9.698
  699    H    MET  87           H        MET  87   3.772  -7.866   9.980
  700    HA   MET  87           HA       MET  87   2.195 -10.219  10.691
  701   1HB   MET  87          1HB       MET  87   2.371 -10.926   8.333
  702   2HB   MET  87          2HB       MET  87   1.730  -9.296   8.373
  703   1HG   MET  87          1HG       MET  87   3.818  -8.329   7.697
  704   2HG   MET  87          2HG       MET  87   4.723  -9.773   8.109
  705   1HE   MET  87          1HE       MET  87   2.662  -8.714   4.264
  706   2HE   MET  87          2HE       MET  87   1.527  -8.867   5.626
  707   3HE   MET  87          3HE       MET  87   2.910  -7.755   5.742
  708    H    ARG  88           H        ARG  88   4.865  -9.075  11.688
  709    HA   ARG  88           HA       ARG  88   7.042  -9.632  11.685
  710   1HB   ARG  88          1HB       ARG  88   5.272 -11.609  13.020
  711   2HB   ARG  88          2HB       ARG  88   6.893 -12.215  12.744
  712   1HG   ARG  88          1HG       ARG  88   7.727  -9.967  13.761
  713   2HG   ARG  88          2HG       ARG  88   6.076  -9.725  14.298
  714   1HD   ARG  88          1HD       ARG  88   6.952 -12.434  14.962
  715   2HD   ARG  88          2HD       ARG  88   8.098 -11.266  15.584
  716    HE   ARG  88           HE       ARG  88   5.273 -10.601  16.098
  717   1HH1  ARG  88          2HH2      ARG  88   8.193 -12.177  17.343
  718   2HH1  ARG  88          1HH2      ARG  88   7.676 -12.108  18.995
  719   1HH2  ARG  88          1HH       ARG  88   5.555 -11.124  19.520
  720    H    LEU  89           H        LEU  89   7.715  -9.786   9.440
  721    HA   LEU  89           HA       LEU  89   7.828 -12.556   8.463
  722   1HB   LEU  89          1HB       LEU  89   7.085 -11.943   6.470
  723   2HB   LEU  89          2HB       LEU  89   6.480 -10.515   7.286
  724    HG   LEU  89           HG       LEU  89   9.119 -10.723   5.809
  725   1HD1  LEU  89          1HD1      LEU  89   8.113  -9.306   4.126
  726   2HD1  LEU  89          2HD1      LEU  89   7.132 -10.776   4.342
  727   3HD1  LEU  89          3HD1      LEU  89   6.592  -9.234   5.048
  728   1HD2  LEU  89          1HD2      LEU  89   9.746  -8.732   6.605
  729   2HD2  LEU  89          2HD2      LEU  89   8.106  -8.052   6.471
  730   3HD2  LEU  89          3HD2      LEU  89   8.552  -9.025   7.891
  731    H    ARG  90           H        ARG  90   9.743 -12.729   6.760
  732    HA   ARG  90           HA       ARG  90  11.994 -11.355   7.996
  733   1HB   ARG  90          1HB       ARG  90  13.359 -13.377   7.503
  734   2HB   ARG  90          2HB       ARG  90  11.993 -13.781   8.526
  735   1HG   ARG  90          1HG       ARG  90  10.731 -14.367   6.328
  736   2HG   ARG  90          2HG       ARG  90  12.292 -14.289   5.538
  737   1HD   ARG  90          1HD       ARG  90  12.561 -15.879   7.950
  738   2HD   ARG  90          2HD       ARG  90  11.184 -16.472   7.043
  739    HE   ARG  90           HE       ARG  90  12.619 -17.106   5.265
  740   1HH1  ARG  90          2HH2      ARG  90  14.417 -15.279   7.711
  741   2HH1  ARG  90          1HH2      ARG  90  15.967 -15.694   7.061
  742   1HH2  ARG  90          1HH       ARG  90  16.088 -17.091   5.118
  743    H    ILE  91           H        ILE  91  10.596 -12.828   5.008
  744    HA   ILE  91           HA       ILE  91  12.491 -12.373   3.168
  745    HB   ILE  91           HB       ILE  91  10.514 -11.806   1.626
  746   1HG1  ILE  91          1HG1      ILE  91   8.714 -12.834   3.757
  747   2HG1  ILE  91          2HG1      ILE  91   9.205 -11.158   3.900
  748   1HG2  ILE  91          1HG2      ILE  91  11.544 -14.016   1.813
  749   2HG2  ILE  91          2HG2      ILE  91  10.524 -14.381   3.225
  750   3HG2  ILE  91          3HG2      ILE  91   9.778 -14.137   1.628
  751   1HD1  ILE  91          1HD1      ILE  91   7.154 -12.141   2.267
  752   2HD1  ILE  91          2HD1      ILE  91   7.887 -10.522   2.163
  753   3HD1  ILE  91          3HD1      ILE  91   8.491 -11.841   1.130
  754    H    VAL  92           H        VAL  92  10.668  -9.947   4.984
  755    HA   VAL  92           HA       VAL  92  10.468  -7.701   4.551
  756    HB   VAL  92           HB       VAL  92  13.417  -8.168   5.044
  757   1HG1  VAL  92          1HG1      VAL  92  13.182  -5.949   6.285
  758   2HG1  VAL  92          2HG1      VAL  92  13.152  -5.877   4.507
  759   3HG1  VAL  92          3HG1      VAL  92  11.635  -5.751   5.427
  760   1HG2  VAL  92          1HG2      VAL  92  11.344  -7.659   7.174
  761   2HG2  VAL  92          2HG2      VAL  92  11.664  -9.306   6.582
  762   3HG2  VAL  92          3HG2      VAL  92  12.971  -8.358   7.331
  763    HA   PRO  93           HA       PRO  93  12.059  -7.733   0.261
  764   1HB   PRO  93          1HB       PRO  93   9.685  -7.846  -1.088
  765   2HB   PRO  93          2HB       PRO  93  10.671  -9.258  -0.759
  766   1HG   PRO  93          1HG       PRO  93   8.156  -8.409   0.541
  767   2HG   PRO  93          2HG       PRO  93   8.916  -9.989   0.546
  768   1HD   PRO  93          1HD       PRO  93   8.923  -8.075   2.683
  769   2HD   PRO  93          2HD       PRO  93   9.779  -9.603   2.642
  770    H    GLU  94           H        GLU  94  12.023  -6.059  -1.377
  771    HA   GLU  94           HA       GLU  94  11.568  -3.605  -0.108
  772   1HB   GLU  94          1HB       GLU  94  13.164  -4.394  -2.138
  773   2HB   GLU  94          2HB       GLU  94  11.844  -3.754  -3.097
  774   1HG   GLU  94          1HG       GLU  94  12.002  -1.575  -1.945
  775   2HG   GLU  94          2HG       GLU  94  13.225  -2.202  -0.857
  776    HE2  GLU  94           HE       GLU  94  15.653  -1.171  -2.956
  777    H    LEU  95           H        LEU  95   9.177  -4.414   0.378
  778    HA   LEU  95           HA       LEU  95   7.325  -4.244  -1.753
  779   1HB   LEU  95          1HB       LEU  95   5.675  -4.117   0.157
  780   2HB   LEU  95          2HB       LEU  95   6.673  -5.552   0.043
  781    HG   LEU  95           HG       LEU  95   7.962  -3.599   1.741
  782   1HD1  LEU  95          1HD1      LEU  95   5.535  -2.875   1.992
  783   2HD1  LEU  95          2HD1      LEU  95   5.254  -4.451   2.771
  784   3HD1  LEU  95          3HD1      LEU  95   6.406  -3.298   3.484
  785   1HD2  LEU  95          1HD2      LEU  95   6.794  -6.152   2.767
  786   2HD2  LEU  95          2HD2      LEU  95   8.064  -6.230   1.523
  787   3HD2  LEU  95          3HD2      LEU  95   8.383  -5.410   3.071
  788    H    THR  96           H        THR  96   7.776  -2.301  -2.896
  789    HA   THR  96           HA       THR  96   7.818   0.203  -1.528
  790    HB   THR  96           HB       THR  96   8.927  -0.545  -3.787
  791    HG1  THR  96           HG1      THR  96   7.258   1.858  -3.771
  792   1HG2  THR  96          1HG2      THR  96   6.807   0.714  -5.318
  793   2HG2  THR  96          2HG2      THR  96   7.567  -0.871  -5.592
  794   3HG2  THR  96          3HG2      THR  96   6.153  -0.735  -4.520
  795    H    PHE  97           H        PHE  97   6.287   2.018  -2.133
  796    HA   PHE  97           HA       PHE  97   3.559   0.938  -2.249
  797   1HB   PHE  97          1HB       PHE  97   2.981   2.649  -0.579
  798   2HB   PHE  97          2HB       PHE  97   4.398   1.810   0.023
  799    HD1  PHE  97           HD1      PHE  97   2.998   4.967  -0.736
  800    HD2  PHE  97           HD2      PHE  97   6.696   2.900  -0.516
  801    HE1  PHE  97           HE1      PHE  97   4.210   7.157  -0.537
  802    HE2  PHE  97           HE2      PHE  97   7.909   5.088  -0.316
  803    HZ   PHE  97           HZ       PHE  97   6.651   7.191  -0.329
  804    H    PHE  98           H        PHE  98   2.730   1.485  -4.217
  805    HA   PHE  98           HA       PHE  98   3.645   3.928  -5.470
  806   1HB   PHE  98          1HB       PHE  98   2.537   1.308  -6.172
  807   2HB   PHE  98          2HB       PHE  98   1.513   2.546  -6.873
  808    HD1  PHE  98           HD1      PHE  98   5.162   1.806  -6.524
  809    HD2  PHE  98           HD2      PHE  98   2.032   3.245  -9.002
  810    HE1  PHE  98           HE1      PHE  98   6.786   2.078  -8.418
  811    HE2  PHE  98           HE2      PHE  98   3.656   3.516 -10.897
  812    HZ   PHE  98           HZ       PHE  98   6.014   2.928 -10.581
  813    H    TYR  99           H        TYR  99   2.640   5.825  -5.010
  814    HA   TYR  99           HA       TYR  99  -0.163   5.706  -4.180
  815   1HB   TYR  99          1HB       TYR  99   0.774   8.321  -3.926
  816   2HB   TYR  99          2HB       TYR  99   0.908   7.125  -2.652
  817    HD1  TYR  99           HD1      TYR  99   2.705   9.306  -4.837
  818    HD2  TYR  99           HD2      TYR  99   3.061   5.676  -2.602
  819    HE1  TYR  99           HE1      TYR  99   5.238   9.505  -4.905
  820    HE2  TYR  99           HE2      TYR  99   5.594   5.887  -2.677
  821    HH   TYR  99           HH       TYR  99   7.132   8.462  -4.543
  822    H    ASP 100           H        ASP 100  -1.308   5.536  -6.135
  823    HA   ASP 100           HA       ASP 100  -0.684   7.549  -8.124
  824   1HB   ASP 100          1HB       ASP 100  -1.542   4.827  -8.225
  825   2HB   ASP 100          2HB       ASP 100  -2.897   5.773  -8.811
  826    HD2  ASP 100           HD       ASP 100   0.337   6.680 -10.884
  827    H    ASN 101           H        ASN 101  -1.703   9.443  -7.249
  828    HA   ASN 101           HA       ASN 101  -4.390   9.185  -6.280
  829   1HB   ASN 101          1HB       ASN 101  -2.725  11.726  -6.651
  830   2HB   ASN 101          2HB       ASN 101  -4.150  11.555  -5.646
  831   1HD2  ASN 101          1HD2      ASN 101  -1.461  12.389  -4.944
  832   2HD2  ASN 101          2HD2      ASN 101  -0.884  11.322  -3.708
  833    H    SER 102           H        SER 102  -5.557  11.623  -7.085
  834    HA   SER 102           HA       SER 102  -5.952  11.081  -9.884
  835   1HB   SER 102          1HB       SER 102  -8.071  11.429  -9.133
  836   2HB   SER 102          2HB       SER 102  -7.518  12.242  -7.682
  837    HG   SER 102           HG       SER 102  -8.745  13.422  -9.626
  838    H    LEU 103           H        LEU 103  -3.526  12.542  -8.550
  839    HA   LEU 103           HA       LEU 103  -3.793  15.118  -9.907
  840   1HB   LEU 103          1HB       LEU 103  -3.139  15.029  -7.507
  841   2HB   LEU 103          2HB       LEU 103  -1.685  14.163  -7.965
  842    HG   LEU 103           HG       LEU 103  -1.667  16.451  -9.581
  843   1HD1  LEU 103          1HD1      LEU 103  -2.598  17.125  -6.781
  844   2HD1  LEU 103          2HD1      LEU 103  -1.835  18.288  -7.891
  845   3HD1  LEU 103          3HD1      LEU 103  -3.387  17.535  -8.324
  846   1HD2  LEU 103          1HD2      LEU 103   0.078  15.093  -8.021
  847   2HD2  LEU 103          2HD2      LEU 103   0.411  16.684  -8.745
  848   3HD2  LEU 103          3HD2      LEU 103  -0.134  16.571  -7.054
  849    H    VAL 104           H        VAL 104  -3.112  12.082 -10.809
  850    HA   VAL 104           HA       VAL 104  -1.021  12.998 -12.647
  851    HB   VAL 104           HB       VAL 104  -1.092  10.538 -10.928
  852   1HG1  VAL 104          1HG1      VAL 104  -0.837   9.553 -13.073
  853   2HG1  VAL 104          2HG1      VAL 104   0.264  10.841 -13.619
  854   3HG1  VAL 104          3HG1      VAL 104   0.801   9.669 -12.390
  855   1HG2  VAL 104          1HG2      VAL 104   0.618  11.538  -9.907
  856   2HG2  VAL 104          2HG2      VAL 104   1.517  11.630 -11.440
  857   3HG2  VAL 104          3HG2      VAL 104   0.413  12.946 -10.975
  858    H    GLU 105           H        GLU 105  -4.171  12.177 -12.281
  859    HA   GLU 105           HA       GLU 105  -4.327  11.362 -15.010
  860   1HB   GLU 105          1HB       GLU 105  -5.547   9.546 -12.885
  861   2HB   GLU 105          2HB       GLU 105  -5.608   9.310 -14.620
  862   1HG   GLU 105          1HG       GLU 105  -3.086   9.156 -14.656
  863   2HG   GLU 105          2HG       GLU 105  -3.076   9.304 -12.909
  864    HE2  GLU 105           HE       GLU 105  -2.244   7.231 -14.502
  865    H    GLY 106           H        GLY 106  -5.864  12.117 -11.863
  866   1HA   GLY 106          1HA       GLY 106  -7.490  13.718 -11.542
  867   2HA   GLY 106          2HA       GLY 106  -7.851  13.728 -13.256
  868    H    MET 107           H        MET 107  -7.682  10.507 -12.750
  869    HA   MET 107           HA       MET 107 -10.211  10.204 -11.419
  870   1HB   MET 107          1HB       MET 107 -11.071   8.838 -13.438
  871   2HB   MET 107          2HB       MET 107 -11.011  10.572 -13.682
  872   1HG   MET 107          1HG       MET 107  -9.958   9.844 -15.637
  873   2HG   MET 107          2HG       MET 107  -8.561  10.075 -14.604
  874   1HE   MET 107          1HE       MET 107  -7.238   8.684 -13.676
  875   2HE   MET 107          2HE       MET 107  -7.254   6.905 -13.601
  876   3HE   MET 107          3HE       MET 107  -6.683   7.729 -15.072
  877    H    ARG 108           H        ARG 108  -7.309   9.427 -11.072
  878    HA   ARG 108           HA       ARG 108  -6.608   6.994 -11.764
  879   1HB   ARG 108          1HB       ARG 108  -5.208   6.958  -9.859
  880   2HB   ARG 108          2HB       ARG 108  -5.573   8.666 -10.012
  881   1HG   ARG 108          1HG       ARG 108  -7.004   6.697  -8.164
  882   2HG   ARG 108          2HG       ARG 108  -5.838   7.905  -7.664
  883   1HD   ARG 108          1HD       ARG 108  -7.334   9.726  -8.421
  884   2HD   ARG 108          2HD       ARG 108  -8.475   8.562  -9.062
  885    HE   ARG 108           HE       ARG 108  -8.044   9.215  -6.219
  886   1HH1  ARG 108          2HH2      ARG 108  -9.506   6.967  -8.533
  887   2HH1  ARG 108          1HH2      ARG 108 -10.643   6.333  -7.389
  888   1HH2  ARG 108          1HH       ARG 108 -10.646   7.180  -5.147
  Start of MODEL    8
    1    H    MET   1           H        MET   1  -7.519  -8.149  -5.549
    2    HA   MET   1           HA       MET   1  -8.141  -8.861  -3.488
    3   1HB   MET   1          1HB       MET   1  -8.687  -6.385  -3.981
    4   2HB   MET   1          2HB       MET   1 -10.357  -6.867  -4.211
    5   1HG   MET   1          1HG       MET   1 -10.627  -7.494  -1.924
    6   2HG   MET   1          2HG       MET   1  -8.900  -7.621  -1.655
    7   1HE   MET   1          1HE       MET   1 -11.929  -5.706  -2.118
    8   2HE   MET   1          2HE       MET   1 -11.675  -5.201  -0.431
    9   3HE   MET   1          3HE       MET   1 -11.587  -4.001  -1.743
   10    H    ALA   2           H        ALA   2  -8.968 -11.048  -4.665
   11    HA   ALA   2           HA       ALA   2 -11.050 -12.024  -3.236
   12   1HB   ALA   2          1HB       ALA   2 -12.521 -11.929  -5.674
   13   2HB   ALA   2          2HB       ALA   2 -12.946 -11.197  -4.108
   14   3HB   ALA   2          3HB       ALA   2 -12.016 -10.263  -5.305
   15    H    LYS   3           H        LYS   3  -9.167 -13.517  -3.409
   16    HA   LYS   3           HA       LYS   3  -9.664 -15.397  -5.554
   17   1HB   LYS   3          1HB       LYS   3  -7.709 -13.579  -6.017
   18   2HB   LYS   3          2HB       LYS   3  -6.785 -14.791  -5.153
   19   1HG   LYS   3          1HG       LYS   3  -6.670 -15.408  -7.473
   20   2HG   LYS   3          2HG       LYS   3  -7.773 -16.547  -6.728
   21   1HD   LYS   3          1HD       LYS   3  -9.533 -14.559  -7.456
   22   2HD   LYS   3          2HD       LYS   3  -8.331 -14.394  -8.719
   23   1HE   LYS   3          1HE       LYS   3  -8.522 -16.996  -8.970
   24   2HE   LYS   3          2HE       LYS   3  -9.991 -16.847  -8.028
   25   1HZ   LYS   3          1HZ       LYS   3  -9.528 -15.244 -10.480
   26   2HZ   LYS   3          2HZ       LYS   3 -10.284 -16.685 -10.510
   27    H    GLU   4           H        GLU   4 -10.359 -17.002  -4.190
   28    HA   GLU   4           HA       GLU   4  -8.563 -17.608  -1.977
   29   1HB   GLU   4          1HB       GLU   4 -10.567 -18.822  -1.007
   30   2HB   GLU   4          2HB       GLU   4 -10.757 -17.086  -1.136
   31   1HG   GLU   4          1HG       GLU   4 -11.624 -18.361  -3.614
   32   2HG   GLU   4          2HG       GLU   4 -12.440 -19.100  -2.250
   33    HE2  GLU   4           HE       GLU   4 -13.207 -16.179  -4.137
   34    H    PHE   5           H        PHE   5  -7.083 -18.863  -3.267
   35    HA   PHE   5           HA       PHE   5  -8.133 -21.515  -3.839
   36   1HB   PHE   5          1HB       PHE   5  -7.922 -19.737  -5.873
   37   2HB   PHE   5          2HB       PHE   5  -6.214 -20.115  -5.752
   38    HD1  PHE   5           HD1      PHE   5  -9.230 -22.296  -5.450
   39    HD2  PHE   5           HD2      PHE   5  -5.664 -21.419  -7.578
   40    HE1  PHE   5           HE1      PHE   5  -9.581 -24.331  -6.877
   41    HE2  PHE   5           HE2      PHE   5  -6.014 -23.454  -9.004
   42    HZ   PHE   5           HZ       PHE   5  -7.969 -24.886  -8.637
   43    H    GLY   6           H        GLY   6  -5.922 -22.770  -4.824
   44   1HA   GLY   6          1HA       GLY   6  -4.087 -22.594  -2.558
   45   2HA   GLY   6          2HA       GLY   6  -4.218 -23.890  -3.732
   46    H    ARG   7           H        ARG   7  -4.370 -21.064  -5.532
   47    HA   ARG   7           HA       ARG   7  -1.731 -21.461  -6.453
   48   1HB   ARG   7          1HB       ARG   7  -4.155 -20.173  -7.376
   49   2HB   ARG   7          2HB       ARG   7  -2.852 -19.007  -7.487
   50   1HG   ARG   7          1HG       ARG   7  -1.570 -21.190  -8.508
   51   2HG   ARG   7          2HG       ARG   7  -3.216 -21.599  -8.952
   52   1HD   ARG   7          1HD       ARG   7  -3.287 -19.997 -10.578
   53   2HD   ARG   7          2HD       ARG   7  -2.630 -18.770  -9.514
   54    HE   ARG   7           HE       ARG   7  -0.567 -19.112 -10.532
   55   1HH1  ARG   7          2HH2      ARG   7  -2.423 -22.119 -10.794
   56   2HH1  ARG   7          1HH2      ARG   7  -1.197 -22.942 -11.700
   57   1HH2  ARG   7          1HH       ARG   7   0.836 -21.793 -12.237
   58    HA   PRO   8           HA       PRO   8   0.237 -18.068  -4.514
   59   1HB   PRO   8          1HB       PRO   8   1.488 -16.617  -6.463
   60   2HB   PRO   8          2HB       PRO   8   2.111 -18.135  -5.850
   61   1HG   PRO   8          1HG       PRO   8   0.761 -17.590  -8.422
   62   2HG   PRO   8          2HG       PRO   8   1.753 -18.964  -7.973
   63   1HD   PRO   8          1HD       PRO   8  -1.109 -18.901  -8.162
   64   2HD   PRO   8          2HD       PRO   8  -0.125 -20.238  -7.601
   65    H    GLN   9           H        GLN   9  -2.455 -17.510  -6.208
   66    HA   GLN   9           HA       GLN   9  -2.366 -14.663  -6.031
   67   1HB   GLN   9          1HB       GLN   9  -3.832 -16.540  -7.524
   68   2HB   GLN   9          2HB       GLN   9  -5.024 -15.854  -6.436
   69   1HG   GLN   9          1HG       GLN   9  -4.955 -14.497  -8.464
   70   2HG   GLN   9          2HG       GLN   9  -4.314 -13.546  -7.138
   71   1HE2  GLN   9          1HE2      GLN   9  -3.038 -12.217  -8.296
   72   2HE2  GLN   9          2HE2      GLN   9  -1.626 -12.704  -9.175
   73    H    ARG  10           H        ARG  10  -3.833 -17.429  -4.262
   74    HA   ARG  10           HA       ARG  10  -5.531 -16.015  -2.665
   75   1HB   ARG  10          1HB       ARG  10  -5.240 -18.566  -2.873
   76   2HB   ARG  10          2HB       ARG  10  -3.888 -18.432  -1.767
   77   1HG   ARG  10          1HG       ARG  10  -5.451 -17.305  -0.099
   78   2HG   ARG  10          2HG       ARG  10  -6.781 -17.643  -1.191
   79   1HD   ARG  10          1HD       ARG  10  -6.729 -19.941  -0.781
   80   2HD   ARG  10          2HD       ARG  10  -5.004 -19.962  -0.474
   81    HE   ARG  10           HE       ARG  10  -5.424 -19.538   1.789
   82   1HH1  ARG  10          2HH2      ARG  10  -8.325 -18.730  -0.076
   83   2HH1  ARG  10          1HH2      ARG  10  -9.302 -18.455   1.328
   84   1HH2  ARG  10          1HH       ARG  10  -8.331 -18.722   3.503
   85    H    VAL  11           H        VAL  11  -2.167 -17.169  -1.839
   86    HA   VAL  11           HA       VAL  11  -1.925 -15.925   0.583
   87    HB   VAL  11           HB       VAL  11  -0.381 -17.487  -0.966
   88   1HG1  VAL  11          1HG1      VAL  11   1.664 -16.355  -1.607
   89   2HG1  VAL  11          2HG1      VAL  11   0.282 -15.568  -2.409
   90   3HG1  VAL  11          3HG1      VAL  11   1.044 -14.804  -0.992
   91   1HG2  VAL  11          1HG2      VAL  11   0.750 -15.756   1.256
   92   2HG2  VAL  11          2HG2      VAL  11  -0.319 -17.154   1.522
   93   3HG2  VAL  11          3HG2      VAL  11   1.278 -17.387   0.774
   94    H    ALA  12           H        ALA  12  -1.438 -14.583  -2.724
   95    HA   ALA  12           HA       ALA  12  -0.365 -12.138  -1.937
   96   1HB   ALA  12          1HB       ALA  12  -0.240 -12.859  -4.223
   97   2HB   ALA  12          2HB       ALA  12  -2.009 -13.016  -4.338
   98   3HB   ALA  12          3HB       ALA  12  -1.265 -11.405  -4.199
   99    H    GLN  13           H        GLN  13  -3.717 -13.378  -2.073
  100    HA   GLN  13           HA       GLN  13  -4.929 -10.876  -1.804
  101   1HB   GLN  13          1HB       GLN  13  -5.930 -13.661  -1.063
  102   2HB   GLN  13          2HB       GLN  13  -6.943 -12.232  -1.125
  103   1HG   GLN  13          1HG       GLN  13  -5.721 -13.794  -3.373
  104   2HG   GLN  13          2HG       GLN  13  -7.297 -13.033  -3.276
  105   1HE2  GLN  13          1HE2      GLN  13  -3.869 -12.534  -3.793
  106   2HE2  GLN  13          2HE2      GLN  13  -3.964 -11.008  -4.608
  107    H    GLU  14           H        GLU  14  -4.709 -13.552   0.660
  108    HA   GLU  14           HA       GLU  14  -5.528 -12.228   2.807
  109   1HB   GLU  14          1HB       GLU  14  -3.310 -14.277   2.504
  110   2HB   GLU  14          2HB       GLU  14  -3.764 -13.677   4.088
  111   1HG   GLU  14          1HG       GLU  14  -6.134 -14.404   2.514
  112   2HG   GLU  14          2HG       GLU  14  -5.023 -15.755   2.640
  113    HE2  GLU  14           HE       GLU  14  -4.995 -14.954   6.245
  114    H    MET  15           H        MET  15  -2.286 -11.973   1.278
  115    HA   MET  15           HA       MET  15  -1.260 -10.344   3.349
  116   1HB   MET  15          1HB       MET  15  -0.324 -11.694   0.976
  117   2HB   MET  15          2HB       MET  15   0.112 -10.007   0.794
  118   1HG   MET  15          1HG       MET  15   0.636 -11.141   3.506
  119   2HG   MET  15          2HG       MET  15   1.592 -11.849   2.219
  120   1HE   MET  15          1HE       MET  15   3.371 -11.261   3.476
  121   2HE   MET  15          2HE       MET  15   4.378 -10.114   2.560
  122   3HE   MET  15          3HE       MET  15   3.757  -9.667   4.167
  123    H    GLN  16           H        GLN  16  -2.815  -9.804   0.159
  124    HA   GLN  16           HA       GLN  16  -2.195  -7.097  -0.006
  125   1HB   GLN  16          1HB       GLN  16  -2.993  -8.561  -1.894
  126   2HB   GLN  16          2HB       GLN  16  -4.596  -8.563  -1.184
  127   1HG   GLN  16          1HG       GLN  16  -3.623  -5.823  -1.380
  128   2HG   GLN  16          2HG       GLN  16  -3.472  -6.610  -2.939
  129   1HE2  GLN  16          1HE2      GLN  16  -5.089  -5.140  -3.661
  130   2HE2  GLN  16          2HE2      GLN  16  -6.772  -5.447  -3.386
  131    H    LYS  17           H        LYS  17  -4.811  -8.923   1.609
  132    HA   LYS  17           HA       LYS  17  -6.352  -6.585   2.173
  133   1HB   LYS  17          1HB       LYS  17  -7.845  -8.046   3.258
  134   2HB   LYS  17          2HB       LYS  17  -7.231  -8.946   1.886
  135   1HG   LYS  17          1HG       LYS  17  -5.820 -10.305   3.241
  136   2HG   LYS  17          2HG       LYS  17  -5.847  -9.170   4.578
  137   1HD   LYS  17          1HD       LYS  17  -8.552 -10.120   3.873
  138   2HD   LYS  17          2HD       LYS  17  -7.479 -11.441   4.295
  139   1HE   LYS  17          1HE       LYS  17  -6.821 -10.075   6.385
  140   2HE   LYS  17          2HE       LYS  17  -8.146  -8.997   5.994
  141   1HZ   LYS  17          1HZ       LYS  17  -9.508 -11.202   5.928
  142   2HZ   LYS  17          2HZ       LYS  17  -8.293 -11.817   6.821
  143    H    GLU  18           H        GLU  18  -3.841  -8.546   3.814
  144    HA   GLU  18           HA       GLU  18  -4.180  -7.282   6.294
  145   1HB   GLU  18          1HB       GLU  18  -3.079  -9.519   5.919
  146   2HB   GLU  18          2HB       GLU  18  -1.714  -8.697   5.188
  147   1HG   GLU  18          1HG       GLU  18  -0.842  -8.577   7.287
  148   2HG   GLU  18          2HG       GLU  18  -2.013  -7.306   7.584
  149    HE2  GLU  18           HE       GLU  18  -2.101 -10.950   8.956
  150    H    ILE  19           H        ILE  19  -2.071  -6.705   3.431
  151    HA   ILE  19           HA       ILE  19  -0.638  -4.600   4.725
  152    HB   ILE  19           HB       ILE  19   0.534  -4.388   2.711
  153   1HG1  ILE  19          1HG1      ILE  19  -1.837  -5.715   1.383
  154   2HG1  ILE  19          2HG1      ILE  19  -1.216  -4.099   1.116
  155   1HG2  ILE  19          1HG2      ILE  19   1.520  -6.314   3.203
  156   2HG2  ILE  19          2HG2      ILE  19  -0.008  -7.011   3.796
  157   3HG2  ILE  19          3HG2      ILE  19   0.406  -7.113   2.067
  158   1HD1  ILE  19          1HD1      ILE  19  -0.232  -6.707   0.065
  159   2HD1  ILE  19          2HD1      ILE  19  -0.149  -5.083  -0.659
  160   3HD1  ILE  19          3HD1      ILE  19   1.038  -5.569   0.577
  161    H    ALA  20           H        ALA  20  -3.450  -4.908   2.515
  162    HA   ALA  20           HA       ALA  20  -3.683  -2.198   1.895
  163   1HB   ALA  20          1HB       ALA  20  -4.858  -3.823   0.596
  164   2HB   ALA  20          2HB       ALA  20  -5.654  -4.504   2.035
  165   3HB   ALA  20          3HB       ALA  20  -6.106  -2.885   1.452
  166    H    LEU  21           H        LEU  21  -4.710  -4.151   4.713
  167    HA   LEU  21           HA       LEU  21  -6.356  -2.102   5.795
  168   1HB   LEU  21          1HB       LEU  21  -6.874  -4.316   6.370
  169   2HB   LEU  21          2HB       LEU  21  -5.220  -4.692   6.811
  170    HG   LEU  21           HG       LEU  21  -6.131  -2.556   8.493
  171   1HD1  LEU  21          1HD1      LEU  21  -7.979  -4.958   8.490
  172   2HD1  LEU  21          2HD1      LEU  21  -7.999  -3.601   9.640
  173   3HD1  LEU  21          3HD1      LEU  21  -8.403  -3.324   7.929
  174   1HD2  LEU  21          1HD2      LEU  21  -4.470  -4.681   8.702
  175   2HD2  LEU  21          2HD2      LEU  21  -5.097  -3.761  10.090
  176   3HD2  LEU  21          3HD2      LEU  21  -5.879  -5.285   9.608
  177    H    ILE  22           H        ILE  22  -3.093  -3.415   6.725
  178    HA   ILE  22           HA       ILE  22  -2.586  -1.444   8.621
  179    HB   ILE  22           HB       ILE  22  -0.672  -3.085   6.957
  180   1HG1  ILE  22          1HG1      ILE  22  -1.484  -3.720   9.779
  181   2HG1  ILE  22          2HG1      ILE  22  -2.536  -4.184   8.456
  182   1HG2  ILE  22          1HG2      ILE  22   0.335  -1.075   8.065
  183   2HG2  ILE  22          2HG2      ILE  22  -0.165  -1.757   9.630
  184   3HG2  ILE  22          3HG2      ILE  22   0.995  -2.635   8.607
  185   1HD1  ILE  22          1HD1      ILE  22   0.392  -4.966   8.810
  186   2HD1  ILE  22          2HD1      ILE  22  -1.024  -6.038   8.915
  187   3HD1  ILE  22          3HD1      ILE  22  -0.560  -5.325   7.351
  188    H    LEU  23           H        LEU  23  -2.672  -1.327   5.141
  189    HA   LEU  23           HA       LEU  23  -0.951   0.996   5.021
  190   1HB   LEU  23          1HB       LEU  23  -0.857  -0.734   3.292
  191   2HB   LEU  23          2HB       LEU  23  -2.540  -0.449   2.896
  192    HG   LEU  23           HG       LEU  23  -0.794   1.940   2.764
  193   1HD1  LEU  23          1HD1      LEU  23  -0.561   0.181   0.386
  194   2HD1  LEU  23          2HD1      LEU  23   0.589   1.353   1.073
  195   3HD1  LEU  23          3HD1      LEU  23   0.415  -0.259   1.807
  196   1HD2  LEU  23          1HD2      LEU  23  -2.881   0.770   0.904
  197   2HD2  LEU  23          2HD2      LEU  23  -3.143   2.036   2.128
  198   3HD2  LEU  23          3HD2      LEU  23  -2.095   2.356   0.727
  199    H    GLN  24           H        GLN  24  -4.275   0.209   5.603
  200    HA   GLN  24           HA       GLN  24  -4.999   2.951   4.927
  201   1HB   GLN  24          1HB       GLN  24  -6.374   0.367   4.612
  202   2HB   GLN  24          2HB       GLN  24  -7.378   1.551   5.423
  203   1HG   GLN  24          1HG       GLN  24  -7.173   3.125   3.598
  204   2HG   GLN  24          2HG       GLN  24  -5.863   2.220   2.866
  205   1HE2  GLN  24          1HE2      GLN  24  -6.495   1.340   1.059
  206   2HE2  GLN  24          2HE2      GLN  24  -7.986   0.514   0.753
  207    H    ARG  25           H        ARG  25  -4.125   0.923   7.480
  208    HA   ARG  25           HA       ARG  25  -5.813   2.416   9.321
  209   1HB   ARG  25          1HB       ARG  25  -4.904  -0.390   9.218
  210   2HB   ARG  25          2HB       ARG  25  -4.553   0.342  10.770
  211   1HG   ARG  25          1HG       ARG  25  -7.117   1.251  10.378
  212   2HG   ARG  25          2HG       ARG  25  -7.195  -0.270   9.513
  213   1HD   ARG  25          1HD       ARG  25  -7.653  -1.137  11.594
  214   2HD   ARG  25          2HD       ARG  25  -5.909  -1.113  11.775
  215    HE   ARG  25           HE       ARG  25  -6.092   0.697  13.268
  216   1HH1  ARG  25          2HH2      ARG  25  -9.192   0.210  11.623
  217   2HH1  ARG  25          1HH2      ARG  25 -10.051   1.309  12.649
  218   1HH2  ARG  25          1HH       ARG  25  -8.874   2.437  14.407
  219    H    GLU  26           H        GLU  26  -2.529   0.832   9.161
  220    HA   GLU  26           HA       GLU  26  -1.481   2.442  11.182
  221   1HB   GLU  26          1HB       GLU  26   0.289   1.036  10.992
  222   2HB   GLU  26          2HB       GLU  26  -0.678   0.170   9.815
  223   1HG   GLU  26          1HG       GLU  26   1.290   0.572   8.600
  224   2HG   GLU  26          2HG       GLU  26   0.283   1.909   8.083
  225    HE2  GLU  26           HE       GLU  26   1.833   3.886   8.224
  226    H    ILE  27           H        ILE  27  -2.288   3.120   7.914
  227    HA   ILE  27           HA       ILE  27  -0.224   5.132   7.599
  228    HB   ILE  27           HB       ILE  27  -1.429   3.470   5.847
  229   1HG1  ILE  27          1HG1      ILE  27  -0.040   6.117   5.502
  230   2HG1  ILE  27          2HG1      ILE  27   0.583   4.497   5.255
  231   1HG2  ILE  27          1HG2      ILE  27  -2.884   4.864   4.384
  232   2HG2  ILE  27          2HG2      ILE  27  -3.606   4.479   5.965
  233   3HG2  ILE  27          3HG2      ILE  27  -2.927   6.097   5.668
  234   1HD1  ILE  27          1HD1      ILE  27   0.204   5.456   3.068
  235   2HD1  ILE  27          2HD1      ILE  27  -1.070   4.242   3.326
  236   3HD1  ILE  27          3HD1      ILE  27  -1.438   5.973   3.514
  237    H    LYS  28           H        LYS  28  -1.321   7.286   6.492
  238    HA   LYS  28           HA       LYS  28  -3.103   8.237   8.608
  239   1HB   LYS  28          1HB       LYS  28  -2.332  10.473   7.977
  240   2HB   LYS  28          2HB       LYS  28  -0.993   9.426   8.404
  241   1HG   LYS  28          1HG       LYS  28  -1.350   9.029   5.622
  242   2HG   LYS  28          2HG       LYS  28  -1.564  10.753   5.852
  243   1HD   LYS  28          1HD       LYS  28   0.719  10.842   5.783
  244   2HD   LYS  28          2HD       LYS  28   0.637  10.303   7.448
  245   1HE   LYS  28          1HE       LYS  28   0.519   7.874   6.336
  246   2HE   LYS  28          2HE       LYS  28   1.240   8.689   4.961
  247   1HZ   LYS  28          1HZ       LYS  28   2.668   9.547   7.177
  248   2HZ   LYS  28          2HZ       LYS  28   2.486   7.945   7.400
  249    H    ASP  29           H        ASP  29  -4.888   6.993   7.520
  250    HA   ASP  29           HA       ASP  29  -5.676   7.982   4.966
  251   1HB   ASP  29          1HB       ASP  29  -6.573   5.893   5.006
  252   2HB   ASP  29          2HB       ASP  29  -6.351   5.767   6.742
  253    HD2  ASP  29           HD       ASP  29  -8.646   5.828   4.422
  254    HA   PRO  30           HA       PRO  30  -9.003   9.808   7.877
  255   1HB   PRO  30          1HB       PRO  30  -8.639   9.690  10.582
  256   2HB   PRO  30          2HB       PRO  30  -9.601   8.527   9.693
  257   1HG   PRO  30          1HG       PRO  30  -6.894   8.205  10.836
  258   2HG   PRO  30          2HG       PRO  30  -8.027   6.967  10.331
  259   1HD   PRO  30          1HD       PRO  30  -5.700   7.847   8.905
  260   2HD   PRO  30          2HD       PRO  30  -6.896   6.693   8.350
  261    H    ARG  31           H        ARG  31  -5.678  10.175   8.362
  262    HA   ARG  31           HA       ARG  31  -5.904  12.711   9.587
  263   1HB   ARG  31          1HB       ARG  31  -3.855  10.830   9.176
  264   2HB   ARG  31          2HB       ARG  31  -3.372  12.169   8.152
  265   1HG   ARG  31          1HG       ARG  31  -3.082  13.630   9.945
  266   2HG   ARG  31          2HG       ARG  31  -4.324  12.864  10.917
  267   1HD   ARG  31          1HD       ARG  31  -2.832  10.933  11.362
  268   2HD   ARG  31          2HD       ARG  31  -1.602  11.610  10.312
  269    HE   ARG  31           HE       ARG  31  -2.292  13.564  12.294
  270   1HH1  ARG  31          2HH2      ARG  31  -0.612  10.456  12.016
  271   2HH1  ARG  31          1HH2      ARG  31   0.426  10.756  13.369
  272   1HH2  ARG  31          1HH       ARG  31   0.226  12.821  14.569
  273    H    LEU  32           H        LEU  32  -5.910  11.425   6.305
  274    HA   LEU  32           HA       LEU  32  -5.274  13.997   5.136
  275   1HB   LEU  32          1HB       LEU  32  -5.900  11.286   3.969
  276   2HB   LEU  32          2HB       LEU  32  -5.628  12.720   2.999
  277    HG   LEU  32           HG       LEU  32  -3.583  11.689   4.974
  278   1HD1  LEU  32          1HD1      LEU  32  -2.774  10.158   3.544
  279   2HD1  LEU  32          2HD1      LEU  32  -4.418  10.190   2.867
  280   3HD1  LEU  32          3HD1      LEU  32  -3.124  11.150   2.109
  281   1HD2  LEU  32          1HD2      LEU  32  -2.031  12.958   3.435
  282   2HD2  LEU  32          2HD2      LEU  32  -3.485  13.650   2.675
  283   3HD2  LEU  32          3HD2      LEU  32  -3.154  13.949   4.398
  284    H    GLY  33           H        GLY  33  -8.030  12.134   6.204
  285   1HA   GLY  33          1HA       GLY  33 -10.172  12.909   6.416
  286   2HA   GLY  33          2HA       GLY  33  -9.796  14.286   5.401
  287    H    MET  34           H        MET  34  -8.771  11.149   4.205
  288    HA   MET  34           HA       MET  34 -11.213  10.873   2.680
  289   1HB   MET  34          1HB       MET  34  -8.450  10.840   1.358
  290   2HB   MET  34          2HB       MET  34 -10.003  10.811   0.546
  291   1HG   MET  34          1HG       MET  34 -10.496  13.107   1.264
  292   2HG   MET  34          2HG       MET  34  -9.075  13.144   2.288
  293   1HE   MET  34          1HE       MET  34  -6.841  14.886   0.627
  294   2HE   MET  34          2HE       MET  34  -7.158  13.690   1.908
  295   3HE   MET  34          3HE       MET  34  -6.171  13.243   0.496
  296    H    MET  35           H        MET  35 -11.165   8.735   1.365
  297    HA   MET  35           HA       MET  35  -9.833   6.774   3.051
  298   1HB   MET  35          1HB       MET  35 -12.487   7.011   2.270
  299   2HB   MET  35          2HB       MET  35 -11.888   5.922   1.036
  300   1HG   MET  35          1HG       MET  35 -12.401   4.329   2.632
  301   2HG   MET  35          2HG       MET  35 -10.784   4.703   3.191
  302   1HE   MET  35          1HE       MET  35 -14.416   4.353   4.616
  303   2HE   MET  35          2HE       MET  35 -14.775   6.072   4.909
  304   3HE   MET  35          3HE       MET  35 -14.411   5.507   3.261
  305    H    THR  36           H        THR  36  -8.096   5.679   2.247
  306    HA   THR  36           HA       THR  36  -7.477   5.982  -0.570
  307    HB   THR  36           HB       THR  36  -5.312   4.947   0.188
  308    HG1  THR  36           HG1      THR  36  -5.272   4.181   2.345
  309   1HG2  THR  36          1HG2      THR  36  -6.034   6.869   2.410
  310   2HG2  THR  36          2HG2      THR  36  -4.543   6.781   1.444
  311   3HG2  THR  36          3HG2      THR  36  -6.019   7.481   0.738
  312    H    THR  37           H        THR  37  -6.651   4.040  -1.807
  313    HA   THR  37           HA       THR  37  -8.029   1.578  -1.051
  314    HB   THR  37           HB       THR  37  -8.605   3.337  -3.460
  315    HG1  THR  37           HG1      THR  37 -10.588   3.141  -2.455
  316   1HG2  THR  37          1HG2      THR  37  -9.745   1.411  -4.521
  317   2HG2  THR  37          2HG2      THR  37  -8.007   1.055  -4.366
  318   3HG2  THR  37          3HG2      THR  37  -9.169   0.334  -3.226
  319    H    VAL  38           H        VAL  38  -7.404  -0.244  -2.615
  320    HA   VAL  38           HA       VAL  38  -4.649   0.208  -3.526
  321    HB   VAL  38           HB       VAL  38  -5.708  -2.212  -2.051
  322   1HG1  VAL  38          1HG1      VAL  38  -2.796  -1.808  -2.356
  323   2HG1  VAL  38          2HG1      VAL  38  -3.774  -3.290  -2.495
  324   3HG1  VAL  38          3HG1      VAL  38  -3.669  -2.159  -3.866
  325   1HG2  VAL  38          1HG2      VAL  38  -3.791  -1.300  -0.425
  326   2HG2  VAL  38          2HG2      VAL  38  -4.287   0.251  -1.142
  327   3HG2  VAL  38          3HG2      VAL  38  -5.483  -0.762  -0.299
  328    H    SER  39           H        SER  39  -5.326   0.458  -5.697
  329    HA   SER  39           HA       SER  39  -6.916  -1.686  -6.788
  330   1HB   SER  39          1HB       SER  39  -6.679   1.068  -7.332
  331   2HB   SER  39          2HB       SER  39  -5.914   0.299  -8.709
  332    HG   SER  39           HG       SER  39  -8.614   0.344  -7.950
  333    H    GLY  40           H        GLY  40  -4.178  -2.232  -5.797
  334   1HA   GLY  40          1HA       GLY  40  -3.206  -3.803  -7.895
  335   2HA   GLY  40          2HA       GLY  40  -2.299  -2.303  -7.894
  336    H    VAL  41           H        VAL  41  -1.571  -5.186  -7.140
  337    HA   VAL  41           HA       VAL  41  -0.128  -4.459  -4.753
  338    HB   VAL  41           HB       VAL  41  -2.236  -5.284  -3.852
  339   1HG1  VAL  41          1HG1      VAL  41  -1.781  -7.459  -5.823
  340   2HG1  VAL  41          2HG1      VAL  41  -2.423  -7.957  -4.238
  341   3HG1  VAL  41          3HG1      VAL  41  -3.298  -6.754  -5.216
  342   1HG2  VAL  41          1HG2      VAL  41  -0.703  -7.628  -3.113
  343   2HG2  VAL  41          2HG2      VAL  41   0.346  -6.193  -3.206
  344   3HG2  VAL  41          3HG2      VAL  41  -1.092  -6.179  -2.157
  345    H    GLU  42           H        GLU  42   1.855  -5.514  -4.647
  346    HA   GLU  42           HA       GLU  42   2.217  -7.780  -6.397
  347   1HB   GLU  42          1HB       GLU  42   4.194  -5.486  -6.563
  348   2HB   GLU  42          2HB       GLU  42   4.021  -6.852  -7.648
  349   1HG   GLU  42          1HG       GLU  42   1.865  -6.002  -8.471
  350   2HG   GLU  42          2HG       GLU  42   1.867  -4.718  -7.276
  351    HE2  GLU  42           HE       GLU  42   4.236  -5.932  -9.513
  352    H    MET  43           H        MET  43   3.681  -9.273  -5.556
  353    HA   MET  43           HA       MET  43   5.401  -8.335  -3.420
  354   1HB   MET  43          1HB       MET  43   4.138 -10.987  -2.910
  355   2HB   MET  43          2HB       MET  43   4.417  -9.667  -1.791
  356   1HG   MET  43          1HG       MET  43   2.470  -8.433  -2.964
  357   2HG   MET  43          2HG       MET  43   2.121  -9.944  -3.781
  358   1HE   MET  43          1HE       MET  43   0.894  -8.350  -0.021
  359   2HE   MET  43          2HE       MET  43   1.022  -7.822  -1.716
  360   3HE   MET  43          3HE       MET  43  -0.337  -8.851  -1.204
  361    H    SER  44           H        SER  44   7.415  -8.846  -4.172
  362    HA   SER  44           HA       SER  44   7.659 -11.409  -5.538
  363   1HB   SER  44          1HB       SER  44   8.487  -8.826  -6.316
  364   2HB   SER  44          2HB       SER  44   9.966  -9.613  -5.799
  365    HG   SER  44           HG       SER  44   9.519 -11.361  -7.269
  366    H    ARG  45           H        ARG  45   8.367 -12.951  -4.099
  367    HA   ARG  45           HA       ARG  45  10.200 -12.064  -2.043
  368   1HB   ARG  45          1HB       ARG  45   8.218 -14.297  -2.321
  369   2HB   ARG  45          2HB       ARG  45   9.666 -14.685  -1.415
  370   1HG   ARG  45          1HG       ARG  45   8.900 -13.542   0.386
  371   2HG   ARG  45          2HG       ARG  45   8.749 -12.078  -0.564
  372   1HD   ARG  45          1HD       ARG  45   6.565 -12.797   0.445
  373   2HD   ARG  45          2HD       ARG  45   6.497 -12.710  -1.305
  374    HE   ARG  45           HE       ARG  45   7.265 -15.357  -0.673
  375   1HH1  ARG  45          2HH2      ARG  45   4.459 -13.262  -0.139
  376   2HH1  ARG  45          1HH2      ARG  45   3.331 -14.575  -0.087
  377   1HH2  ARG  45          1HH       ARG  45   4.128 -16.818  -0.364
  378    H    ASP  46           H        ASP  46  10.331 -13.231  -5.151
  379    HA   ASP  46           HA       ASP  46  11.979 -15.420  -5.025
  380   1HB   ASP  46          1HB       ASP  46  11.162 -13.411  -7.007
  381   2HB   ASP  46          2HB       ASP  46  12.822 -13.906  -7.268
  382    HD2  ASP  46           HD       ASP  46  10.439 -16.997  -6.985
  383    H    LEU  47           H        LEU  47  12.517 -12.108  -4.144
  384    HA   LEU  47           HA       LEU  47  15.340 -12.661  -3.754
  385   1HB   LEU  47          1HB       LEU  47  14.545 -11.256  -5.981
  386   2HB   LEU  47          2HB       LEU  47  14.865  -9.975  -4.828
  387    HG   LEU  47           HG       LEU  47  17.132 -11.134  -4.429
  388   1HD1  LEU  47          1HD1      LEU  47  16.858 -13.252  -5.409
  389   2HD1  LEU  47          2HD1      LEU  47  16.200 -12.568  -6.915
  390   3HD1  LEU  47          3HD1      LEU  47  17.924 -12.360  -6.523
  391   1HD2  LEU  47          1HD2      LEU  47  18.153  -9.763  -5.994
  392   2HD2  LEU  47          2HD2      LEU  47  16.879 -10.020  -7.209
  393   3HD2  LEU  47          3HD2      LEU  47  16.559  -8.999  -5.787
  394    H    ALA  48           H        ALA  48  13.129  -9.781  -3.614
  395    HA   ALA  48           HA       ALA  48  12.384  -9.771  -1.064
  396   1HB   ALA  48          1HB       ALA  48  15.323  -9.185  -1.259
  397   2HB   ALA  48          2HB       ALA  48  14.353  -8.266  -0.082
  398   3HB   ALA  48          3HB       ALA  48  14.414 -10.043   0.009
  399    H    TYR  49           H        TYR  49  11.231  -8.753  -3.201
  400    HA   TYR  49           HA       TYR  49  11.243  -5.910  -2.658
  401   1HB   TYR  49          1HB       TYR  49  11.565  -5.428  -5.100
  402   2HB   TYR  49          2HB       TYR  49  12.945  -6.320  -4.492
  403    HD1  TYR  49           HD1      TYR  49  13.309  -8.671  -5.130
  404    HD2  TYR  49           HD2      TYR  49  10.004  -6.438  -6.678
  405    HE1  TYR  49           HE1      TYR  49  12.961 -10.424  -6.939
  406    HE2  TYR  49           HE2      TYR  49   9.668  -8.198  -8.482
  407    HH   TYR  49           HH       TYR  49  11.990 -10.759  -8.955
  408    H    ALA  50           H        ALA  50   9.203  -5.038  -2.856
  409    HA   ALA  50           HA       ALA  50   7.242  -6.532  -4.410
  410   1HB   ALA  50          1HB       ALA  50   5.667  -6.154  -2.360
  411   2HB   ALA  50          2HB       ALA  50   6.810  -7.518  -2.324
  412   3HB   ALA  50          3HB       ALA  50   7.180  -6.024  -1.431
  413    H    LYS  51           H        LYS  51   5.255  -5.209  -4.808
  414    HA   LYS  51           HA       LYS  51   5.611  -2.372  -4.283
  415   1HB   LYS  51          1HB       LYS  51   4.828  -2.743  -7.046
  416   2HB   LYS  51          2HB       LYS  51   6.099  -1.748  -6.367
  417   1HG   LYS  51          1HG       LYS  51   7.555  -3.809  -6.178
  418   2HG   LYS  51          2HG       LYS  51   6.294  -4.740  -6.961
  419   1HD   LYS  51          1HD       LYS  51   7.834  -4.129  -8.702
  420   2HD   LYS  51          2HD       LYS  51   6.428  -3.108  -8.927
  421   1HE   LYS  51          1HE       LYS  51   7.525  -1.177  -8.103
  422   2HE   LYS  51          2HE       LYS  51   8.707  -2.106  -7.202
  423   1HZ   LYS  51          1HZ       LYS  51   8.984  -2.777  -9.911
  424   2HZ   LYS  51          2HZ       LYS  51   8.935  -1.151  -9.833
  425    H    VAL  52           H        VAL  52   3.731  -1.613  -3.484
  426    HA   VAL  52           HA       VAL  52   1.288  -3.005  -4.342
  427    HB   VAL  52           HB       VAL  52   2.212  -3.245  -1.915
  428   1HG1  VAL  52          1HG1      VAL  52   0.817  -0.554  -1.715
  429   2HG1  VAL  52          2HG1      VAL  52   1.442  -1.526  -0.362
  430   3HG1  VAL  52          3HG1      VAL  52   2.568  -0.827  -1.549
  431   1HG2  VAL  52          1HG2      VAL  52   0.138  -4.224  -2.410
  432   2HG2  VAL  52          2HG2      VAL  52  -0.221  -3.122  -1.059
  433   3HG2  VAL  52          3HG2      VAL  52  -0.636  -2.653  -2.725
  434    H    TYR  53           H        TYR  53  -0.404  -1.748  -5.082
  435    HA   TYR  53           HA       TYR  53   0.257   1.038  -5.551
  436   1HB   TYR  53          1HB       TYR  53  -1.136  -1.135  -6.815
  437   2HB   TYR  53          2HB       TYR  53  -2.394   0.000  -6.372
  438    HD1  TYR  53           HD1      TYR  53  -0.454   2.483  -6.702
  439    HD2  TYR  53           HD2      TYR  53  -1.513  -0.824  -9.201
  440    HE1  TYR  53           HE1      TYR  53   0.072   3.868  -8.768
  441    HE2  TYR  53           HE2      TYR  53  -0.983   0.572 -11.259
  442    HH   TYR  53           HH       TYR  53   0.836   3.070 -11.321
  443    H    VAL  54           H        VAL  54  -1.041   2.816  -4.903
  444    HA   VAL  54           HA       VAL  54  -3.270   2.247  -3.135
  445    HB   VAL  54           HB       VAL  54  -2.389   3.617  -1.342
  446   1HG1  VAL  54          1HG1      VAL  54  -2.008   1.238  -1.162
  447   2HG1  VAL  54          2HG1      VAL  54  -0.541   1.353  -2.164
  448   3HG1  VAL  54          3HG1      VAL  54  -0.574   2.096  -0.548
  449   1HG2  VAL  54          1HG2      VAL  54  -0.958   5.153  -2.497
  450   2HG2  VAL  54          2HG2      VAL  54   0.054   4.242  -1.352
  451   3HG2  VAL  54          3HG2      VAL  54   0.085   3.836  -3.085
  452    H    THR  55           H        THR  55  -4.908   3.522  -3.810
  453    HA   THR  55           HA       THR  55  -4.170   6.024  -5.174
  454    HB   THR  55           HB       THR  55  -5.388   4.830  -6.768
  455    HG1  THR  55           HG1      THR  55  -7.162   6.155  -6.694
  456   1HG2  THR  55          1HG2      THR  55  -7.440   3.410  -6.031
  457   2HG2  THR  55          2HG2      THR  55  -5.834   2.743  -5.647
  458   3HG2  THR  55          3HG2      THR  55  -6.790   3.548  -4.379
  459    H    PHE  56           H        PHE  56  -4.582   7.915  -4.221
  460    HA   PHE  56           HA       PHE  56  -6.482   7.843  -1.985
  461   1HB   PHE  56          1HB       PHE  56  -4.204   9.822  -2.548
  462   2HB   PHE  56          2HB       PHE  56  -5.055   9.619  -1.029
  463    HD1  PHE  56           HD1      PHE  56  -5.005   6.579  -0.948
  464    HD2  PHE  56           HD2      PHE  56  -1.993   9.438  -1.823
  465    HE1  PHE  56           HE1      PHE  56  -3.245   4.962  -0.180
  466    HE2  PHE  56           HE2      PHE  56  -0.234   7.821  -1.056
  467    HZ   PHE  56           HZ       PHE  56  -0.882   5.603  -0.244
  468    H    LEU  57           H        LEU  57  -7.625   9.966  -1.572
  469    HA   LEU  57           HA       LEU  57  -8.430  11.070  -4.149
  470   1HB   LEU  57          1HB       LEU  57  -9.970  10.050  -2.286
  471   2HB   LEU  57          2HB       LEU  57  -9.802  11.631  -1.550
  472    HG   LEU  57           HG       LEU  57 -10.625  12.635  -3.721
  473   1HD1  LEU  57          1HD1      LEU  57 -11.823  10.011  -4.461
  474   2HD1  LEU  57          2HD1      LEU  57 -11.369  11.400  -5.478
  475   3HD1  LEU  57          3HD1      LEU  57 -10.115  10.287  -4.878
  476   1HD2  LEU  57          1HD2      LEU  57 -13.024  11.351  -3.193
  477   2HD2  LEU  57          2HD2      LEU  57 -12.118  11.205  -1.667
  478   3HD2  LEU  57          3HD2      LEU  57 -12.398  12.808  -2.386
  479    H    ASN  58           H        ASN  58  -5.884  11.664  -2.434
  480    HA   ASN  58           HA       ASN  58  -6.140  14.177  -1.362
  481   1HB   ASN  58          1HB       ASN  58  -3.977  12.363  -2.170
  482   2HB   ASN  58          2HB       ASN  58  -3.534  14.023  -2.511
  483   1HD2  ASN  58          1HD2      ASN  58  -4.812  15.419  -0.553
  484   2HD2  ASN  58          2HD2      ASN  58  -4.182  15.021   1.012
  485    H    ASP  59           H        ASP  59  -5.732  12.994  -4.707
  486    HA   ASP  59           HA       ASP  59  -4.712  15.006  -6.060
  487   1HB   ASP  59          1HB       ASP  59  -6.554  14.493  -7.844
  488   2HB   ASP  59          2HB       ASP  59  -5.483  13.195  -7.353
  489    HD2  ASP  59           HD       ASP  59  -8.638  14.437  -6.271
  490    H    LYS  60           H        LYS  60  -7.924  14.889  -4.476
  491    HA   LYS  60           HA       LYS  60  -9.285  16.907  -5.628
  492   1HB   LYS  60          1HB       LYS  60  -9.197  15.651  -2.977
  493   2HB   LYS  60          2HB       LYS  60  -9.790  17.298  -2.935
  494   1HG   LYS  60          1HG       LYS  60 -11.607  16.828  -4.381
  495   2HG   LYS  60          2HG       LYS  60 -10.835  15.410  -5.061
  496   1HD   LYS  60          1HD       LYS  60 -12.536  14.558  -3.609
  497   2HD   LYS  60          2HD       LYS  60 -11.034  14.321  -2.741
  498   1HE   LYS  60          1HE       LYS  60 -11.513  15.969  -1.162
  499   2HE   LYS  60          2HE       LYS  60 -12.443  16.936  -2.289
  500   1HZ   LYS  60          1HZ       LYS  60 -14.006  14.797  -2.143
  501   2HZ   LYS  60          2HZ       LYS  60 -13.334  14.684  -0.664
  502    H    ASP  61           H        ASP  61  -6.641  17.212  -3.183
  503    HA   ASP  61           HA       ASP  61  -6.480  20.003  -4.007
  504   1HB   ASP  61          1HB       ASP  61  -5.610  19.081  -1.257
  505   2HB   ASP  61          2HB       ASP  61  -6.047  20.696  -1.777
  506    HD2  ASP  61           HD       ASP  61  -8.895  20.314  -2.505
  507    H    GLU  62           H        GLU  62  -4.448  20.451  -4.884
  508    HA   GLU  62           HA       GLU  62  -2.503  18.446  -4.955
  509   1HB   GLU  62          1HB       GLU  62  -2.952  20.322  -6.662
  510   2HB   GLU  62          2HB       GLU  62  -2.071  21.391  -5.590
  511   1HG   GLU  62          1HG       GLU  62  -0.272  19.359  -5.702
  512   2HG   GLU  62          2HG       GLU  62  -1.054  19.103  -7.250
  513    HE2  GLU  62           HE       GLU  62   0.573  21.856  -5.521
  514    H    ASP  63           H        ASP  63  -3.240  21.015  -2.694
  515    HA   ASP  63           HA       ASP  63  -0.652  21.368  -1.697
  516   1HB   ASP  63          1HB       ASP  63  -3.276  22.381  -1.211
  517   2HB   ASP  63          2HB       ASP  63  -2.727  21.740   0.324
  518    HD2  ASP  63           HD       ASP  63  -1.780  23.425   1.482
  519    H    ALA  64           H        ALA  64  -3.485  19.286  -0.840
  520    HA   ALA  64           HA       ALA  64  -2.131  18.128   1.413
  521   1HB   ALA  64          1HB       ALA  64  -4.177  16.846   1.655
  522   2HB   ALA  64          2HB       ALA  64  -4.610  18.530   1.272
  523   3HB   ALA  64          3HB       ALA  64  -4.694  17.279   0.008
  524    H    VAL  65           H        VAL  65  -2.233  17.674  -2.033
  525    HA   VAL  65           HA       VAL  65  -1.714  14.873  -2.002
  526    HB   VAL  65           HB       VAL  65  -2.492  16.776  -3.850
  527   1HG1  VAL  65          1HG1      VAL  65  -0.864  16.746  -5.647
  528   2HG1  VAL  65          2HG1      VAL  65  -0.108  17.403  -4.175
  529   3HG1  VAL  65          3HG1      VAL  65   0.235  15.732  -4.681
  530   1HG2  VAL  65          1HG2      VAL  65  -1.958  13.875  -3.784
  531   2HG2  VAL  65          2HG2      VAL  65  -3.376  14.770  -4.379
  532   3HG2  VAL  65          3HG2      VAL  65  -1.936  14.595  -5.411
  533    H    LYS  66           H        LYS  66   0.246  17.893  -2.214
  534    HA   LYS  66           HA       LYS  66   2.684  16.428  -2.497
  535   1HB   LYS  66          1HB       LYS  66   1.789  19.164  -2.698
  536   2HB   LYS  66          2HB       LYS  66   3.202  19.085  -1.667
  537   1HG   LYS  66          1HG       LYS  66   4.590  18.348  -3.371
  538   2HG   LYS  66          2HG       LYS  66   3.325  17.421  -4.152
  539   1HD   LYS  66          1HD       LYS  66   2.259  19.688  -4.806
  540   2HD   LYS  66          2HD       LYS  66   3.754  20.435  -4.281
  541   1HE   LYS  66          1HE       LYS  66   4.440  18.205  -5.981
  542   2HE   LYS  66          2HE       LYS  66   3.193  19.130  -6.796
  543   1HZ   LYS  66          1HZ       LYS  66   5.914  19.869  -6.297
  544   2HZ   LYS  66          2HZ       LYS  66   4.857  20.523  -7.351
  545    H    ALA  67           H        ALA  67   1.006  18.231   0.156
  546    HA   ALA  67           HA       ALA  67   3.008  17.721   2.063
  547   1HB   ALA  67          1HB       ALA  67   0.043  18.345   2.376
  548   2HB   ALA  67          2HB       ALA  67   1.270  18.465   3.660
  549   3HB   ALA  67          3HB       ALA  67   1.357  19.539   2.244
  550    H    GLY  68           H        GLY  68  -0.189  16.142   1.372
  551   1HA   GLY  68          1HA       GLY  68  -0.088  14.188   3.331
  552   2HA   GLY  68          2HA       GLY  68  -0.929  14.064   1.800
  553    H    ILE  69           H        ILE  69   0.797  13.803  -0.182
  554    HA   ILE  69           HA       ILE  69   1.823  11.262   0.058
  555    HB   ILE  69           HB       ILE  69   1.259  12.669  -2.002
  556   1HG1  ILE  69          1HG1      ILE  69   3.823  11.190  -2.426
  557   2HG1  ILE  69          2HG1      ILE  69   2.476  10.315  -1.728
  558   1HG2  ILE  69          1HG2      ILE  69   3.029  14.434  -1.242
  559   2HG2  ILE  69          2HG2      ILE  69   4.179  13.354  -2.067
  560   3HG2  ILE  69          3HG2      ILE  69   2.818  14.063  -2.969
  561   1HD1  ILE  69          1HD1      ILE  69   1.150  10.534  -3.640
  562   2HD1  ILE  69          2HD1      ILE  69   1.953  12.038  -4.150
  563   3HD1  ILE  69          3HD1      ILE  69   2.771  10.474  -4.372
  564    H    LYS  70           H        LYS  70   3.277  14.431   0.815
  565    HA   LYS  70           HA       LYS  70   5.925  13.522   1.003
  566   1HB   LYS  70          1HB       LYS  70   5.441  15.862   0.748
  567   2HB   LYS  70          2HB       LYS  70   4.477  15.891   2.210
  568   1HG   LYS  70          1HG       LYS  70   6.846  14.883   3.194
  569   2HG   LYS  70          2HG       LYS  70   7.446  15.895   1.895
  570   1HD   LYS  70          1HD       LYS  70   7.263  17.629   3.359
  571   2HD   LYS  70          2HD       LYS  70   5.537  17.545   3.066
  572   1HE   LYS  70          1HE       LYS  70   5.152  16.200   5.020
  573   2HE   LYS  70          2HE       LYS  70   6.849  15.792   5.179
  574   1HZ   LYS  70          1HZ       LYS  70   6.191  17.533   6.754
  575   2HZ   LYS  70          2HZ       LYS  70   7.307  18.121   5.724
  576    H    ALA  71           H        ALA  71   3.134  13.491   3.231
  577    HA   ALA  71           HA       ALA  71   4.701  12.763   5.497
  578   1HB   ALA  71          1HB       ALA  71   1.758  12.896   4.814
  579   2HB   ALA  71          2HB       ALA  71   2.307  12.161   6.339
  580   3HB   ALA  71          3HB       ALA  71   2.683  13.865   5.986
  581    H    LEU  72           H        LEU  72   2.826  11.058   2.949
  582    HA   LEU  72           HA       LEU  72   3.070   8.518   4.189
  583   1HB   LEU  72          1HB       LEU  72   1.546   9.604   2.198
  584   2HB   LEU  72          2HB       LEU  72   2.674   8.630   1.278
  585    HG   LEU  72           HG       LEU  72   1.866   6.925   3.328
  586   1HD1  LEU  72          1HD1      LEU  72  -0.778   7.476   2.410
  587   2HD1  LEU  72          2HD1      LEU  72  -0.147   7.477   4.074
  588   3HD1  LEU  72          3HD1      LEU  72  -0.102   8.968   3.105
  589   1HD2  LEU  72          1HD2      LEU  72   1.499   7.187   0.418
  590   2HD2  LEU  72          2HD2      LEU  72   2.014   5.793   1.398
  591   3HD2  LEU  72          3HD2      LEU  72   0.283   6.177   1.237
  592    H    GLN  73           H        GLN  73   5.187  10.580   2.333
  593    HA   GLN  73           HA       GLN  73   6.775   8.427   1.362
  594   1HB   GLN  73          1HB       GLN  73   6.443  10.892   0.431
  595   2HB   GLN  73          2HB       GLN  73   7.746  11.285   1.536
  596   1HG   GLN  73          1HG       GLN  73   8.346   8.846   0.008
  597   2HG   GLN  73          2HG       GLN  73   8.002  10.193  -1.059
  598   1HE2  GLN  73          1HE2      GLN  73   9.245  12.076  -0.969
  599   2HE2  GLN  73          2HE2      GLN  73  10.835  12.113  -0.280
  600    H    GLU  74           H        GLU  74   6.975  10.887   4.004
  601    HA   GLU  74           HA       GLU  74   9.503  10.035   4.860
  602   1HB   GLU  74          1HB       GLU  74   9.266  11.628   6.569
  603   2HB   GLU  74          2HB       GLU  74   8.232  12.273   5.311
  604   1HG   GLU  74          1HG       GLU  74   6.722  12.390   7.055
  605   2HG   GLU  74          2HG       GLU  74   6.386  10.745   6.555
  606    HE2  GLU  74           HE       GLU  74   6.590  10.107   9.741
  607    H    ALA  75           H        ALA  75   6.197   8.920   5.407
  608    HA   ALA  75           HA       ALA  75   7.055   7.282   7.663
  609   1HB   ALA  75          1HB       ALA  75   4.279   7.093   6.633
  610   2HB   ALA  75          2HB       ALA  75   4.870   7.317   8.297
  611   3HB   ALA  75          3HB       ALA  75   4.767   8.710   7.193
  612    H    SER  76           H        SER  76   7.830   7.013   4.653
  613    HA   SER  76           HA       SER  76   6.534   4.834   3.603
  614   1HB   SER  76          1HB       SER  76   7.972   6.060   2.164
  615   2HB   SER  76          2HB       SER  76   9.325   5.968   3.274
  616    HG   SER  76           HG       SER  76   9.431   4.512   1.361
  617    H    GLY  77           H        GLY  77   9.919   4.719   4.933
  618   1HA   GLY  77          1HA       GLY  77  10.123   2.013   5.267
  619   2HA   GLY  77          2HA       GLY  77  10.951   3.208   6.246
  620    H    PHE  78           H        PHE  78   8.131   4.283   7.083
  621    HA   PHE  78           HA       PHE  78   7.993   2.744   9.457
  622   1HB   PHE  78          1HB       PHE  78   6.927   5.199   8.220
  623   2HB   PHE  78          2HB       PHE  78   5.636   4.345   9.041
  624    HD1  PHE  78           HD1      PHE  78   7.975   6.823   9.457
  625    HD2  PHE  78           HD2      PHE  78   6.466   3.408  11.473
  626    HE1  PHE  78           HE1      PHE  78   8.733   7.783  11.651
  627    HE2  PHE  78           HE2      PHE  78   7.224   4.366  13.665
  628    HZ   PHE  78           HZ       PHE  78   8.350   6.543  13.728
  629    H    ILE  79           H        ILE  79   5.894   3.105   6.529
  630    HA   ILE  79           HA       ILE  79   3.910   1.344   7.495
  631    HB   ILE  79           HB       ILE  79   3.201   1.350   5.080
  632   1HG1  ILE  79          1HG1      ILE  79   5.296   3.483   4.676
  633   2HG1  ILE  79          2HG1      ILE  79   5.629   1.803   4.305
  634   1HG2  ILE  79          1HG2      ILE  79   2.753   3.913   5.151
  635   2HG2  ILE  79          2HG2      ILE  79   2.060   2.861   6.410
  636   3HG2  ILE  79          3HG2      ILE  79   3.518   3.823   6.756
  637   1HD1  ILE  79          1HD1      ILE  79   4.380   1.867   2.406
  638   2HD1  ILE  79          2HD1      ILE  79   3.023   2.664   3.236
  639   3HD1  ILE  79          3HD1      ILE  79   4.375   3.635   2.608
  640    H    ARG  80           H        ARG  80   6.888   0.966   5.526
  641    HA   ARG  80           HA       ARG  80   6.375  -1.637   4.748
  642   1HB   ARG  80          1HB       ARG  80   8.134  -0.254   3.703
  643   2HB   ARG  80          2HB       ARG  80   9.019  -0.168   5.213
  644   1HG   ARG  80          1HG       ARG  80   9.194  -2.730   5.138
  645   2HG   ARG  80          2HG       ARG  80   8.527  -2.659   3.520
  646   1HD   ARG  80          1HD       ARG  80  10.686  -2.417   2.814
  647   2HD   ARG  80          2HD       ARG  80  10.554  -0.760   3.372
  648    HE   ARG  80           HE       ARG  80  11.216  -2.273   5.653
  649   1HH1  ARG  80          2HH2      ARG  80  12.695  -1.575   2.510
  650   2HH1  ARG  80          1HH2      ARG  80  14.316  -1.749   3.095
  651   1HH2  ARG  80          1HH       ARG  80  14.680  -2.294   5.400
  652    H    SER  81           H        SER  81   8.096  -0.234   7.606
  653    HA   SER  81           HA       SER  81   8.885  -2.741   8.598
  654   1HB   SER  81          1HB       SER  81   8.851   0.091   9.600
  655   2HB   SER  81          2HB       SER  81   9.008  -1.176  10.800
  656    HG   SER  81           HG       SER  81  10.755  -1.994   9.138
  657    H    LEU  82           H        LEU  82   6.049  -0.595   9.025
  658    HA   LEU  82           HA       LEU  82   4.980  -1.799  11.293
  659   1HB   LEU  82          1HB       LEU  82   4.357   0.385  10.190
  660   2HB   LEU  82          2HB       LEU  82   3.443  -0.545   9.020
  661    HG   LEU  82           HG       LEU  82   1.716  -0.218  10.403
  662   1HD1  LEU  82          1HD1      LEU  82   3.203  -2.329  11.983
  663   2HD1  LEU  82          2HD1      LEU  82   1.513  -1.861  12.284
  664   3HD1  LEU  82          3HD1      LEU  82   1.975  -2.572  10.718
  665   1HD2  LEU  82          1HD2      LEU  82   3.515   1.242  11.797
  666   2HD2  LEU  82          2HD2      LEU  82   1.823   1.002  12.295
  667   3HD2  LEU  82          3HD2      LEU  82   3.112   0.001  13.005
  668    H    LEU  83           H        LEU  83   4.719  -2.605   7.794
  669    HA   LEU  83           HA       LEU  83   2.799  -4.636   8.175
  670   1HB   LEU  83          1HB       LEU  83   4.784  -4.294   5.926
  671   2HB   LEU  83          2HB       LEU  83   3.317  -5.251   5.894
  672    HG   LEU  83           HG       LEU  83   2.953  -2.382   6.553
  673   1HD1  LEU  83          1HD1      LEU  83   4.756  -2.808   4.582
  674   2HD1  LEU  83          2HD1      LEU  83   3.242  -2.864   3.648
  675   3HD1  LEU  83          3HD1      LEU  83   3.631  -1.429   4.628
  676   1HD2  LEU  83          1HD2      LEU  83   0.958  -2.613   5.283
  677   2HD2  LEU  83          2HD2      LEU  83   1.525  -4.126   4.535
  678   3HD2  LEU  83          3HD2      LEU  83   1.120  -4.086   6.268
  679    H    GLY  84           H        GLY  84   6.330  -4.911   7.337
  680   1HA   GLY  84          1HA       GLY  84   6.732  -7.547   7.631
  681   2HA   GLY  84          2HA       GLY  84   7.890  -6.339   8.153
  682    H    LYS  85           H        LYS  85   6.751  -5.150  10.371
  683    HA   LYS  85           HA       LYS  85   7.122  -7.166  12.320
  684   1HB   LYS  85          1HB       LYS  85   6.667  -4.232  12.259
  685   2HB   LYS  85          2HB       LYS  85   6.165  -5.052  13.723
  686   1HG   LYS  85          1HG       LYS  85   8.349  -4.907  14.360
  687   2HG   LYS  85          2HG       LYS  85   8.631  -6.234  13.250
  688   1HD   LYS  85          1HD       LYS  85  10.115  -4.800  12.259
  689   2HD   LYS  85          2HD       LYS  85   8.691  -4.123  11.495
  690   1HE   LYS  85          1HE       LYS  85   9.685  -2.205  12.423
  691   2HE   LYS  85          2HE       LYS  85   8.518  -2.628  13.660
  692   1HZ   LYS  85          1HZ       LYS  85  10.730  -4.072  14.351
  693   2HZ   LYS  85          2HZ       LYS  85  11.382  -2.680  13.815
  694    H    ALA  86           H        ALA  86   4.281  -5.495  10.894
  695    HA   ALA  86           HA       ALA  86   2.387  -6.426  12.710
  696   1HB   ALA  86          1HB       ALA  86   2.293  -5.586   9.796
  697   2HB   ALA  86          2HB       ALA  86   0.831  -6.043  10.699
  698   3HB   ALA  86          3HB       ALA  86   1.807  -4.653  11.232
  699    H    MET  87           H        MET  87   4.063  -7.968   9.979
  700    HA   MET  87           HA       MET  87   2.400 -10.321  10.441
  701   1HB   MET  87          1HB       MET  87   4.158  -9.788   7.997
  702   2HB   MET  87          2HB       MET  87   2.838 -10.934   8.127
  703   1HG   MET  87          1HG       MET  87   1.354  -9.362   7.435
  704   2HG   MET  87          2HG       MET  87   1.800  -8.313   8.765
  705   1HE   MET  87          1HE       MET  87   1.685  -9.078   5.304
  706   2HE   MET  87          2HE       MET  87   1.177  -7.372   5.357
  707   3HE   MET  87          3HE       MET  87   2.629  -7.840   4.442
  708    H    ARG  88           H        ARG  88   5.074  -9.144  11.682
  709    HA   ARG  88           HA       ARG  88   7.202  -9.838  11.923
  710   1HB   ARG  88          1HB       ARG  88   5.265 -11.792  13.188
  711   2HB   ARG  88          2HB       ARG  88   6.982 -12.105  13.350
  712   1HG   ARG  88          1HG       ARG  88   6.899  -9.421  13.978
  713   2HG   ARG  88          2HG       ARG  88   5.326  -9.934  14.557
  714   1HD   ARG  88          1HD       ARG  88   6.335 -11.655  15.984
  715   2HD   ARG  88          2HD       ARG  88   7.918 -11.378  15.285
  716    HE   ARG  88           HE       ARG  88   6.973  -8.892  16.324
  717   1HH1  ARG  88          2HH2      ARG  88   8.043 -12.058  17.503
  718   2HH1  ARG  88          1HH2      ARG  88   8.604 -11.441  19.021
  719   1HH2  ARG  88          1HH       ARG  88   8.401  -9.098  19.484
  720    H    LEU  89           H        LEU  89   7.691 -10.256   9.560
  721    HA   LEU  89           HA       LEU  89   7.874 -13.138   9.022
  722   1HB   LEU  89          1HB       LEU  89   6.632 -11.158   7.541
  723   2HB   LEU  89          2HB       LEU  89   8.179 -11.347   6.738
  724    HG   LEU  89           HG       LEU  89   7.704 -13.845   6.650
  725   1HD1  LEU  89          1HD1      LEU  89   5.002 -12.867   7.586
  726   2HD1  LEU  89          2HD1      LEU  89   5.231 -14.404   6.717
  727   3HD1  LEU  89          3HD1      LEU  89   6.027 -14.140   8.289
  728   1HD2  LEU  89          1HD2      LEU  89   7.192 -11.866   4.883
  729   2HD2  LEU  89          2HD2      LEU  89   6.918 -13.593   4.552
  730   3HD2  LEU  89          3HD2      LEU  89   5.561 -12.557   5.061
  731    H    ARG  90           H        ARG  90   9.705 -12.552   6.726
  732    HA   ARG  90           HA       ARG  90  11.990 -11.498   8.136
  733   1HB   ARG  90          1HB       ARG  90  13.193 -13.633   6.915
  734   2HB   ARG  90          2HB       ARG  90  12.655 -13.661   8.582
  735   1HG   ARG  90          1HG       ARG  90  10.721 -14.909   8.091
  736   2HG   ARG  90          2HG       ARG  90  10.659 -14.363   6.426
  737   1HD   ARG  90          1HD       ARG  90  12.744 -16.283   7.572
  738   2HD   ARG  90          2HD       ARG  90  11.372 -16.751   6.587
  739    HE   ARG  90           HE       ARG  90  12.857 -14.732   5.192
  740   1HH1  ARG  90          2HH2      ARG  90  13.138 -18.131   6.153
  741   2HH1  ARG  90          1HH2      ARG  90  14.183 -18.546   4.836
  742   1HH2  ARG  90          1HH       ARG  90  14.815 -16.853   3.261
  743    H    ILE  91           H        ILE  91  10.626 -12.935   5.105
  744    HA   ILE  91           HA       ILE  91  12.452 -12.279   3.262
  745    HB   ILE  91           HB       ILE  91  10.396 -11.747   1.786
  746   1HG1  ILE  91          1HG1      ILE  91   8.695 -13.091   3.785
  747   2HG1  ILE  91          2HG1      ILE  91   9.131 -11.447   4.205
  748   1HG2  ILE  91          1HG2      ILE  91   9.834 -14.412   2.685
  749   2HG2  ILE  91          2HG2      ILE  91  10.693 -13.871   1.223
  750   3HG2  ILE  91          3HG2      ILE  91  11.591 -14.130   2.738
  751   1HD1  ILE  91          1HD1      ILE  91   7.776 -10.575   2.604
  752   2HD1  ILE  91          2HD1      ILE  91   8.416 -11.677   1.362
  753   3HD1  ILE  91          3HD1      ILE  91   7.099 -12.213   2.433
  754    H    VAL  92           H        VAL  92  10.396 -10.035   5.109
  755    HA   VAL  92           HA       VAL  92  10.070  -7.793   4.712
  756    HB   VAL  92           HB       VAL  92  13.011  -8.016   5.378
  757   1HG1  VAL  92          1HG1      VAL  92  12.320  -5.961   6.824
  758   2HG1  VAL  92          2HG1      VAL  92  12.606  -5.743   5.080
  759   3HG1  VAL  92          3HG1      VAL  92  10.942  -5.852   5.703
  760   1HG2  VAL  92          1HG2      VAL  92  12.488  -8.463   7.607
  761   2HG2  VAL  92          2HG2      VAL  92  10.802  -7.921   7.427
  762   3HG2  VAL  92          3HG2      VAL  92  11.320  -9.470   6.718
  763    HA   PRO  93           HA       PRO  93  11.939  -7.574   0.551
  764   1HB   PRO  93          1HB       PRO  93   9.656  -7.692  -0.946
  765   2HB   PRO  93          2HB       PRO  93  10.659  -9.091  -0.615
  766   1HG   PRO  93          1HG       PRO  93   8.045  -8.361   0.561
  767   2HG   PRO  93          2HG       PRO  93   8.847  -9.919   0.550
  768   1HD   PRO  93          1HD       PRO  93   8.671  -8.096   2.757
  769   2HD   PRO  93          2HD       PRO  93   9.570  -9.598   2.709
  770    H    GLU  94           H        GLU  94  11.970  -5.833  -1.008
  771    HA   GLU  94           HA       GLU  94  11.382  -3.446   0.318
  772   1HB   GLU  94          1HB       GLU  94  12.910  -4.257  -1.909
  773   2HB   GLU  94          2HB       GLU  94  11.721  -3.160  -2.583
  774   1HG   GLU  94          1HG       GLU  94  12.355  -1.393  -1.006
  775   2HG   GLU  94          2HG       GLU  94  13.397  -2.490  -0.122
  776    HE2  GLU  94           HE       GLU  94  15.818  -2.824  -2.070
  777    H    LEU  95           H        LEU  95   8.988  -4.389   0.638
  778    HA   LEU  95           HA       LEU  95   7.243  -4.111  -1.577
  779   1HB   LEU  95          1HB       LEU  95   7.041  -5.462   0.645
  780   2HB   LEU  95          2HB       LEU  95   6.381  -3.973   1.292
  781    HG   LEU  95           HG       LEU  95   5.099  -4.633  -1.225
  782   1HD1  LEU  95          1HD1      LEU  95   5.873  -6.938  -0.065
  783   2HD1  LEU  95          2HD1      LEU  95   4.337  -6.668   0.792
  784   3HD1  LEU  95          3HD1      LEU  95   4.360  -6.753  -0.986
  785   1HD2  LEU  95          1HD2      LEU  95   3.280  -3.826  -0.176
  786   2HD2  LEU  95          2HD2      LEU  95   3.576  -4.772   1.303
  787   3HD2  LEU  95          3HD2      LEU  95   4.466  -3.256   1.023
  788    H    THR  96           H        THR  96   7.587  -2.080  -2.550
  789    HA   THR  96           HA       THR  96   7.360   0.291  -0.907
  790    HB   THR  96           HB       THR  96   8.879  -0.228  -3.039
  791    HG1  THR  96           HG1      THR  96   8.923   1.848  -2.123
  792   1HG2  THR  96          1HG2      THR  96   6.527  -0.526  -4.362
  793   2HG2  THR  96          2HG2      THR  96   6.664   1.247  -4.451
  794   3HG2  THR  96          3HG2      THR  96   7.947   0.220  -5.133
  795    H    PHE  97           H        PHE  97   5.857   2.092  -1.657
  796    HA   PHE  97           HA       PHE  97   3.278   0.902  -2.402
  797   1HB   PHE  97          1HB       PHE  97   2.283   2.445  -0.731
  798   2HB   PHE  97          2HB       PHE  97   3.536   1.508   0.059
  799    HD1  PHE  97           HD1      PHE  97   2.313   4.764  -0.579
  800    HD2  PHE  97           HD2      PHE  97   5.889   2.612   0.185
  801    HE1  PHE  97           HE1      PHE  97   3.431   6.885   0.163
  802    HE2  PHE  97           HE2      PHE  97   7.008   4.734   0.926
  803    HZ   PHE  97           HZ       PHE  97   5.766   6.845   0.907
  804    H    PHE  98           H        PHE  98   2.773   1.648  -4.410
  805    HA   PHE  98           HA       PHE  98   3.775   4.237  -5.220
  806   1HB   PHE  98          1HB       PHE  98   2.852   1.688  -6.370
  807   2HB   PHE  98          2HB       PHE  98   1.990   3.012  -7.128
  808    HD1  PHE  98           HD1      PHE  98   2.902   3.746  -9.101
  809    HD2  PHE  98           HD2      PHE  98   5.515   2.325  -6.074
  810    HE1  PHE  98           HE1      PHE  98   4.869   4.170 -10.601
  811    HE2  PHE  98           HE2      PHE  98   7.482   2.749  -7.573
  812    HZ   PHE  98           HZ       PHE  98   7.137   3.666  -9.819
  813    H    TYR  99           H        TYR  99   2.634   6.057  -4.774
  814    HA   TYR  99           HA       TYR  99  -0.192   5.835  -4.199
  815   1HB   TYR  99          1HB       TYR  99   0.680   8.540  -4.261
  816   2HB   TYR  99          2HB       TYR  99   0.608   7.535  -2.826
  817    HD1  TYR  99           HD1      TYR  99   2.582   6.905  -1.686
  818    HD2  TYR  99           HD2      TYR  99   2.854   8.547  -5.627
  819    HE1  TYR  99           HE1      TYR  99   5.107   7.072  -1.449
  820    HE2  TYR  99           HE2      TYR  99   5.379   8.711  -5.377
  821    HH   TYR  99           HH       TYR  99   7.114   7.135  -3.577
  822    H    ASP 100           H        ASP 100  -1.584   5.743  -5.903
  823    HA   ASP 100           HA       ASP 100  -0.943   7.482  -8.153
  824   1HB   ASP 100          1HB       ASP 100  -1.575   4.735  -8.075
  825   2HB   ASP 100          2HB       ASP 100  -3.071   5.489  -8.589
  826    HD2  ASP 100           HD       ASP 100  -0.672   7.135 -10.928
  827    H    ASN 101           H        ASN 101  -2.070   9.396  -7.543
  828    HA   ASN 101           HA       ASN 101  -4.793   9.046  -6.620
  829   1HB   ASN 101          1HB       ASN 101  -3.513  11.768  -6.857
  830   2HB   ASN 101          2HB       ASN 101  -4.598  11.166  -5.619
  831   1HD2  ASN 101          1HD2      ASN 101  -1.697  12.331  -5.930
  832   2HD2  ASN 101          2HD2      ASN 101  -0.764  11.402  -4.803
  833    H    SER 102           H        SER 102  -6.119  11.276  -7.472
  834    HA   SER 102           HA       SER 102  -6.283  10.832 -10.276
  835   1HB   SER 102          1HB       SER 102  -8.397  11.639 -10.044
  836   2HB   SER 102          2HB       SER 102  -8.096  11.526  -8.321
  837    HG   SER 102           HG       SER 102  -8.706  13.722  -9.654
  838    H    LEU 103           H        LEU 103  -4.015  12.429  -8.625
  839    HA   LEU 103           HA       LEU 103  -4.126  14.930 -10.102
  840   1HB   LEU 103          1HB       LEU 103  -3.611  14.868  -7.677
  841   2HB   LEU 103          2HB       LEU 103  -2.155  13.958  -8.031
  842    HG   LEU 103           HG       LEU 103  -1.894  16.172  -9.671
  843   1HD1  LEU 103          1HD1      LEU 103  -2.961  17.158  -7.015
  844   2HD1  LEU 103          2HD1      LEU 103  -2.378  18.137  -8.382
  845   3HD1  LEU 103          3HD1      LEU 103  -3.874  17.183  -8.542
  846   1HD2  LEU 103          1HD2      LEU 103  -0.753  15.306  -7.052
  847   2HD2  LEU 103          2HD2      LEU 103   0.030  15.511  -8.636
  848   3HD2  LEU 103          3HD2      LEU 103  -0.367  16.938  -7.648
  849    H    VAL 104           H        VAL 104  -3.352  11.837 -10.861
  850    HA   VAL 104           HA       VAL 104  -1.304  12.753 -12.734
  851    HB   VAL 104           HB       VAL 104  -0.978  10.841 -10.547
  852   1HG1  VAL 104          1HG1      VAL 104   0.304   9.176 -11.780
  853   2HG1  VAL 104          2HG1      VAL 104  -1.367   9.236 -12.392
  854   3HG1  VAL 104          3HG1      VAL 104  -0.053  10.003 -13.316
  855   1HG2  VAL 104          1HG2      VAL 104   0.458  12.918 -11.802
  856   2HG2  VAL 104          2HG2      VAL 104   0.967  11.925 -10.416
  857   3HG2  VAL 104          3HG2      VAL 104   1.406  11.435 -12.068
  858    H    GLU 105           H        GLU 105  -4.351  11.737 -12.336
  859    HA   GLU 105           HA       GLU 105  -4.337  10.479 -14.909
  860   1HB   GLU 105          1HB       GLU 105  -4.794   8.964 -12.401
  861   2HB   GLU 105          2HB       GLU 105  -6.062   8.751 -13.590
  862   1HG   GLU 105          1HG       GLU 105  -4.392   8.106 -15.306
  863   2HG   GLU 105          2HG       GLU 105  -3.084   8.409 -14.180
  864    HE2  GLU 105           HE       GLU 105  -5.012   5.956 -15.292
  865    H    GLY 106           H        GLY 106  -6.062  11.725 -12.025
  866   1HA   GLY 106          1HA       GLY 106  -7.735  13.319 -12.104
  867   2HA   GLY 106          2HA       GLY 106  -8.039  12.950 -13.790
  868    H    MET 107           H        MET 107  -7.893   9.914 -12.951
  869    HA   MET 107           HA       MET 107 -10.640   9.864 -11.970
  870   1HB   MET 107          1HB       MET 107 -10.974   7.898 -13.331
  871   2HB   MET 107          2HB       MET 107 -10.059   8.990 -14.351
  872   1HG   MET 107          1HG       MET 107  -8.029   7.639 -13.012
  873   2HG   MET 107          2HG       MET 107  -9.245   6.387 -13.166
  874   1HE   MET 107          1HE       MET 107  -7.594   9.268 -14.740
  875   2HE   MET 107          2HE       MET 107  -6.361   8.211 -15.471
  876   3HE   MET 107          3HE       MET 107  -7.591   8.987 -16.497
  877    H    ARG 108           H        ARG 108  -7.898   9.862 -10.514
  878    HA   ARG 108           HA       ARG 108  -8.430   7.406  -9.045
  879   1HB   ARG 108          1HB       ARG 108  -5.779   8.681  -9.823
  880   2HB   ARG 108          2HB       ARG 108  -5.873   7.615  -8.435
  881   1HG   ARG 108          1HG       ARG 108  -6.401   6.959 -11.352
  882   2HG   ARG 108          2HG       ARG 108  -5.280   6.183 -10.249
  883   1HD   ARG 108          1HD       ARG 108  -7.533   5.635  -8.883
  884   2HD   ARG 108          2HD       ARG 108  -8.274   5.851 -10.456
  885    HE   ARG 108           HE       ARG 108  -5.928   4.130 -10.597
  886   1HH1  ARG 108          2HH2      ARG 108  -9.383   4.165  -9.807
  887   2HH1  ARG 108          1HH2      ARG 108  -9.599   2.477 -10.128
  888   1HH2  ARG 108          1HH       ARG 108  -7.722   1.167 -10.839
  Start of MODEL    9
    1    H    MET   1           H        MET   1  -9.145  -8.485  -4.481
    2    HA   MET   1           HA       MET   1  -8.080  -8.708  -2.458
    3   1HB   MET   1          1HB       MET   1 -10.966  -8.029  -2.497
    4   2HB   MET   1          2HB       MET   1 -10.439  -8.535  -0.903
    5   1HG   MET   1          1HG       MET   1  -8.651  -6.837  -0.897
    6   2HG   MET   1          2HG       MET   1  -9.002  -6.404  -2.559
    7   1HE   MET   1          1HE       MET   1 -11.261  -7.048   0.729
    8   2HE   MET   1          2HE       MET   1  -9.791  -6.106   1.078
    9   3HE   MET   1          3HE       MET   1 -11.391  -5.333   1.190
   10    H    ALA   2           H        ALA   2 -10.642 -11.112  -3.028
   11    HA   ALA   2           HA       ALA   2  -9.380 -12.786  -0.973
   12   1HB   ALA   2          1HB       ALA   2 -11.315 -12.999   0.154
   13   2HB   ALA   2          2HB       ALA   2 -11.957 -11.664  -0.833
   14   3HB   ALA   2          3HB       ALA   2 -12.215 -13.350  -1.341
   15    H    LYS   3           H        LYS   3  -8.473 -14.520  -1.950
   16    HA   LYS   3           HA       LYS   3  -9.990 -15.863  -4.021
   17   1HB   LYS   3          1HB       LYS   3  -8.156 -14.011  -4.844
   18   2HB   LYS   3          2HB       LYS   3  -7.160 -15.450  -4.770
   19   1HG   LYS   3          1HG       LYS   3  -9.795 -15.166  -6.288
   20   2HG   LYS   3          2HG       LYS   3  -8.197 -15.235  -7.004
   21   1HD   LYS   3          1HD       LYS   3  -8.425 -17.488  -7.118
   22   2HD   LYS   3          2HD       LYS   3  -8.303 -17.532  -5.372
   23   1HE   LYS   3          1HE       LYS   3 -10.395 -18.453  -5.447
   24   2HE   LYS   3          2HE       LYS   3 -10.949 -16.807  -5.678
   25   1HZ   LYS   3          1HZ       LYS   3 -11.834 -17.769  -7.541
   26   2HZ   LYS   3          2HZ       LYS   3 -10.377 -17.429  -8.188
   27    H    GLU   4           H        GLU   4 -10.259 -17.491  -2.407
   28    HA   GLU   4           HA       GLU   4  -7.963 -18.557  -1.141
   29   1HB   GLU   4          1HB       GLU   4 -10.367 -18.519  -0.234
   30   2HB   GLU   4          2HB       GLU   4 -10.721 -19.833  -1.339
   31   1HG   GLU   4          1HG       GLU   4  -9.572 -21.374  -0.085
   32   2HG   GLU   4          2HG       GLU   4  -8.259 -20.269   0.262
   33    HE2  GLU   4           HE       GLU   4  -8.924 -21.395   2.607
   34    H    PHE   5           H        PHE   5  -6.552 -19.149  -2.905
   35    HA   PHE   5           HA       PHE   5  -7.338 -21.691  -4.099
   36   1HB   PHE   5          1HB       PHE   5  -7.560 -19.392  -5.530
   37   2HB   PHE   5          2HB       PHE   5  -5.823 -19.571  -5.679
   38    HD1  PHE   5           HD1      PHE   5  -7.612 -19.561  -8.020
   39    HD2  PHE   5           HD2      PHE   5  -6.322 -22.784  -5.582
   40    HE1  PHE   5           HE1      PHE   5  -7.938 -21.143  -9.941
   41    HE2  PHE   5           HE2      PHE   5  -6.647 -24.367  -7.503
   42    HZ   PHE   5           HZ       PHE   5  -7.452 -23.528  -9.658
   43    H    GLY   6           H        GLY   6  -5.759 -23.190  -3.791
   44   1HA   GLY   6          1HA       GLY   6  -3.538 -22.951  -2.331
   45   2HA   GLY   6          2HA       GLY   6  -3.662 -24.058  -3.682
   46    H    ARG   7           H        ARG   7  -3.972 -21.735  -5.647
   47    HA   ARG   7           HA       ARG   7  -1.359 -21.585  -6.409
   48   1HB   ARG   7          1HB       ARG   7  -3.908 -20.491  -7.252
   49   2HB   ARG   7          2HB       ARG   7  -2.714 -19.212  -7.336
   50   1HG   ARG   7          1HG       ARG   7  -1.262 -21.236  -8.454
   51   2HG   ARG   7          2HG       ARG   7  -2.872 -21.771  -8.894
   52   1HD   ARG   7          1HD       ARG   7  -3.113 -20.119 -10.454
   53   2HD   ARG   7          2HD       ARG   7  -2.538 -18.881  -9.354
   54    HE   ARG   7           HE       ARG   7  -0.264 -20.391 -10.063
   55   1HH1  ARG   7          2HH2      ARG   7  -2.653 -18.380 -11.737
   56   2HH1  ARG   7          1HH2      ARG   7  -1.556 -17.905 -12.992
   57   1HH2  ARG   7          1HH       ARG   7   0.694 -18.730 -12.960
   58    HA   PRO   8           HA       PRO   8   0.294 -18.094  -4.353
   59   1HB   PRO   8          1HB       PRO   8   1.354 -16.437  -6.251
   60   2HB   PRO   8          2HB       PRO   8   2.140 -17.910  -5.718
   61   1HG   PRO   8          1HG       PRO   8   0.691 -17.391  -8.242
   62   2HG   PRO   8          2HG       PRO   8   1.825 -18.674  -7.870
   63   1HD   PRO   8          1HD       PRO   8  -1.031 -18.896  -8.015
   64   2HD   PRO   8          2HD       PRO   8   0.094 -20.149  -7.531
   65    H    GLN   9           H        GLN   9  -2.503 -17.778  -5.864
   66    HA   GLN   9           HA       GLN   9  -2.724 -14.952  -5.731
   67   1HB   GLN   9          1HB       GLN   9  -4.125 -17.017  -6.994
   68   2HB   GLN   9          2HB       GLN   9  -5.251 -16.474  -5.766
   69   1HG   GLN   9          1HG       GLN   9  -5.761 -14.664  -7.027
   70   2HG   GLN   9          2HG       GLN   9  -4.101 -14.113  -6.912
   71   1HE2  GLN   9          1HE2      GLN   9  -4.366 -13.264  -9.022
   72   2HE2  GLN   9          2HE2      GLN   9  -4.212 -14.263 -10.430
   73    H    ARG  10           H        ARG  10  -3.703 -17.774  -3.719
   74    HA   ARG  10           HA       ARG  10  -5.318 -16.452  -1.966
   75   1HB   ARG  10          1HB       ARG  10  -4.817 -18.977  -2.143
   76   2HB   ARG  10          2HB       ARG  10  -3.371 -18.681  -1.200
   77   1HG   ARG  10          1HG       ARG  10  -5.958 -17.590  -0.114
   78   2HG   ARG  10          2HG       ARG  10  -5.744 -19.329  -0.063
   79   1HD   ARG  10          1HD       ARG  10  -3.288 -18.503   0.877
   80   2HD   ARG  10          2HD       ARG  10  -4.302 -17.195   1.456
   81    HE   ARG  10           HE       ARG  10  -5.781 -19.355   2.211
   82   1HH1  ARG  10          2HH2      ARG  10  -2.321 -18.688   2.573
   83   2HH1  ARG  10          1HH2      ARG  10  -2.165 -19.626   4.021
   84   1HH2  ARG  10          1HH       ARG  10  -4.092 -20.737   4.913
   85    H    VAL  11           H        VAL  11  -1.746 -17.123  -1.719
   86    HA   VAL  11           HA       VAL  11  -1.380 -15.759   0.688
   87    HB   VAL  11           HB       VAL  11   0.097 -17.362  -0.926
   88   1HG1  VAL  11          1HG1      VAL  11   1.358 -14.607  -1.145
   89   2HG1  VAL  11          2HG1      VAL  11   2.065 -16.145  -1.698
   90   3HG1  VAL  11          3HG1      VAL  11   0.598 -15.506  -2.481
   91   1HG2  VAL  11          1HG2      VAL  11   0.839 -17.510   1.198
   92   2HG2  VAL  11          2HG2      VAL  11   2.047 -16.309   0.681
   93   3HG2  VAL  11          3HG2      VAL  11   0.569 -15.782   1.522
   94    H    ALA  12           H        ALA  12  -1.319 -14.705  -2.750
   95    HA   ALA  12           HA       ALA  12  -0.288 -12.156  -2.305
   96   1HB   ALA  12          1HB       ALA  12  -1.936 -11.864  -4.476
   97   2HB   ALA  12          2HB       ALA  12  -0.305 -12.573  -4.539
   98   3HB   ALA  12          3HB       ALA  12  -1.734 -13.630  -4.432
   99    H    GLN  13           H        GLN  13  -3.622 -13.495  -2.113
  100    HA   GLN  13           HA       GLN  13  -4.813 -10.973  -1.778
  101   1HB   GLN  13          1HB       GLN  13  -5.746 -13.813  -1.209
  102   2HB   GLN  13          2HB       GLN  13  -6.770 -12.420  -0.920
  103   1HG   GLN  13          1HG       GLN  13  -5.674 -13.433  -3.562
  104   2HG   GLN  13          2HG       GLN  13  -7.343 -13.129  -3.122
  105   1HE2  GLN  13          1HE2      GLN  13  -4.272 -11.718  -4.002
  106   2HE2  GLN  13          2HE2      GLN  13  -4.838 -10.140  -4.437
  107    H    GLU  14           H        GLU  14  -4.394 -13.714   0.591
  108    HA   GLU  14           HA       GLU  14  -5.168 -12.550   2.821
  109   1HB   GLU  14          1HB       GLU  14  -3.065 -14.544   2.161
  110   2HB   GLU  14          2HB       GLU  14  -2.890 -13.810   3.742
  111   1HG   GLU  14          1HG       GLU  14  -5.693 -14.488   3.242
  112   2HG   GLU  14          2HG       GLU  14  -4.675 -15.894   3.005
  113    HE2  GLU  14           HE       GLU  14  -6.356 -14.580   5.474
  114    H    MET  15           H        MET  15  -1.963 -12.025   1.237
  115    HA   MET  15           HA       MET  15  -1.038 -10.330   3.282
  116   1HB   MET  15          1HB       MET  15  -0.137 -11.424   0.707
  117   2HB   MET  15          2HB       MET  15   0.305  -9.733   0.823
  118   1HG   MET  15          1HG       MET  15   0.959 -10.693   3.364
  119   2HG   MET  15          2HG       MET  15   1.351 -12.058   2.337
  120   1HE   MET  15          1HE       MET  15   4.699 -10.658   2.984
  121   2HE   MET  15          2HE       MET  15   3.741  -9.410   3.813
  122   3HE   MET  15          3HE       MET  15   3.253 -11.119   3.912
  123    H    GLN  16           H        GLN  16  -2.674  -9.833   0.113
  124    HA   GLN  16           HA       GLN  16  -2.322  -7.090   0.017
  125   1HB   GLN  16          1HB       GLN  16  -3.127  -8.706  -1.824
  126   2HB   GLN  16          2HB       GLN  16  -4.719  -8.596  -1.100
  127   1HG   GLN  16          1HG       GLN  16  -3.676  -5.913  -1.374
  128   2HG   GLN  16          2HG       GLN  16  -3.452  -6.741  -2.902
  129   1HE2  GLN  16          1HE2      GLN  16  -5.045  -4.898  -3.328
  130   2HE2  GLN  16          2HE2      GLN  16  -6.730  -5.299  -3.288
  131    H    LYS  17           H        LYS  17  -4.644  -9.160   1.749
  132    HA   LYS  17           HA       LYS  17  -6.415  -7.011   2.378
  133   1HB   LYS  17          1HB       LYS  17  -6.844  -9.595   2.213
  134   2HB   LYS  17          2HB       LYS  17  -6.305  -9.614   3.877
  135   1HG   LYS  17          1HG       LYS  17  -8.354  -7.551   3.062
  136   2HG   LYS  17          2HG       LYS  17  -8.880  -9.212   3.258
  137   1HD   LYS  17          1HD       LYS  17  -7.244  -7.812   5.410
  138   2HD   LYS  17          2HD       LYS  17  -8.987  -7.639   5.339
  139   1HE   LYS  17          1HE       LYS  17  -7.817 -10.424   5.231
  140   2HE   LYS  17          2HE       LYS  17  -7.845  -9.593   6.774
  141   1HZ   LYS  17          1HZ       LYS  17 -10.313  -9.161   6.179
  142   2HZ   LYS  17          2HZ       LYS  17 -10.146 -10.370   5.099
  143    H    GLU  18           H        GLU  18  -3.670  -8.710   3.968
  144    HA   GLU  18           HA       GLU  18  -4.004  -7.389   6.411
  145   1HB   GLU  18          1HB       GLU  18  -2.712  -9.538   5.992
  146   2HB   GLU  18          2HB       GLU  18  -1.439  -8.577   5.267
  147   1HG   GLU  18          1HG       GLU  18  -0.696  -8.758   7.490
  148   2HG   GLU  18          2HG       GLU  18  -1.498  -7.201   7.507
  149    HE2  GLU  18           HE       GLU  18  -2.948 -10.538   9.036
  150    H    ILE  19           H        ILE  19  -2.149  -6.688   3.415
  151    HA   ILE  19           HA       ILE  19  -0.810  -4.449   4.585
  152    HB   ILE  19           HB       ILE  19   0.217  -4.185   2.505
  153   1HG1  ILE  19          1HG1      ILE  19  -2.131  -5.692   1.338
  154   2HG1  ILE  19          2HG1      ILE  19  -1.640  -4.039   1.019
  155   1HG2  ILE  19          1HG2      ILE  19  -0.024  -6.802   3.667
  156   2HG2  ILE  19          2HG2      ILE  19   0.205  -6.944   1.908
  157   3HG2  ILE  19          3HG2      ILE  19   1.379  -6.034   2.887
  158   1HD1  ILE  19          1HD1      ILE  19  -0.425  -6.609   0.033
  159   2HD1  ILE  19          2HD1      ILE  19  -0.725  -5.089  -0.843
  160   3HD1  ILE  19          3HD1      ILE  19   0.654  -5.215   0.277
  161    H    ALA  20           H        ALA  20  -3.726  -5.041   2.578
  162    HA   ALA  20           HA       ALA  20  -4.233  -2.378   1.924
  163   1HB   ALA  20          1HB       ALA  20  -5.348  -4.155   0.760
  164   2HB   ALA  20          2HB       ALA  20  -6.007  -4.822   2.273
  165   3HB   ALA  20          3HB       ALA  20  -6.605  -3.265   1.653
  166    H    LEU  21           H        LEU  21  -4.804  -4.302   4.872
  167    HA   LEU  21           HA       LEU  21  -6.559  -2.370   6.025
  168   1HB   LEU  21          1HB       LEU  21  -6.855  -4.610   6.669
  169   2HB   LEU  21          2HB       LEU  21  -5.153  -4.834   7.017
  170    HG   LEU  21           HG       LEU  21  -6.186  -2.727   8.690
  171   1HD1  LEU  21          1HD1      LEU  21  -7.583  -5.231   9.446
  172   2HD1  LEU  21          2HD1      LEU  21  -8.058  -3.529   9.666
  173   3HD1  LEU  21          3HD1      LEU  21  -8.273  -4.316   8.084
  174   1HD2  LEU  21          1HD2      LEU  21  -5.604  -4.792  10.364
  175   2HD2  LEU  21          2HD2      LEU  21  -4.676  -5.251   8.917
  176   3HD2  LEU  21          3HD2      LEU  21  -4.405  -3.667   9.683
  177    H    ILE  22           H        ILE  22  -3.161  -3.431   6.779
  178    HA   ILE  22           HA       ILE  22  -2.674  -1.353   8.564
  179    HB   ILE  22           HB       ILE  22  -0.742  -2.927   6.858
  180   1HG1  ILE  22          1HG1      ILE  22  -1.405  -3.544   9.724
  181   2HG1  ILE  22          2HG1      ILE  22  -2.463  -4.116   8.449
  182   1HG2  ILE  22          1HG2      ILE  22   0.073  -0.766   7.980
  183   2HG2  ILE  22          2HG2      ILE  22  -0.139  -1.640   9.516
  184   3HG2  ILE  22          3HG2      ILE  22   0.986  -2.263   8.284
  185   1HD1  ILE  22          1HD1      ILE  22  -0.618  -5.737   9.115
  186   2HD1  ILE  22          2HD1      ILE  22  -0.667  -5.345   7.379
  187   3HD1  ILE  22          3HD1      ILE  22   0.551  -4.583   8.431
  188    H    LEU  23           H        LEU  23  -2.979  -1.388   5.098
  189    HA   LEU  23           HA       LEU  23  -1.390   1.001   4.758
  190   1HB   LEU  23          1HB       LEU  23  -1.327  -0.740   3.076
  191   2HB   LEU  23          2HB       LEU  23  -3.063  -0.638   2.852
  192    HG   LEU  23           HG       LEU  23  -1.422   1.829   2.403
  193   1HD1  LEU  23          1HD1      LEU  23  -0.372   1.148   0.549
  194   2HD1  LEU  23          2HD1      LEU  23  -0.626  -0.496   1.183
  195   3HD1  LEU  23          3HD1      LEU  23  -1.761   0.186  -0.006
  196   1HD2  LEU  23          1HD2      LEU  23  -4.064   1.407   2.263
  197   2HD2  LEU  23          2HD2      LEU  23  -3.209   2.579   1.232
  198   3HD2  LEU  23          3HD2      LEU  23  -3.618   0.966   0.597
  199    H    GLN  24           H        GLN  24  -4.595   0.132   5.703
  200    HA   GLN  24           HA       GLN  24  -5.492   2.811   4.976
  201   1HB   GLN  24          1HB       GLN  24  -6.794   0.164   4.890
  202   2HB   GLN  24          2HB       GLN  24  -7.771   1.366   5.708
  203   1HG   GLN  24          1HG       GLN  24  -7.789   2.822   3.795
  204   2HG   GLN  24          2HG       GLN  24  -6.463   1.970   3.029
  205   1HE2  GLN  24          1HE2      GLN  24  -7.231   1.124   1.242
  206   2HE2  GLN  24          2HE2      GLN  24  -8.645   0.136   1.081
  207    H    ARG  25           H        ARG  25  -4.485   0.753   7.529
  208    HA   ARG  25           HA       ARG  25  -6.013   2.301   9.449
  209   1HB   ARG  25          1HB       ARG  25  -5.163  -0.477   9.309
  210   2HB   ARG  25          2HB       ARG  25  -4.474   0.247  10.750
  211   1HG   ARG  25          1HG       ARG  25  -6.558  -0.435  11.562
  212   2HG   ARG  25          2HG       ARG  25  -6.912   1.221  11.112
  213   1HD   ARG  25          1HD       ARG  25  -7.265  -0.479   8.781
  214   2HD   ARG  25          2HD       ARG  25  -8.154  -1.167  10.125
  215    HE   ARG  25           HE       ARG  25  -8.533   1.726   9.855
  216   1HH1  ARG  25          2HH2      ARG  25  -9.694  -1.452   8.802
  217   2HH1  ARG  25          1HH2      ARG  25 -11.265  -0.871   8.364
  218   1HH2  ARG  25          1HH       ARG  25 -11.779   1.453   8.650
  219    H    GLU  26           H        GLU  26  -2.712   0.761   9.220
  220    HA   GLU  26           HA       GLU  26  -1.572   2.473  11.066
  221   1HB   GLU  26          1HB       GLU  26   0.146   1.031  10.804
  222   2HB   GLU  26          2HB       GLU  26  -0.781   0.234   9.550
  223   1HG   GLU  26          1HG       GLU  26   1.236   0.779   8.443
  224   2HG   GLU  26          2HG       GLU  26   0.158   2.067   7.944
  225    HE2  GLU  26           HE       GLU  26   3.266   2.427   8.480
  226    H    ILE  27           H        ILE  27  -2.541   2.996   7.782
  227    HA   ILE  27           HA       ILE  27  -0.598   5.057   7.270
  228    HB   ILE  27           HB       ILE  27  -2.195   3.392   5.732
  229   1HG1  ILE  27          1HG1      ILE  27  -0.398   5.735   5.125
  230   2HG1  ILE  27          2HG1      ILE  27  -0.052   4.022   4.993
  231   1HG2  ILE  27          1HG2      ILE  27  -3.057   6.201   5.076
  232   2HG2  ILE  27          2HG2      ILE  27  -3.720   4.652   4.501
  233   3HG2  ILE  27          3HG2      ILE  27  -4.003   5.174   6.179
  234   1HD1  ILE  27          1HD1      ILE  27  -1.390   5.825   3.067
  235   2HD1  ILE  27          2HD1      ILE  27  -0.545   4.283   2.782
  236   3HD1  ILE  27          3HD1      ILE  27  -2.245   4.282   3.309
  237    H    LYS  28           H        LYS  28  -1.860   7.185   6.239
  238    HA   LYS  28           HA       LYS  28  -3.465   8.127   8.508
  239   1HB   LYS  28          1HB       LYS  28  -2.652  10.366   7.941
  240   2HB   LYS  28          2HB       LYS  28  -1.332   9.271   8.296
  241   1HG   LYS  28          1HG       LYS  28  -2.102   9.303   5.428
  242   2HG   LYS  28          2HG       LYS  28  -1.536  10.855   6.017
  243   1HD   LYS  28          1HD       LYS  28   0.608  10.044   6.531
  244   2HD   LYS  28          2HD       LYS  28   0.051   8.399   6.764
  245   1HE   LYS  28          1HE       LYS  28   1.401   9.090   4.562
  246   2HE   LYS  28          2HE       LYS  28   0.118   7.896   4.491
  247   1HZ   LYS  28          1HZ       LYS  28  -1.210   9.320   3.341
  248   2HZ   LYS  28          2HZ       LYS  28  -0.770  10.642   4.184
  249    H    ASP  29           H        ASP  29  -5.277   6.920   7.365
  250    HA   ASP  29           HA       ASP  29  -6.118   8.076   4.901
  251   1HB   ASP  29          1HB       ASP  29  -7.039   5.999   4.833
  252   2HB   ASP  29          2HB       ASP  29  -6.765   5.758   6.547
  253    HD2  ASP  29           HD       ASP  29  -9.077   7.419   4.461
  254    HA   PRO  30           HA       PRO  30  -9.369   9.743   7.988
  255   1HB   PRO  30          1HB       PRO  30  -8.959   9.445  10.673
  256   2HB   PRO  30          2HB       PRO  30  -9.950   8.351   9.728
  257   1HG   PRO  30          1HG       PRO  30  -7.226   7.929  10.799
  258   2HG   PRO  30          2HG       PRO  30  -8.382   6.737  10.235
  259   1HD   PRO  30          1HD       PRO  30  -6.070   7.687   8.827
  260   2HD   PRO  30          2HD       PRO  30  -7.287   6.583   8.219
  261    H    ARG  31           H        ARG  31  -6.180  10.246   7.843
  262    HA   ARG  31           HA       ARG  31  -6.280  12.633   9.448
  263   1HB   ARG  31          1HB       ARG  31  -4.259  10.797   8.896
  264   2HB   ARG  31          2HB       ARG  31  -3.842  12.116   7.821
  265   1HG   ARG  31          1HG       ARG  31  -3.493  13.635   9.583
  266   2HG   ARG  31          2HG       ARG  31  -4.575  12.788  10.672
  267   1HD   ARG  31          1HD       ARG  31  -2.892  10.874  10.751
  268   2HD   ARG  31          2HD       ARG  31  -1.795  11.860   9.804
  269    HE   ARG  31           HE       ARG  31  -2.838  13.139  12.255
  270   1HH1  ARG  31          2HH2      ARG  31  -0.193  11.303  10.774
  271   2HH1  ARG  31          1HH2      ARG  31   0.961  11.750  11.986
  272   1HH2  ARG  31          1HH       ARG  31   0.281  13.178  13.786
  273    H    LEU  32           H        LEU  32  -5.527  11.606   6.041
  274    HA   LEU  32           HA       LEU  32  -5.342  14.243   5.064
  275   1HB   LEU  32          1HB       LEU  32  -5.799  11.598   3.680
  276   2HB   LEU  32          2HB       LEU  32  -5.509  13.112   2.846
  277    HG   LEU  32           HG       LEU  32  -3.523  12.178   4.892
  278   1HD1  LEU  32          1HD1      LEU  32  -2.878  11.294   2.185
  279   2HD1  LEU  32          2HD1      LEU  32  -2.752  10.434   3.738
  280   3HD1  LEU  32          3HD1      LEU  32  -4.303  10.470   2.864
  281   1HD2  LEU  32          1HD2      LEU  32  -2.311  13.861   4.104
  282   2HD2  LEU  32          2HD2      LEU  32  -2.461  13.260   2.436
  283   3HD2  LEU  32          3HD2      LEU  32  -3.705  14.340   3.108
  284    H    GLY  33           H        GLY  33  -8.012  12.150   5.911
  285   1HA   GLY  33          1HA       GLY  33 -10.200  12.802   6.108
  286   2HA   GLY  33          2HA       GLY  33  -9.878  14.244   5.166
  287    H    MET  34           H        MET  34  -8.882  10.964   4.126
  288    HA   MET  34           HA       MET  34 -11.144  10.853   2.335
  289   1HB   MET  34          1HB       MET  34  -8.201  10.996   1.509
  290   2HB   MET  34          2HB       MET  34  -9.402  10.281   0.452
  291   1HG   MET  34          1HG       MET  34  -9.484  12.478  -0.316
  292   2HG   MET  34          2HG       MET  34 -10.722  12.563   0.921
  293   1HE   MET  34          1HE       MET  34  -6.410  13.434   1.047
  294   2HE   MET  34          2HE       MET  34  -7.471  13.159  -0.355
  295   3HE   MET  34          3HE       MET  34  -7.175  14.815   0.227
  296    H    MET  35           H        MET  35 -10.732   8.677   0.856
  297    HA   MET  35           HA       MET  35  -9.842   6.671   2.782
  298   1HB   MET  35          1HB       MET  35 -12.420   7.056   1.828
  299   2HB   MET  35          2HB       MET  35 -11.816   5.903   0.656
  300   1HG   MET  35          1HG       MET  35 -12.216   4.247   2.158
  301   2HG   MET  35          2HG       MET  35 -10.938   4.902   3.162
  302   1HE   MET  35          1HE       MET  35 -12.728   3.538   4.973
  303   2HE   MET  35          2HE       MET  35 -14.383   4.141   5.230
  304   3HE   MET  35          3HE       MET  35 -13.932   3.416   3.668
  305    H    THR  36           H        THR  36  -7.875   5.931   2.073
  306    HA   THR  36           HA       THR  36  -7.149   5.990  -0.675
  307    HB   THR  36           HB       THR  36  -5.074   4.979   0.197
  308    HG1  THR  36           HG1      THR  36  -6.369   3.461   1.589
  309   1HG2  THR  36          1HG2      THR  36  -5.644   7.412   0.916
  310   2HG2  THR  36          2HG2      THR  36  -6.158   6.707   2.468
  311   3HG2  THR  36          3HG2      THR  36  -4.469   6.542   1.933
  312    H    THR  37           H        THR  37  -6.585   4.169  -2.040
  313    HA   THR  37           HA       THR  37  -8.086   1.736  -1.355
  314    HB   THR  37           HB       THR  37  -8.266   3.531  -3.799
  315    HG1  THR  37           HG1      THR  37  -9.812   3.507  -1.946
  316   1HG2  THR  37          1HG2      THR  37  -9.514   1.671  -4.926
  317   2HG2  THR  37          2HG2      THR  37  -7.797   1.255  -4.711
  318   3HG2  THR  37          3HG2      THR  37  -9.023   0.567  -3.621
  319    H    VAL  38           H        VAL  38  -7.385  -0.193  -2.579
  320    HA   VAL  38           HA       VAL  38  -4.538   0.061  -3.269
  321    HB   VAL  38           HB       VAL  38  -4.833  -1.074  -1.160
  322   1HG1  VAL  38          1HG1      VAL  38  -7.144  -2.207  -2.454
  323   2HG1  VAL  38          2HG1      VAL  38  -6.096  -3.512  -1.849
  324   3HG1  VAL  38          3HG1      VAL  38  -6.680  -2.250  -0.737
  325   1HG2  VAL  38          1HG2      VAL  38  -3.805  -2.459  -3.555
  326   2HG2  VAL  38          2HG2      VAL  38  -3.021  -2.128  -1.991
  327   3HG2  VAL  38          3HG2      VAL  38  -4.120  -3.519  -2.160
  328    H    SER  39           H        SER  39  -5.246   0.531  -5.489
  329    HA   SER  39           HA       SER  39  -6.630  -1.641  -6.782
  330   1HB   SER  39          1HB       SER  39  -6.408   1.186  -7.195
  331   2HB   SER  39          2HB       SER  39  -5.730   0.414  -8.616
  332    HG   SER  39           HG       SER  39  -7.677  -0.703  -8.973
  333    H    GLY  40           H        GLY  40  -3.964  -2.163  -5.687
  334   1HA   GLY  40          1HA       GLY  40  -2.771  -3.456  -7.872
  335   2HA   GLY  40          2HA       GLY  40  -1.924  -1.947  -7.601
  336    H    VAL  41           H        VAL  41  -1.438  -5.037  -7.049
  337    HA   VAL  41           HA       VAL  41  -0.049  -4.538  -4.563
  338    HB   VAL  41           HB       VAL  41  -2.096  -5.282  -3.660
  339   1HG1  VAL  41          1HG1      VAL  41  -2.756  -7.776  -4.581
  340   2HG1  VAL  41          2HG1      VAL  41  -3.508  -6.256  -5.120
  341   3HG1  VAL  41          3HG1      VAL  41  -2.188  -6.981  -6.070
  342   1HG2  VAL  41          1HG2      VAL  41   0.206  -7.117  -3.661
  343   2HG2  VAL  41          2HG2      VAL  41  -0.731  -6.449  -2.304
  344   3HG2  VAL  41          3HG2      VAL  41  -1.328  -7.878  -3.180
  345    H    GLU  42           H        GLU  42   1.980  -5.325  -4.789
  346    HA   GLU  42           HA       GLU  42   2.277  -7.665  -6.490
  347   1HB   GLU  42          1HB       GLU  42   4.116  -5.234  -6.600
  348   2HB   GLU  42          2HB       GLU  42   4.264  -6.689  -7.566
  349   1HG   GLU  42          1HG       GLU  42   1.566  -5.637  -7.840
  350   2HG   GLU  42          2HG       GLU  42   2.717  -4.352  -8.148
  351    HE2  GLU  42           HE       GLU  42   2.112  -6.914 -10.978
  352    H    MET  43           H        MET  43   3.517  -9.248  -5.545
  353    HA   MET  43           HA       MET  43   5.305  -8.380  -3.417
  354   1HB   MET  43          1HB       MET  43   3.989 -11.046  -3.073
  355   2HB   MET  43          2HB       MET  43   4.317  -9.815  -1.869
  356   1HG   MET  43          1HG       MET  43   2.414  -8.452  -3.118
  357   2HG   MET  43          2HG       MET  43   1.959 -10.014  -3.768
  358   1HE   MET  43          1HE       MET  43   1.029  -8.032  -0.089
  359   2HE   MET  43          2HE       MET  43   1.127  -7.634  -1.821
  360   3HE   MET  43          3HE       MET  43  -0.279  -8.525  -1.190
  361    H    SER  44           H        SER  44   7.319  -8.827  -4.230
  362    HA   SER  44           HA       SER  44   7.597 -11.409  -5.561
  363   1HB   SER  44          1HB       SER  44   8.696  -8.698  -6.143
  364   2HB   SER  44          2HB       SER  44   9.842 -10.013  -6.315
  365    HG   SER  44           HG       SER  44   8.195  -9.286  -8.163
  366    H    ARG  45           H        ARG  45   8.494 -12.866  -4.144
  367    HA   ARG  45           HA       ARG  45  10.366 -11.801  -2.206
  368   1HB   ARG  45          1HB       ARG  45   8.699 -14.345  -2.347
  369   2HB   ARG  45          2HB       ARG  45  10.049 -14.234  -1.236
  370   1HG   ARG  45          1HG       ARG  45   8.578 -13.275   0.214
  371   2HG   ARG  45          2HG       ARG  45   8.742 -11.829  -0.763
  372   1HD   ARG  45          1HD       ARG  45   6.347 -12.446  -0.444
  373   2HD   ARG  45          2HD       ARG  45   6.792 -12.482  -2.137
  374    HE   ARG  45           HE       ARG  45   7.173 -15.081  -0.897
  375   1HH1  ARG  45          2HH2      ARG  45   4.700 -12.944  -2.265
  376   2HH1  ARG  45          1HH2      ARG  45   3.628 -14.242  -2.673
  377   1HH2  ARG  45          1HH       ARG  45   4.270 -16.497  -2.175
  378    H    ASP  46           H        ASP  46  10.514 -12.897  -5.277
  379    HA   ASP  46           HA       ASP  46  12.058 -15.086  -5.401
  380   1HB   ASP  46          1HB       ASP  46  11.864 -12.556  -7.009
  381   2HB   ASP  46          2HB       ASP  46  13.237 -13.592  -7.349
  382    HD2  ASP  46           HD       ASP  46  12.305 -13.877  -9.379
  383    H    LEU  47           H        LEU  47  12.904 -11.766  -4.387
  384    HA   LEU  47           HA       LEU  47  15.497 -12.750  -3.506
  385   1HB   LEU  47          1HB       LEU  47  15.040 -10.695  -5.595
  386   2HB   LEU  47          2HB       LEU  47  16.253 -10.325  -4.386
  387    HG   LEU  47           HG       LEU  47  16.916 -12.907  -5.101
  388   1HD1  LEU  47          1HD1      LEU  47  17.029 -12.753  -7.641
  389   2HD1  LEU  47          2HD1      LEU  47  15.443 -13.125  -6.923
  390   3HD1  LEU  47          3HD1      LEU  47  15.791 -11.482  -7.513
  391   1HD2  LEU  47          1HD2      LEU  47  17.928 -10.201  -5.945
  392   2HD2  LEU  47          2HD2      LEU  47  18.625 -11.361  -4.790
  393   3HD2  LEU  47          3HD2      LEU  47  18.692 -11.695  -6.536
  394    H    ALA  48           H        ALA  48  13.472  -9.734  -3.736
  395    HA   ALA  48           HA       ALA  48  12.578  -9.556  -1.233
  396   1HB   ALA  48          1HB       ALA  48  15.509  -9.228  -1.255
  397   2HB   ALA  48          2HB       ALA  48  14.645  -7.894  -0.456
  398   3HB   ALA  48          3HB       ALA  48  14.407  -9.568   0.101
  399    H    TYR  49           H        TYR  49  11.202  -8.594  -3.000
  400    HA   TYR  49           HA       TYR  49  11.381  -5.753  -2.851
  401   1HB   TYR  49          1HB       TYR  49  11.270  -5.906  -5.576
  402   2HB   TYR  49          2HB       TYR  49  12.806  -5.775  -4.742
  403    HD1  TYR  49           HD1      TYR  49  14.169  -6.887  -6.358
  404    HD2  TYR  49           HD2      TYR  49  10.700  -8.834  -4.784
  405    HE1  TYR  49           HE1      TYR  49  14.919  -9.081  -7.401
  406    HE2  TYR  49           HE2      TYR  49  11.462 -11.022  -5.832
  407    HH   TYR  49           HH       TYR  49  13.887 -11.949  -6.498
  408    H    ALA  50           H        ALA  50   9.339  -4.898  -2.958
  409    HA   ALA  50           HA       ALA  50   7.296  -6.502  -4.305
  410   1HB   ALA  50          1HB       ALA  50   6.178  -5.304  -1.949
  411   2HB   ALA  50          2HB       ALA  50   6.303  -7.031  -2.362
  412   3HB   ALA  50          3HB       ALA  50   7.622  -6.230  -1.473
  413    H    LYS  51           H        LYS  51   5.238  -5.146  -4.619
  414    HA   LYS  51           HA       LYS  51   5.805  -2.291  -4.665
  415   1HB   LYS  51          1HB       LYS  51   4.605  -3.299  -7.168
  416   2HB   LYS  51          2HB       LYS  51   5.768  -2.016  -6.908
  417   1HG   LYS  51          1HG       LYS  51   7.543  -3.769  -6.473
  418   2HG   LYS  51          2HG       LYS  51   6.367  -5.012  -6.855
  419   1HD   LYS  51          1HD       LYS  51   6.852  -4.777  -9.054
  420   2HD   LYS  51          2HD       LYS  51   6.245  -3.135  -9.004
  421   1HE   LYS  51          1HE       LYS  51   8.347  -2.340  -9.297
  422   2HE   LYS  51          2HE       LYS  51   8.845  -3.085  -7.791
  423   1HZ   LYS  51          1HZ       LYS  51   8.741  -4.560 -10.366
  424   2HZ   LYS  51          2HZ       LYS  51  10.100  -3.886  -9.773
  425    H    VAL  52           H        VAL  52   4.206  -1.564  -3.355
  426    HA   VAL  52           HA       VAL  52   1.566  -2.795  -3.683
  427    HB   VAL  52           HB       VAL  52   3.048  -1.514  -1.433
  428   1HG1  VAL  52          1HG1      VAL  52   1.274  -0.127  -1.084
  429   2HG1  VAL  52          2HG1      VAL  52   0.144  -1.160  -1.991
  430   3HG1  VAL  52          3HG1      VAL  52   0.600  -1.588  -0.325
  431   1HG2  VAL  52          1HG2      VAL  52   1.991  -4.102  -2.100
  432   2HG2  VAL  52          2HG2      VAL  52   2.997  -3.622  -0.711
  433   3HG2  VAL  52          3HG2      VAL  52   1.222  -3.523  -0.601
  434    H    TYR  53           H        TYR  53  -0.142  -1.619  -4.466
  435    HA   TYR  53           HA       TYR  53   0.498   1.084  -5.355
  436   1HB   TYR  53          1HB       TYR  53  -0.491  -0.854  -6.790
  437   2HB   TYR  53          2HB       TYR  53  -1.930  -0.760  -5.795
  438    HD1  TYR  53           HD1      TYR  53  -3.462   1.163  -5.967
  439    HD2  TYR  53           HD2      TYR  53  -0.001   0.851  -8.462
  440    HE1  TYR  53           HE1      TYR  53  -4.403   2.953  -7.507
  441    HE2  TYR  53           HE2      TYR  53  -0.953   2.642  -9.994
  442    HH   TYR  53           HH       TYR  53  -3.603   3.398 -10.449
  443    H    VAL  54           H        VAL  54  -0.934   2.882  -4.967
  444    HA   VAL  54           HA       VAL  54  -3.072   2.514  -3.076
  445    HB   VAL  54           HB       VAL  54  -1.897   4.439  -1.693
  446   1HG1  VAL  54          1HG1      VAL  54  -2.698   2.173  -0.922
  447   2HG1  VAL  54          2HG1      VAL  54  -1.070   1.551  -1.284
  448   3HG1  VAL  54          3HG1      VAL  54  -1.286   2.814  -0.048
  449   1HG2  VAL  54          1HG2      VAL  54   0.556   3.853  -1.430
  450   2HG2  VAL  54          2HG2      VAL  54   0.413   2.929  -2.945
  451   3HG2  VAL  54          3HG2      VAL  54   0.118   4.683  -2.943
  452    H    THR  55           H        THR  55  -4.700   3.827  -3.723
  453    HA   THR  55           HA       THR  55  -3.931   6.204  -5.289
  454    HB   THR  55           HB       THR  55  -5.077   4.970  -6.888
  455    HG1  THR  55           HG1      THR  55  -6.448   6.824  -6.055
  456   1HG2  THR  55          1HG2      THR  55  -6.446   3.635  -4.509
  457   2HG2  THR  55          2HG2      THR  55  -7.066   3.446  -6.167
  458   3HG2  THR  55          3HG2      THR  55  -5.431   2.873  -5.757
  459    H    PHE  56           H        PHE  56  -4.630   8.171  -4.653
  460    HA   PHE  56           HA       PHE  56  -6.606   8.180  -2.484
  461   1HB   PHE  56          1HB       PHE  56  -4.242  10.099  -2.878
  462   2HB   PHE  56          2HB       PHE  56  -5.240   9.955  -1.444
  463    HD1  PHE  56           HD1      PHE  56  -3.029   7.801  -3.554
  464    HD2  PHE  56           HD2      PHE  56  -4.353   8.815   0.348
  465    HE1  PHE  56           HE1      PHE  56  -1.386   6.175  -2.573
  466    HE2  PHE  56           HE2      PHE  56  -2.709   7.191   1.328
  467    HZ   PHE  56           HZ       PHE  56  -1.246   5.890  -0.144
  468    H    LEU  57           H        LEU  57  -7.510  10.536  -2.188
  469    HA   LEU  57           HA       LEU  57  -8.040  11.558  -4.887
  470   1HB   LEU  57          1HB       LEU  57  -9.881  10.506  -3.410
  471   2HB   LEU  57          2HB       LEU  57  -9.791  11.991  -2.486
  472    HG   LEU  57           HG       LEU  57 -10.296  13.277  -4.566
  473   1HD1  LEU  57          1HD1      LEU  57 -10.309  10.522  -5.732
  474   2HD1  LEU  57          2HD1      LEU  57 -11.436  11.739  -6.375
  475   3HD1  LEU  57          3HD1      LEU  57  -9.684  12.047  -6.401
  476   1HD2  LEU  57          1HD2      LEU  57 -12.339  13.244  -3.706
  477   2HD2  LEU  57          2HD2      LEU  57 -12.687  11.780  -4.653
  478   3HD2  LEU  57          3HD2      LEU  57 -12.057  11.636  -2.995
  479    H    ASN  58           H        ASN  58  -5.881  12.094  -2.606
  480    HA   ASN  58           HA       ASN  58  -6.226  14.531  -1.534
  481   1HB   ASN  58          1HB       ASN  58  -3.920  12.866  -2.368
  482   2HB   ASN  58          2HB       ASN  58  -3.538  14.576  -2.376
  483   1HD2  ASN  58          1HD2      ASN  58  -5.071  15.575  -0.369
  484   2HD2  ASN  58          2HD2      ASN  58  -4.591  14.937   1.168
  485    H    ASP  59           H        ASP  59  -5.716  13.618  -4.915
  486    HA   ASP  59           HA       ASP  59  -4.545  15.648  -6.098
  487   1HB   ASP  59          1HB       ASP  59  -5.506  13.859  -7.406
  488   2HB   ASP  59          2HB       ASP  59  -7.128  14.233  -6.859
  489    HD2  ASP  59           HD       ASP  59  -5.453  16.227  -9.869
  490    H    LYS  60           H        LYS  60  -7.916  15.594  -4.794
  491    HA   LYS  60           HA       LYS  60  -9.010  17.836  -5.753
  492   1HB   LYS  60          1HB       LYS  60  -9.202  16.320  -3.236
  493   2HB   LYS  60          2HB       LYS  60  -9.720  17.989  -3.097
  494   1HG   LYS  60          1HG       LYS  60 -11.458  17.735  -4.659
  495   2HG   LYS  60          2HG       LYS  60 -10.668  16.409  -5.487
  496   1HD   LYS  60          1HD       LYS  60 -12.396  15.312  -4.315
  497   2HD   LYS  60          2HD       LYS  60 -11.017  15.072  -3.261
  498   1HE   LYS  60          1HE       LYS  60 -11.735  16.759  -1.726
  499   2HE   LYS  60          2HE       LYS  60 -12.823  17.488  -2.892
  500   1HZ   LYS  60          1HZ       LYS  60 -13.214  15.015  -1.349
  501   2HZ   LYS  60          2HZ       LYS  60 -14.262  16.236  -1.598
  502    H    ASP  61           H        ASP  61  -6.453  17.642  -3.227
  503    HA   ASP  61           HA       ASP  61  -6.111  20.507  -3.634
  504   1HB   ASP  61          1HB       ASP  61  -5.212  19.321  -1.039
  505   2HB   ASP  61          2HB       ASP  61  -5.901  20.900  -1.358
  506    HD2  ASP  61           HD       ASP  61  -8.285  20.985  -0.807
  507    H    GLU  62           H        GLU  62  -4.098  20.825  -4.594
  508    HA   GLU  62           HA       GLU  62  -2.249  18.740  -4.767
  509   1HB   GLU  62          1HB       GLU  62  -2.670  20.845  -6.302
  510   2HB   GLU  62          2HB       GLU  62  -1.526  21.644  -5.241
  511   1HG   GLU  62          1HG       GLU  62  -0.207  19.265  -5.751
  512   2HG   GLU  62          2HG       GLU  62  -1.060  19.507  -7.263
  513    HE2  GLU  62           HE       GLU  62   1.738  22.105  -6.053
  514    H    ASP  63           H        ASP  63  -2.906  21.116  -2.321
  515    HA   ASP  63           HA       ASP  63  -0.285  21.358  -1.345
  516   1HB   ASP  63          1HB       ASP  63  -2.772  22.542  -0.845
  517   2HB   ASP  63          2HB       ASP  63  -2.475  21.642   0.629
  518    HD2  ASP  63           HD       ASP  63  -0.950  23.997   1.996
  519    H    ALA  64           H        ALA  64  -3.189  19.337  -0.575
  520    HA   ALA  64           HA       ALA  64  -1.842  17.986   1.576
  521   1HB   ALA  64          1HB       ALA  64  -3.945  16.752   1.750
  522   2HB   ALA  64          2HB       ALA  64  -4.285  18.490   1.571
  523   3HB   ALA  64          3HB       ALA  64  -4.483  17.397   0.181
  524    H    VAL  65           H        VAL  65  -2.063  17.744  -1.891
  525    HA   VAL  65           HA       VAL  65  -1.645  14.924  -2.020
  526    HB   VAL  65           HB       VAL  65  -2.480  16.907  -3.732
  527   1HG1  VAL  65          1HG1      VAL  65  -0.124  17.580  -4.128
  528   2HG1  VAL  65          2HG1      VAL  65   0.222  15.939  -4.726
  529   3HG1  VAL  65          3HG1      VAL  65  -0.926  16.981  -5.600
  530   1HG2  VAL  65          1HG2      VAL  65  -3.374  14.967  -4.414
  531   2HG2  VAL  65          2HG2      VAL  65  -1.912  14.782  -5.414
  532   3HG2  VAL  65          3HG2      VAL  65  -1.995  14.018  -3.808
  533    H    LYS  66           H        LYS  66   0.394  17.896  -2.201
  534    HA   LYS  66           HA       LYS  66   2.770  16.389  -2.674
  535   1HB   LYS  66          1HB       LYS  66   2.282  18.776  -3.415
  536   2HB   LYS  66          2HB       LYS  66   2.551  19.263  -1.753
  537   1HG   LYS  66          1HG       LYS  66   4.810  17.925  -1.962
  538   2HG   LYS  66          2HG       LYS  66   4.531  18.015  -3.690
  539   1HD   LYS  66          1HD       LYS  66   4.326  20.542  -2.033
  540   2HD   LYS  66          2HD       LYS  66   5.912  19.922  -2.444
  541   1HE   LYS  66          1HE       LYS  66   4.951  19.795  -4.908
  542   2HE   LYS  66          2HE       LYS  66   3.730  20.902  -4.311
  543   1HZ   LYS  66          1HZ       LYS  66   5.343  22.531  -3.878
  544   2HZ   LYS  66          2HZ       LYS  66   6.589  21.483  -3.855
  545    H    ALA  67           H        ALA  67   1.327  18.133   0.158
  546    HA   ALA  67           HA       ALA  67   3.397  17.403   1.920
  547   1HB   ALA  67          1HB       ALA  67   0.620  17.893   2.923
  548   2HB   ALA  67          2HB       ALA  67   2.168  18.586   3.460
  549   3HB   ALA  67          3HB       ALA  67   1.388  19.192   1.981
  550    H    GLY  68           H        GLY  68   0.101  16.034   1.267
  551   1HA   GLY  68          1HA       GLY  68   0.148  13.993   3.146
  552   2HA   GLY  68          2HA       GLY  68  -0.749  13.989   1.641
  553    H    ILE  69           H        ILE  69   0.891  13.724  -0.411
  554    HA   ILE  69           HA       ILE  69   1.790  11.120  -0.304
  555    HB   ILE  69           HB       ILE  69   1.202  12.633  -2.285
  556   1HG1  ILE  69          1HG1      ILE  69   3.474  10.638  -2.318
  557   2HG1  ILE  69          2HG1      ILE  69   1.774  10.338  -2.620
  558   1HG2  ILE  69          1HG2      ILE  69   2.863  13.895  -3.339
  559   2HG2  ILE  69          2HG2      ILE  69   3.024  14.313  -1.618
  560   3HG2  ILE  69          3HG2      ILE  69   4.166  13.171  -2.366
  561   1HD1  ILE  69          1HD1      ILE  69   3.852  11.394  -4.443
  562   2HD1  ILE  69          2HD1      ILE  69   2.320  10.571  -4.822
  563   3HD1  ILE  69          3HD1      ILE  69   2.331  12.318  -4.483
  564    H    LYS  70           H        LYS  70   3.412  14.181   0.522
  565    HA   LYS  70           HA       LYS  70   6.023  13.115   0.556
  566   1HB   LYS  70          1HB       LYS  70   5.644  15.489   0.331
  567   2HB   LYS  70          2HB       LYS  70   4.790  15.557   1.859
  568   1HG   LYS  70          1HG       LYS  70   7.128  14.422   2.707
  569   2HG   LYS  70          2HG       LYS  70   7.732  15.328   1.334
  570   1HD   LYS  70          1HD       LYS  70   7.822  17.090   2.787
  571   2HD   LYS  70          2HD       LYS  70   6.096  17.215   2.508
  572   1HE   LYS  70          1HE       LYS  70   5.711  15.646   4.460
  573   2HE   LYS  70          2HE       LYS  70   7.435  15.654   4.768
  574   1HZ   LYS  70          1HZ       LYS  70   6.524  17.337   6.137
  575   2HZ   LYS  70          2HZ       LYS  70   7.193  18.173   4.910
  576    H    ALA  71           H        ALA  71   3.315  13.201   2.872
  577    HA   ALA  71           HA       ALA  71   4.935  12.359   5.072
  578   1HB   ALA  71          1HB       ALA  71   3.075  12.842   6.271
  579   2HB   ALA  71          2HB       ALA  71   2.468  13.557   4.758
  580   3HB   ALA  71          3HB       ALA  71   2.023  11.890   5.196
  581    H    LEU  72           H        LEU  72   2.949  10.845   2.516
  582    HA   LEU  72           HA       LEU  72   3.011   8.272   3.755
  583   1HB   LEU  72          1HB       LEU  72   1.153   8.902   2.377
  584   2HB   LEU  72          2HB       LEU  72   2.202   9.243   1.015
  585    HG   LEU  72           HG       LEU  72   2.804   6.833   0.901
  586   1HD1  LEU  72          1HD1      LEU  72   2.215   5.309   2.423
  587   2HD1  LEU  72          2HD1      LEU  72   1.828   6.694   3.474
  588   3HD1  LEU  72          3HD1      LEU  72   0.543   5.913   2.519
  589   1HD2  LEU  72          1HD2      LEU  72   0.990   7.839  -0.471
  590   2HD2  LEU  72          2HD2      LEU  72   0.766   6.103  -0.146
  591   3HD2  LEU  72          3HD2      LEU  72  -0.184   7.308   0.757
  592    H    GLN  73           H        GLN  73   5.115  10.190   1.695
  593    HA   GLN  73           HA       GLN  73   6.506   7.945   0.667
  594   1HB   GLN  73          1HB       GLN  73   6.516  10.841   0.322
  595   2HB   GLN  73          2HB       GLN  73   8.157  10.250   0.481
  596   1HG   GLN  73          1HG       GLN  73   6.464   8.552  -1.266
  597   2HG   GLN  73          2HG       GLN  73   6.639  10.193  -1.856
  598   1HE2  GLN  73          1HE2      GLN  73   7.805   7.300  -2.313
  599   2HE2  GLN  73          2HE2      GLN  73   9.483   7.589  -2.628
  600    H    GLU  74           H        GLU  74   7.015  10.361   3.303
  601    HA   GLU  74           HA       GLU  74   9.529   9.293   3.997
  602   1HB   GLU  74          1HB       GLU  74   9.412  10.822   5.905
  603   2HB   GLU  74          2HB       GLU  74   8.857  11.646   4.461
  604   1HG   GLU  74          1HG       GLU  74   6.884  12.101   5.476
  605   2HG   GLU  74          2HG       GLU  74   6.554  10.385   5.606
  606    HE2  GLU  74           HE       GLU  74   8.771  10.197   8.222
  607    H    ALA  75           H        ALA  75   6.155   8.617   4.847
  608    HA   ALA  75           HA       ALA  75   6.907   7.032   7.143
  609   1HB   ALA  75          1HB       ALA  75   4.414   6.595   7.180
  610   2HB   ALA  75          2HB       ALA  75   4.868   8.314   7.285
  611   3HB   ALA  75          3HB       ALA  75   4.275   7.641   5.747
  612    H    SER  76           H        SER  76   7.543   6.569   4.031
  613    HA   SER  76           HA       SER  76   6.261   4.309   3.225
  614   1HB   SER  76          1HB       SER  76   9.079   5.337   2.754
  615   2HB   SER  76          2HB       SER  76   8.530   3.850   2.005
  616    HG   SER  76           HG       SER  76   7.233   4.944   0.658
  617    H    GLY  77           H        GLY  77   9.680   4.254   4.465
  618   1HA   GLY  77          1HA       GLY  77   9.915   1.605   4.997
  619   2HA   GLY  77          2HA       GLY  77  10.707   2.867   5.920
  620    H    PHE  78           H        PHE  78   7.891   3.952   6.691
  621    HA   PHE  78           HA       PHE  78   7.741   2.557   9.139
  622   1HB   PHE  78          1HB       PHE  78   6.841   4.972   7.900
  623   2HB   PHE  78          2HB       PHE  78   5.363   4.113   8.287
  624    HD1  PHE  78           HD1      PHE  78   5.497   3.002  10.786
  625    HD2  PHE  78           HD2      PHE  78   7.536   6.485   9.478
  626    HE1  PHE  78           HE1      PHE  78   5.654   3.802  13.160
  627    HE2  PHE  78           HE2      PHE  78   7.692   7.286  11.852
  628    HZ   PHE  78           HZ       PHE  78   6.749   5.934  13.665
  629    H    ILE  79           H        ILE  79   5.653   2.664   6.178
  630    HA   ILE  79           HA       ILE  79   3.742   0.874   7.246
  631    HB   ILE  79           HB       ILE  79   2.770   0.913   5.085
  632   1HG1  ILE  79          1HG1      ILE  79   5.520   1.288   4.185
  633   2HG1  ILE  79          2HG1      ILE  79   4.136   0.625   3.337
  634   1HG2  ILE  79          1HG2      ILE  79   2.600   3.329   4.651
  635   2HG2  ILE  79          2HG2      ILE  79   2.499   2.946   6.386
  636   3HG2  ILE  79          3HG2      ILE  79   4.005   3.610   5.707
  637   1HD1  ILE  79          1HD1      ILE  79   4.559   3.614   3.783
  638   2HD1  ILE  79          2HD1      ILE  79   5.056   2.747   2.310
  639   3HD1  ILE  79          3HD1      ILE  79   3.333   2.849   2.745
  640    H    ARG  80           H        ARG  80   6.795   0.540   5.432
  641    HA   ARG  80           HA       ARG  80   6.389  -2.101   4.680
  642   1HB   ARG  80          1HB       ARG  80   8.138  -0.944   3.554
  643   2HB   ARG  80          2HB       ARG  80   8.828  -0.331   5.043
  644   1HG   ARG  80          1HG       ARG  80   9.680  -2.533   5.651
  645   2HG   ARG  80          2HG       ARG  80   8.790  -3.301   4.352
  646   1HD   ARG  80          1HD       ARG  80  11.046  -3.106   3.550
  647   2HD   ARG  80          2HD       ARG  80  10.148  -1.857   2.711
  648    HE   ARG  80           HE       ARG  80  11.350  -0.213   3.883
  649   1HH1  ARG  80          2HH2      ARG  80  11.860  -3.360   5.432
  650   2HH1  ARG  80          1HH2      ARG  80  13.111  -2.780   6.481
  651   1HH2  ARG  80          1HH       ARG  80  13.764  -0.478   6.369
  652    H    SER  81           H        SER  81   7.874  -0.547   7.580
  653    HA   SER  81           HA       SER  81   8.693  -3.032   8.663
  654   1HB   SER  81          1HB       SER  81   9.663  -0.644   9.081
  655   2HB   SER  81          2HB       SER  81   8.349  -0.449  10.222
  656    HG   SER  81           HG       SER  81  10.666  -2.057  10.391
  657    H    LEU  82           H        LEU  82   5.850  -0.887   8.866
  658    HA   LEU  82           HA       LEU  82   4.736  -1.957  11.199
  659   1HB   LEU  82          1HB       LEU  82   4.176   0.189   9.964
  660   2HB   LEU  82          2HB       LEU  82   3.235  -0.792   8.859
  661    HG   LEU  82           HG       LEU  82   1.546  -0.264  10.250
  662   1HD1  LEU  82          1HD1      LEU  82   1.730  -2.663  10.535
  663   2HD1  LEU  82          2HD1      LEU  82   2.857  -2.445  11.895
  664   3HD1  LEU  82          3HD1      LEU  82   1.166  -1.911  12.047
  665   1HD2  LEU  82          1HD2      LEU  82   1.761   0.469  12.561
  666   2HD2  LEU  82          2HD2      LEU  82   3.485   0.019  12.563
  667   3HD2  LEU  82          3HD2      LEU  82   2.911   1.338  11.516
  668    H    LEU  83           H        LEU  83   4.583  -2.923   7.740
  669    HA   LEU  83           HA       LEU  83   2.623  -4.926   8.196
  670   1HB   LEU  83          1HB       LEU  83   4.568  -4.618   5.905
  671   2HB   LEU  83          2HB       LEU  83   3.117  -5.600   5.921
  672    HG   LEU  83           HG       LEU  83   2.741  -2.711   6.502
  673   1HD1  LEU  83          1HD1      LEU  83   4.489  -3.103   4.539
  674   2HD1  LEU  83          2HD1      LEU  83   2.999  -3.400   3.612
  675   3HD1  LEU  83          3HD1      LEU  83   3.230  -1.848   4.452
  676   1HD2  LEU  83          1HD2      LEU  83   1.270  -4.782   4.854
  677   2HD2  LEU  83          2HD2      LEU  83   0.808  -4.123   6.442
  678   3HD2  LEU  83          3HD2      LEU  83   0.775  -3.078   5.001
  679    H    GLY  84           H        GLY  84   6.205  -5.038   7.581
  680   1HA   GLY  84          1HA       GLY  84   6.633  -7.720   7.836
  681   2HA   GLY  84          2HA       GLY  84   7.762  -6.478   8.339
  682    H    LYS  85           H        LYS  85   6.343  -5.260  10.485
  683    HA   LYS  85           HA       LYS  85   6.799  -7.238  12.499
  684   1HB   LYS  85          1HB       LYS  85   6.297  -4.304  12.388
  685   2HB   LYS  85          2HB       LYS  85   5.844  -5.124  13.867
  686   1HG   LYS  85          1HG       LYS  85   8.039  -5.730  14.383
  687   2HG   LYS  85          2HG       LYS  85   8.533  -5.807  12.704
  688   1HD   LYS  85          1HD       LYS  85   9.243  -3.648  12.718
  689   2HD   LYS  85          2HD       LYS  85   7.726  -3.082  13.391
  690   1HE   LYS  85          1HE       LYS  85   9.123  -2.546  15.164
  691   2HE   LYS  85          2HE       LYS  85   8.699  -4.178  15.643
  692   1HZ   LYS  85          1HZ       LYS  85  10.765  -4.970  15.001
  693   2HZ   LYS  85          2HZ       LYS  85  11.030  -3.808  13.890
  694    H    ALA  86           H        ALA  86   3.980  -5.577  11.011
  695    HA   ALA  86           HA       ALA  86   2.067  -6.526  12.813
  696   1HB   ALA  86          1HB       ALA  86   1.977  -5.639   9.910
  697   2HB   ALA  86          2HB       ALA  86   0.515  -6.072  10.830
  698   3HB   ALA  86          3HB       ALA  86   1.529  -4.708  11.360
  699    H    MET  87           H        MET  87   3.769  -8.013  10.072
  700    HA   MET  87           HA       MET  87   2.168 -10.406  10.558
  701   1HB   MET  87          1HB       MET  87   2.657  -8.926   8.124
  702   2HB   MET  87          2HB       MET  87   3.519 -10.445   7.974
  703   1HG   MET  87          1HG       MET  87   1.295 -11.562   8.803
  704   2HG   MET  87          2HG       MET  87   0.542 -10.021   8.441
  705   1HE   MET  87          1HE       MET  87   0.510  -9.408   4.995
  706   2HE   MET  87          2HE       MET  87   1.165  -8.728   6.505
  707   3HE   MET  87          3HE       MET  87   2.270  -9.299   5.232
  708    H    ARG  88           H        ARG  88   4.781  -9.328  11.760
  709    HA   ARG  88           HA       ARG  88   6.958  -9.889  11.832
  710   1HB   ARG  88          1HB       ARG  88   5.246 -12.209  12.782
  711   2HB   ARG  88          2HB       ARG  88   6.989 -12.330  12.902
  712   1HG   ARG  88          1HG       ARG  88   6.967 -10.078  14.127
  713   2HG   ARG  88          2HG       ARG  88   5.217 -10.187  14.159
  714   1HD   ARG  88          1HD       ARG  88   5.595 -11.243  16.171
  715   2HD   ARG  88          2HD       ARG  88   5.808 -12.655  15.154
  716    HE   ARG  88           HE       ARG  88   8.280 -11.134  15.457
  717   1HH1  ARG  88          2HH2      ARG  88   6.228 -13.585  16.988
  718   2HH1  ARG  88          1HH2      ARG  88   7.528 -14.280  17.900
  719   1HH2  ARG  88          1HH       ARG  88   9.731 -13.362  17.692
  720    H    LEU  89           H        LEU  89   7.713  -9.909   9.602
  721    HA   LEU  89           HA       LEU  89   7.948 -12.631   8.516
  722   1HB   LEU  89          1HB       LEU  89   7.227 -11.994   6.519
  723   2HB   LEU  89          2HB       LEU  89   6.493 -10.657   7.381
  724    HG   LEU  89           HG       LEU  89   9.139 -10.616   5.904
  725   1HD1  LEU  89          1HD1      LEU  89   6.527  -9.193   5.311
  726   2HD1  LEU  89          2HD1      LEU  89   8.036  -9.087   4.371
  727   3HD1  LEU  89          3HD1      LEU  89   7.147 -10.628   4.457
  728   1HD2  LEU  89          1HD2      LEU  89   8.359  -7.992   6.542
  729   2HD2  LEU  89          2HD2      LEU  89   8.188  -8.931   8.045
  730   3HD2  LEU  89          3HD2      LEU  89   9.746  -8.907   7.182
  731    H    ARG  90           H        ARG  90   9.859 -12.420   6.669
  732    HA   ARG  90           HA       ARG  90  12.020 -11.014   8.012
  733   1HB   ARG  90          1HB       ARG  90  13.525 -12.940   7.525
  734   2HB   ARG  90          2HB       ARG  90  12.189 -13.430   8.549
  735   1HG   ARG  90          1HG       ARG  90  10.961 -14.195   6.445
  736   2HG   ARG  90          2HG       ARG  90  12.421 -13.860   5.534
  737   1HD   ARG  90          1HD       ARG  90  13.410 -15.402   7.625
  738   2HD   ARG  90          2HD       ARG  90  11.825 -16.112   7.387
  739    HE   ARG  90           HE       ARG  90  14.087 -16.313   5.584
  740   1HH1  ARG  90          2HH2      ARG  90  10.546 -16.184   5.634
  741   2HH1  ARG  90          1HH2      ARG  90  10.370 -17.035   4.135
  742   1HH2  ARG  90          1HH       ARG  90  12.329 -17.761   2.961
  743    H    ILE  91           H        ILE  91  10.683 -12.513   5.024
  744    HA   ILE  91           HA       ILE  91  12.545 -12.001   3.171
  745    HB   ILE  91           HB       ILE  91  10.568 -11.469   1.643
  746   1HG1  ILE  91          1HG1      ILE  91   8.723 -12.472   3.725
  747   2HG1  ILE  91          2HG1      ILE  91   9.269 -10.824   3.957
  748   1HG2  ILE  91          1HG2      ILE  91  10.095 -13.723   1.415
  749   2HG2  ILE  91          2HG2      ILE  91  11.672 -13.743   2.241
  750   3HG2  ILE  91          3HG2      ILE  91  10.178 -14.029   3.167
  751   1HD1  ILE  91          1HD1      ILE  91   8.572 -11.376   1.145
  752   2HD1  ILE  91          2HD1      ILE  91   7.208 -11.631   2.259
  753   3HD1  ILE  91          3HD1      ILE  91   8.032 -10.056   2.209
  754    H    VAL  92           H        VAL  92  10.628  -9.613   4.973
  755    HA   VAL  92           HA       VAL  92  10.404  -7.368   4.528
  756    HB   VAL  92           HB       VAL  92  13.331  -7.777   5.171
  757   1HG1  VAL  92          1HG1      VAL  92  12.912  -5.576   6.452
  758   2HG1  VAL  92          2HG1      VAL  92  13.095  -5.493   4.684
  759   3HG1  VAL  92          3HG1      VAL  92  11.475  -5.407   5.417
  760   1HG2  VAL  92          1HG2      VAL  92  12.743  -7.895   7.468
  761   2HG2  VAL  92          2HG2      VAL  92  11.061  -7.414   7.143
  762   3HG2  VAL  92          3HG2      VAL  92  11.645  -9.014   6.626
  763    HA   PRO  93           HA       PRO  93  12.203  -7.350   0.326
  764   1HB   PRO  93          1HB       PRO  93   9.894  -7.436  -1.132
  765   2HB   PRO  93          2HB       PRO  93  10.853  -8.856  -0.774
  766   1HG   PRO  93          1HG       PRO  93   8.287  -8.004   0.419
  767   2HG   PRO  93          2HG       PRO  93   9.035  -9.588   0.443
  768   1HD   PRO  93          1HD       PRO  93   8.956  -7.694   2.596
  769   2HD   PRO  93          2HD       PRO  93   9.803  -9.228   2.580
  770    H    GLU  94           H        GLU  94  12.318  -5.646  -1.244
  771    HA   GLU  94           HA       GLU  94  11.770  -3.210   0.015
  772   1HB   GLU  94          1HB       GLU  94  13.426  -4.061  -2.028
  773   2HB   GLU  94          2HB       GLU  94  12.221  -3.154  -2.922
  774   1HG   GLU  94          1HG       GLU  94  12.581  -1.180  -1.458
  775   2HG   GLU  94          2HG       GLU  94  13.733  -2.082  -0.493
  776    HE2  GLU  94           HE       GLU  94  13.859   0.215  -2.465
  777    H    LEU  95           H        LEU  95   9.356  -3.927   0.346
  778    HA   LEU  95           HA       LEU  95   7.645  -3.789  -1.900
  779   1HB   LEU  95          1HB       LEU  95   5.865  -3.681  -0.188
  780   2HB   LEU  95          2HB       LEU  95   6.960  -5.037  -0.017
  781    HG   LEU  95           HG       LEU  95   8.105  -3.125   1.626
  782   1HD1  LEU  95          1HD1      LEU  95   5.314  -2.437   1.264
  783   2HD1  LEU  95          2HD1      LEU  95   5.663  -2.860   2.958
  784   3HD1  LEU  95          3HD1      LEU  95   6.599  -1.579   2.149
  785   1HD2  LEU  95          1HD2      LEU  95   7.425  -5.691   1.846
  786   2HD2  LEU  95          2HD2      LEU  95   7.814  -4.679   3.259
  787   3HD2  LEU  95          3HD2      LEU  95   6.115  -4.990   2.826
  788    H    THR  96           H        THR  96   8.069  -1.914  -3.105
  789    HA   THR  96           HA       THR  96   8.262   0.640  -1.900
  790    HB   THR  96           HB       THR  96   9.193  -0.132  -4.157
  791    HG1  THR  96           HG1      THR  96   8.925   2.137  -3.592
  792   1HG2  THR  96          1HG2      THR  96   7.353   0.472  -6.001
  793   2HG2  THR  96          2HG2      THR  96   7.470  -1.191  -5.375
  794   3HG2  THR  96          3HG2      THR  96   6.221  -0.090  -4.748
  795    H    PHE  97           H        PHE  97   6.720   2.482  -2.685
  796    HA   PHE  97           HA       PHE  97   3.971   1.519  -2.338
  797   1HB   PHE  97          1HB       PHE  97   5.601   3.015  -0.553
  798   2HB   PHE  97          2HB       PHE  97   4.643   4.248  -1.352
  799    HD1  PHE  97           HD1      PHE  97   4.087   0.872   0.162
  800    HD2  PHE  97           HD2      PHE  97   2.696   4.854  -0.296
  801    HE1  PHE  97           HE1      PHE  97   2.167   0.378   1.700
  802    HE2  PHE  97           HE2      PHE  97   0.776   4.361   1.242
  803    HZ   PHE  97           HZ       PHE  97   0.534   2.128   2.223
  804    H    PHE  98           H        PHE  98   2.938   1.895  -4.247
  805    HA   PHE  98           HA       PHE  98   3.777   4.176  -5.832
  806   1HB   PHE  98          1HB       PHE  98   2.648   1.511  -6.188
  807   2HB   PHE  98          2HB       PHE  98   1.511   2.658  -6.865
  808    HD1  PHE  98           HD1      PHE  98   2.151   4.064  -8.773
  809    HD2  PHE  98           HD2      PHE  98   4.803   1.145  -7.210
  810    HE1  PHE  98           HE1      PHE  98   3.533   4.201 -10.864
  811    HE2  PHE  98           HE2      PHE  98   6.186   1.281  -9.299
  812    HZ   PHE  98           HZ       PHE  98   5.535   2.808 -11.102
  813    H    TYR  99           H        TYR  99   2.834   6.120  -5.434
  814    HA   TYR  99           HA       TYR  99   0.105   6.113  -4.378
  815   1HB   TYR  99          1HB       TYR  99   1.654   8.645  -4.788
  816   2HB   TYR  99          2HB       TYR  99   0.855   8.084  -3.333
  817    HD1  TYR  99           HD1      TYR  99   3.993   8.085  -5.241
  818    HD2  TYR  99           HD2      TYR  99   2.041   6.691  -1.698
  819    HE1  TYR  99           HE1      TYR  99   6.245   7.485  -4.228
  820    HE2  TYR  99           HE2      TYR  99   4.301   6.096  -0.696
  821    HH   TYR  99           HH       TYR  99   6.434   6.003  -1.001
  822    H    ASP 100           H        ASP 100  -1.216   5.806  -6.195
  823    HA   ASP 100           HA       ASP 100  -0.753   7.652  -8.386
  824   1HB   ASP 100          1HB       ASP 100  -1.513   4.918  -8.253
  825   2HB   ASP 100          2HB       ASP 100  -2.966   5.764  -8.747
  826    HD2  ASP 100           HD       ASP 100  -0.565   4.705 -11.414
  827    H    ASN 101           H        ASN 101  -1.713   9.564  -7.393
  828    HA   ASN 101           HA       ASN 101  -4.375   9.300  -6.354
  829   1HB   ASN 101          1HB       ASN 101  -3.117  12.004  -6.772
  830   2HB   ASN 101          2HB       ASN 101  -4.019  11.407  -5.393
  831   1HD2  ASN 101          1HD2      ASN 101  -2.637   8.979  -5.006
  832   2HD2  ASN 101          2HD2      ASN 101  -1.050   9.315  -4.396
  833    H    SER 102           H        SER 102  -5.533  11.771  -7.123
  834    HA   SER 102           HA       SER 102  -6.068  11.209  -9.887
  835   1HB   SER 102          1HB       SER 102  -7.530  13.500  -8.932
  836   2HB   SER 102          2HB       SER 102  -8.142  11.908  -9.334
  837    HG   SER 102           HG       SER 102  -8.014  11.259  -7.228
  838    H    LEU 103           H        LEU 103  -3.519  12.599  -8.684
  839    HA   LEU 103           HA       LEU 103  -3.726  15.166 -10.052
  840   1HB   LEU 103          1HB       LEU 103  -2.874  15.046  -7.733
  841   2HB   LEU 103          2HB       LEU 103  -1.544  14.051  -8.286
  842    HG   LEU 103           HG       LEU 103  -1.277  16.201  -9.943
  843   1HD1  LEU 103          1HD1      LEU 103  -3.199  17.158  -8.321
  844   2HD1  LEU 103          2HD1      LEU 103  -1.759  17.638  -7.392
  845   3HD1  LEU 103          3HD1      LEU 103  -1.951  18.178  -9.076
  846   1HD2  LEU 103          1HD2      LEU 103   0.238  14.938  -8.090
  847   2HD2  LEU 103          2HD2      LEU 103   0.731  16.418  -8.946
  848   3HD2  LEU 103          3HD2      LEU 103   0.034  16.526  -7.311
  849    H    VAL 104           H        VAL 104  -3.290  12.082 -10.996
  850    HA   VAL 104           HA       VAL 104  -1.409  12.908 -13.078
  851    HB   VAL 104           HB       VAL 104  -1.125  10.713 -11.108
  852   1HG1  VAL 104          1HG1      VAL 104  -0.442  10.340 -14.044
  853   2HG1  VAL 104          2HG1      VAL 104   0.164   9.314 -12.721
  854   3HG1  VAL 104          3HG1      VAL 104  -1.580   9.375 -13.072
  855   1HG2  VAL 104          1HG2      VAL 104   1.210  11.571 -12.661
  856   2HG2  VAL 104          2HG2      VAL 104   0.354  12.922 -11.881
  857   3HG2  VAL 104          3HG2      VAL 104   0.944  11.558 -10.901
  858    H    GLU 105           H        GLU 105  -4.479  12.172 -12.350
  859    HA   GLU 105           HA       GLU 105  -4.926  11.134 -14.970
  860   1HB   GLU 105          1HB       GLU 105  -6.311   9.543 -12.835
  861   2HB   GLU 105          2HB       GLU 105  -5.839   9.061 -14.453
  862   1HG   GLU 105          1HG       GLU 105  -3.475   8.927 -13.783
  863   2HG   GLU 105          2HG       GLU 105  -3.845   9.581 -12.200
  864    HE2  GLU 105           HE       GLU 105  -3.986   6.225 -11.272
  865    H    GLY 106           H        GLY 106  -6.108  12.233 -11.777
  866   1HA   GLY 106          1HA       GLY 106  -7.620  14.004 -11.565
  867   2HA   GLY 106          2HA       GLY 106  -8.288  13.644 -13.145
  868    H    MET 107           H        MET 107  -8.466  10.706 -12.710
  869    HA   MET 107           HA       MET 107 -10.377  10.603 -10.528
  870   1HB   MET 107          1HB       MET 107 -12.070   9.574 -11.962
  871   2HB   MET 107          2HB       MET 107 -11.548  11.042 -12.766
  872   1HG   MET 107          1HG       MET 107 -10.278   8.337 -13.379
  873   2HG   MET 107          2HG       MET 107 -11.712   8.896 -14.218
  874   1HE   MET 107          1HE       MET 107  -8.333   8.408 -15.250
  875   2HE   MET 107          2HE       MET 107  -7.452   9.939 -15.033
  876   3HE   MET 107          3HE       MET 107  -8.071   9.059 -13.614
  877    H    ARG 108           H        ARG 108  -7.581   9.613 -10.942
  878    HA   ARG 108           HA       ARG 108  -7.143   7.189 -11.719
  879   1HB   ARG 108          1HB       ARG 108  -5.473   6.980 -10.022
  880   2HB   ARG 108          2HB       ARG 108  -5.700   8.711 -10.181
  881   1HG   ARG 108          1HG       ARG 108  -6.824   6.886  -8.016
  882   2HG   ARG 108          2HG       ARG 108  -5.693   8.210  -7.813
  883   1HD   ARG 108          1HD       ARG 108  -7.455   9.838  -8.512
  884   2HD   ARG 108          2HD       ARG 108  -8.585   8.522  -8.759
  885    HE   ARG 108           HE       ARG 108  -7.614   9.542  -6.152
  886   1HH1  ARG 108          2HH2      ARG 108  -9.492   7.085  -7.880
  887   2HH1  ARG 108          1HH2      ARG 108 -10.366   6.584  -6.471
  888   1HH2  ARG 108          1HH       ARG 108  -9.924   7.654  -4.373
  Start of MODEL   10
    1    H    MET   1           H        MET   1 -12.357 -11.583  -0.137
    2    HA   MET   1           HA       MET   1 -11.025  -9.396  -0.722
    3   1HB   MET   1          1HB       MET   1 -10.490 -10.177   2.173
    4   2HB   MET   1          2HB       MET   1  -9.207  -9.434   1.240
    5   1HG   MET   1          1HG       MET   1 -11.701  -7.954   0.861
    6   2HG   MET   1          2HG       MET   1 -11.356  -8.117   2.571
    7   1HE   MET   1          1HE       MET   1 -10.191  -4.718   0.618
    8   2HE   MET   1          2HE       MET   1 -11.641  -5.724   0.849
    9   3HE   MET   1          3HE       MET   1 -10.837  -4.985   2.255
   10    H    ALA   2           H        ALA   2 -10.151 -12.340   1.238
   11    HA   ALA   2           HA       ALA   2  -7.847 -12.904  -0.261
   12   1HB   ALA   2          1HB       ALA   2  -9.228 -15.184   1.013
   13   2HB   ALA   2          2HB       ALA   2  -7.598 -14.533   1.296
   14   3HB   ALA   2          3HB       ALA   2  -9.004 -13.782   2.085
   15    H    LYS   3           H        LYS   3  -7.609 -15.088  -1.493
   16    HA   LYS   3           HA       LYS   3 -10.007 -15.803  -2.953
   17   1HB   LYS   3          1HB       LYS   3  -8.888 -13.809  -4.110
   18   2HB   LYS   3          2HB       LYS   3  -7.566 -14.895  -4.488
   19   1HG   LYS   3          1HG       LYS   3  -9.061 -16.402  -5.713
   20   2HG   LYS   3          2HG       LYS   3 -10.474 -15.507  -5.189
   21   1HD   LYS   3          1HD       LYS   3 -10.242 -13.988  -6.864
   22   2HD   LYS   3          2HD       LYS   3  -8.560 -13.704  -6.467
   23   1HE   LYS   3          1HE       LYS   3  -7.882 -14.939  -8.246
   24   2HE   LYS   3          2HE       LYS   3  -8.777 -16.331  -7.671
   25   1HZ   LYS   3          1HZ       LYS   3 -10.803 -15.092  -8.662
   26   2HZ   LYS   3          2HZ       LYS   3  -9.716 -14.216  -9.498
   27    H    GLU   4           H        GLU   4  -9.717 -17.773  -1.724
   28    HA   GLU   4           HA       GLU   4  -7.288 -19.172  -1.893
   29   1HB   GLU   4          1HB       GLU   4  -8.792 -21.106  -1.033
   30   2HB   GLU   4          2HB       GLU   4  -8.610 -19.694  -0.011
   31   1HG   GLU   4          1HG       GLU   4 -10.811 -19.095  -0.227
   32   2HG   GLU   4          2HG       GLU   4 -10.838 -19.437  -1.946
   33    HE2  GLU   4           HE       GLU   4 -12.703 -22.214  -1.299
   34    H    PHE   5           H        PHE   5  -6.771 -19.255  -4.170
   35    HA   PHE   5           HA       PHE   5  -8.507 -21.097  -5.658
   36   1HB   PHE   5          1HB       PHE   5  -8.400 -18.739  -6.538
   37   2HB   PHE   5          2HB       PHE   5  -6.649 -18.801  -6.522
   38    HD1  PHE   5           HD1      PHE   5  -6.674 -18.149  -8.902
   39    HD2  PHE   5           HD2      PHE   5  -8.431 -21.781  -7.588
   40    HE1  PHE   5           HE1      PHE   5  -6.683 -19.000 -11.263
   41    HE2  PHE   5           HE2      PHE   5  -8.441 -22.631  -9.949
   42    HZ   PHE   5           HZ       PHE   5  -7.566 -21.230 -11.759
   43    H    GLY   6           H        GLY   6  -5.836 -21.168  -3.834
   44   1HA   GLY   6          1HA       GLY   6  -4.163 -22.686  -3.724
   45   2HA   GLY   6          2HA       GLY   6  -4.697 -23.382  -5.242
   46    H    ARG   7           H        ARG   7  -4.612 -20.485  -6.438
   47    HA   ARG   7           HA       ARG   7  -2.001 -20.782  -7.445
   48   1HB   ARG   7          1HB       ARG   7  -4.409 -19.257  -8.067
   49   2HB   ARG   7          2HB       ARG   7  -3.021 -18.188  -8.117
   50   1HG   ARG   7          1HG       ARG   7  -1.873 -19.622  -9.724
   51   2HG   ARG   7          2HG       ARG   7  -3.072 -20.886  -9.539
   52   1HD   ARG   7          1HD       ARG   7  -4.795 -19.047 -10.326
   53   2HD   ARG   7          2HD       ARG   7  -3.380 -18.187 -10.901
   54    HE   ARG   7           HE       ARG   7  -4.565 -20.526 -12.117
   55   1HH1  ARG   7          2HH2      ARG   7  -1.427 -18.985 -11.540
   56   2HH1  ARG   7          1HH2      ARG   7  -0.674 -19.718 -12.916
   57   1HH2  ARG   7          1HH       ARG   7  -1.955 -21.190 -14.309
   58    HA   PRO   8           HA       PRO   8   0.095 -17.729  -5.107
   59   1HB   PRO   8          1HB       PRO   8   1.252 -15.970  -6.850
   60   2HB   PRO   8          2HB       PRO   8   1.897 -17.568  -6.533
   61   1HG   PRO   8          1HG       PRO   8   0.416 -16.603  -8.903
   62   2HG   PRO   8          2HG       PRO   8   1.420 -18.030  -8.742
   63   1HD   PRO   8          1HD       PRO   8  -1.447 -17.943  -8.766
   64   2HD   PRO   8          2HD       PRO   8  -0.443 -19.353  -8.490
   65    H    GLN   9           H        GLN   9  -2.692 -16.926  -6.491
   66    HA   GLN   9           HA       GLN   9  -2.563 -14.142  -5.821
   67   1HB   GLN   9          1HB       GLN   9  -4.302 -15.893  -7.392
   68   2HB   GLN   9          2HB       GLN   9  -5.251 -14.859  -6.342
   69   1HG   GLN   9          1HG       GLN   9  -4.872 -13.712  -8.477
   70   2HG   GLN   9          2HG       GLN   9  -4.026 -12.855  -7.204
   71   1HE2  GLN   9          1HE2      GLN   9  -1.957 -12.432  -7.439
   72   2HE2  GLN   9          2HE2      GLN   9  -0.880 -13.129  -8.603
   73    H    ARG  10           H        ARG  10  -3.726 -17.214  -4.463
   74    HA   ARG  10           HA       ARG  10  -5.565 -16.353  -2.692
   75   1HB   ARG  10          1HB       ARG  10  -4.836 -18.745  -3.101
   76   2HB   ARG  10          2HB       ARG  10  -3.399 -18.444  -2.146
   77   1HG   ARG  10          1HG       ARG  10  -6.121 -17.849  -0.957
   78   2HG   ARG  10          2HG       ARG  10  -5.554 -19.506  -1.015
   79   1HD   ARG  10          1HD       ARG  10  -3.373 -17.887  -0.048
   80   2HD   ARG  10          2HD       ARG  10  -4.805 -17.417   0.843
   81    HE   ARG  10           HE       ARG  10  -4.729 -20.275   0.706
   82   1HH1  ARG  10          2HH2      ARG  10  -2.995 -17.598   2.248
   83   2HH1  ARG  10          1HH2      ARG  10  -2.485 -18.546   3.605
   84   1HH2  ARG  10          1HH       ARG  10  -3.120 -20.853   3.730
   85    H    VAL  11           H        VAL  11  -1.987 -16.716  -2.085
   86    HA   VAL  11           HA       VAL  11  -2.129 -15.471   0.451
   87    HB   VAL  11           HB       VAL  11  -0.215 -16.809  -1.219
   88   1HG1  VAL  11          1HG1      VAL  11   1.814 -15.532  -0.502
   89   2HG1  VAL  11          2HG1      VAL  11   0.796 -14.668  -1.680
   90   3HG1  VAL  11          3HG1      VAL  11   0.742 -14.217   0.041
   91   1HG2  VAL  11          1HG2      VAL  11  -1.083 -16.963   1.350
   92   2HG2  VAL  11          2HG2      VAL  11   0.416 -17.718   0.756
   93   3HG2  VAL  11          3HG2      VAL  11   0.480 -16.144   1.587
   94    H    ALA  12           H        ALA  12  -1.352 -14.378  -2.891
   95    HA   ALA  12           HA       ALA  12  -0.374 -11.883  -2.339
   96   1HB   ALA  12          1HB       ALA  12  -0.526 -13.019  -4.569
   97   2HB   ALA  12          2HB       ALA  12  -2.266 -12.646  -4.598
   98   3HB   ALA  12          3HB       ALA  12  -1.073 -11.326  -4.601
   99    H    GLN  13           H        GLN  13  -3.769 -13.061  -2.359
  100    HA   GLN  13           HA       GLN  13  -4.829 -10.467  -2.035
  101   1HB   GLN  13          1HB       GLN  13  -6.059 -13.217  -1.561
  102   2HB   GLN  13          2HB       GLN  13  -6.964 -11.717  -1.543
  103   1HG   GLN  13          1HG       GLN  13  -6.056 -13.295  -3.833
  104   2HG   GLN  13          2HG       GLN  13  -7.241 -12.005  -3.782
  105   1HE2  GLN  13          1HE2      GLN  13  -6.362  -9.769  -3.562
  106   2HE2  GLN  13          2HE2      GLN  13  -4.949  -9.349  -4.471
  107    H    GLU  14           H        GLU  14  -4.792 -13.340   0.208
  108    HA   GLU  14           HA       GLU  14  -5.671 -12.211   2.427
  109   1HB   GLU  14          1HB       GLU  14  -4.228 -14.534   1.776
  110   2HB   GLU  14          2HB       GLU  14  -3.257 -13.781   3.026
  111   1HG   GLU  14          1HG       GLU  14  -5.988 -13.547   3.866
  112   2HG   GLU  14          2HG       GLU  14  -5.784 -15.189   3.291
  113    HE2  GLU  14           HE       GLU  14  -4.641 -16.522   4.579
  114    H    MET  15           H        MET  15  -2.336 -11.869   1.098
  115    HA   MET  15           HA       MET  15  -1.455 -10.353   3.316
  116   1HB   MET  15          1HB       MET  15  -0.370 -11.554   0.911
  117   2HB   MET  15          2HB       MET  15   0.110  -9.869   0.913
  118   1HG   MET  15          1HG       MET  15   0.769 -10.315   3.437
  119   2HG   MET  15          2HG       MET  15   0.726 -12.005   2.980
  120   1HE   MET  15          1HE       MET  15   4.279 -10.085   3.219
  121   2HE   MET  15          2HE       MET  15   2.871 -10.581   4.190
  122   3HE   MET  15          3HE       MET  15   3.934 -11.813   3.468
  123    H    GLN  16           H        GLN  16  -2.785  -9.638   0.059
  124    HA   GLN  16           HA       GLN  16  -2.147  -6.940   0.050
  125   1HB   GLN  16          1HB       GLN  16  -2.850  -8.224  -1.956
  126   2HB   GLN  16          2HB       GLN  16  -4.464  -8.398  -1.298
  127   1HG   GLN  16          1HG       GLN  16  -3.507  -5.588  -1.367
  128   2HG   GLN  16          2HG       GLN  16  -3.623  -6.328  -2.951
  129   1HE2  GLN  16          1HE2      GLN  16  -5.332  -5.020  -3.539
  130   2HE2  GLN  16          2HE2      GLN  16  -6.946  -5.235  -2.946
  131    H    LYS  17           H        LYS  17  -4.844  -8.793   1.489
  132    HA   LYS  17           HA       LYS  17  -6.377  -6.458   2.086
  133   1HB   LYS  17          1HB       LYS  17  -7.889  -7.971   3.166
  134   2HB   LYS  17          2HB       LYS  17  -7.367  -8.697   1.659
  135   1HG   LYS  17          1HG       LYS  17  -5.971 -10.277   2.741
  136   2HG   LYS  17          2HG       LYS  17  -5.841  -9.316   4.202
  137   1HD   LYS  17          1HD       LYS  17  -8.639  -9.938   3.740
  138   2HD   LYS  17          2HD       LYS  17  -7.710 -11.419   3.638
  139   1HE   LYS  17          1HE       LYS  17  -6.577 -10.723   5.847
  140   2HE   LYS  17          2HE       LYS  17  -7.770  -9.445   5.962
  141   1HZ   LYS  17          1HZ       LYS  17  -9.512 -11.050   6.073
  142   2HZ   LYS  17          2HZ       LYS  17  -8.550 -12.287   5.631
  143    H    GLU  18           H        GLU  18  -3.991  -8.549   3.761
  144    HA   GLU  18           HA       GLU  18  -4.402  -7.378   6.268
  145   1HB   GLU  18          1HB       GLU  18  -3.348  -9.596   5.958
  146   2HB   GLU  18          2HB       GLU  18  -1.985  -8.858   5.141
  147   1HG   GLU  18          1HG       GLU  18  -1.102  -8.978   7.283
  148   2HG   GLU  18          2HG       GLU  18  -1.847  -7.395   7.382
  149    HE2  GLU  18           HE       GLU  18  -2.423 -10.713   8.794
  150    H    ILE  19           H        ILE  19  -2.091  -6.758   3.565
  151    HA   ILE  19           HA       ILE  19  -0.701  -4.729   4.991
  152    HB   ILE  19           HB       ILE  19   0.556  -4.455   3.045
  153   1HG1  ILE  19          1HG1      ILE  19  -1.767  -5.662   1.522
  154   2HG1  ILE  19          2HG1      ILE  19  -1.186  -4.010   1.437
  155   1HG2  ILE  19          1HG2      ILE  19   0.318  -7.143   2.232
  156   2HG2  ILE  19          2HG2      ILE  19   1.463  -6.446   3.402
  157   3HG2  ILE  19          3HG2      ILE  19  -0.093  -7.103   3.964
  158   1HD1  ILE  19          1HD1      ILE  19  -0.125  -6.450   0.136
  159   2HD1  ILE  19          2HD1      ILE  19   0.035  -4.744  -0.345
  160   3HD1  ILE  19          3HD1      ILE  19   1.127  -5.430   0.882
  161    H    ALA  20           H        ALA  20  -3.325  -4.813   2.513
  162    HA   ALA  20           HA       ALA  20  -3.511  -2.092   2.082
  163   1HB   ALA  20          1HB       ALA  20  -4.664  -3.661   0.674
  164   2HB   ALA  20          2HB       ALA  20  -5.577  -4.322   2.053
  165   3HB   ALA  20          3HB       ALA  20  -5.908  -2.672   1.474
  166    H    LEU  21           H        LEU  21  -4.796  -4.156   4.723
  167    HA   LEU  21           HA       LEU  21  -6.425  -2.142   5.841
  168   1HB   LEU  21          1HB       LEU  21  -6.913  -4.407   6.299
  169   2HB   LEU  21          2HB       LEU  21  -5.285  -4.736   6.858
  170    HG   LEU  21           HG       LEU  21  -6.348  -2.667   8.510
  171   1HD1  LEU  21          1HD1      LEU  21  -8.579  -3.235   7.912
  172   2HD1  LEU  21          2HD1      LEU  21  -8.251  -4.977   8.066
  173   3HD1  LEU  21          3HD1      LEU  21  -8.270  -3.944   9.515
  174   1HD2  LEU  21          1HD2      LEU  21  -6.214  -4.638  10.213
  175   2HD2  LEU  21          2HD2      LEU  21  -5.472  -5.519   8.856
  176   3HD2  LEU  21          3HD2      LEU  21  -4.728  -4.016   9.454
  177    H    ILE  22           H        ILE  22  -3.209  -3.481   6.893
  178    HA   ILE  22           HA       ILE  22  -2.784  -1.548   8.842
  179    HB   ILE  22           HB       ILE  22  -0.870  -3.246   7.241
  180   1HG1  ILE  22          1HG1      ILE  22  -1.895  -3.616  10.069
  181   2HG1  ILE  22          2HG1      ILE  22  -2.611  -4.388   8.667
  182   1HG2  ILE  22          1HG2      ILE  22   0.300  -1.286   8.126
  183   2HG2  ILE  22          2HG2      ILE  22  -0.326  -1.639   9.754
  184   3HG2  ILE  22          3HG2      ILE  22   0.796  -2.775   8.965
  185   1HD1  ILE  22          1HD1      ILE  22   0.288  -4.740   8.632
  186   2HD1  ILE  22          2HD1      ILE  22  -0.402  -5.313  10.170
  187   3HD1  ILE  22          3HD1      ILE  22  -0.996  -5.975   8.628
  188    H    LEU  23           H        LEU  23  -2.681  -1.374   5.359
  189    HA   LEU  23           HA       LEU  23  -0.984   0.973   5.392
  190   1HB   LEU  23          1HB       LEU  23  -0.878  -0.867   3.664
  191   2HB   LEU  23          2HB       LEU  23  -2.420  -0.291   3.061
  192    HG   LEU  23           HG       LEU  23  -1.359   1.952   2.662
  193   1HD1  LEU  23          1HD1      LEU  23   1.362   1.163   2.491
  194   2HD1  LEU  23          2HD1      LEU  23   0.631   2.423   3.514
  195   3HD1  LEU  23          3HD1      LEU  23   0.789   0.760   4.126
  196   1HD2  LEU  23          1HD2      LEU  23  -0.033   1.173   0.659
  197   2HD2  LEU  23          2HD2      LEU  23  -0.312  -0.493   1.223
  198   3HD2  LEU  23          3HD2      LEU  23  -1.692   0.543   0.786
  199    H    GLN  24           H        GLN  24  -4.311   0.132   5.768
  200    HA   GLN  24           HA       GLN  24  -5.052   2.852   5.016
  201   1HB   GLN  24          1HB       GLN  24  -6.397   0.221   4.740
  202   2HB   GLN  24          2HB       GLN  24  -7.441   1.487   5.352
  203   1HG   GLN  24          1HG       GLN  24  -7.637   2.345   3.266
  204   2HG   GLN  24          2HG       GLN  24  -5.912   2.648   3.221
  205   1HE2  GLN  24          1HE2      GLN  24  -5.887   2.190   1.013
  206   2HE2  GLN  24          2HE2      GLN  24  -5.930   0.574   0.392
  207    H    ARG  25           H        ARG  25  -4.280   0.873   7.641
  208    HA   ARG  25           HA       ARG  25  -6.085   2.368   9.365
  209   1HB   ARG  25          1HB       ARG  25  -5.404  -0.431   9.262
  210   2HB   ARG  25          2HB       ARG  25  -4.755   0.200  10.761
  211   1HG   ARG  25          1HG       ARG  25  -7.558   1.019  10.025
  212   2HG   ARG  25          2HG       ARG  25  -7.317  -0.641  10.535
  213   1HD   ARG  25          1HD       ARG  25  -6.002   0.382  12.563
  214   2HD   ARG  25          2HD       ARG  25  -6.749   1.902  12.109
  215    HE   ARG  25           HE       ARG  25  -8.671  -0.297  12.317
  216   1HH1  ARG  25          2HH2      ARG  25  -6.967   2.224  14.132
  217   2HH1  ARG  25          1HH2      ARG  25  -8.144   2.280  15.400
  218   1HH2  ARG  25          1HH       ARG  25 -10.051   0.833  15.297
  219    H    GLU  26           H        GLU  26  -2.756   0.900   9.210
  220    HA   GLU  26           HA       GLU  26  -1.841   2.526  11.333
  221   1HB   GLU  26          1HB       GLU  26  -0.032   1.143  11.296
  222   2HB   GLU  26          2HB       GLU  26  -0.991   0.177  10.194
  223   1HG   GLU  26          1HG       GLU  26   0.897   0.428   8.876
  224   2HG   GLU  26          2HG       GLU  26   0.028   1.862   8.365
  225    HE2  GLU  26           HE       GLU  26   3.341   2.985   9.292
  226    H    ILE  27           H        ILE  27  -2.690   3.285   8.199
  227    HA   ILE  27           HA       ILE  27  -0.500   5.190   7.843
  228    HB   ILE  27           HB       ILE  27  -1.594   3.478   6.079
  229   1HG1  ILE  27          1HG1      ILE  27  -0.304   6.176   5.656
  230   2HG1  ILE  27          2HG1      ILE  27   0.444   4.591   5.628
  231   1HG2  ILE  27          1HG2      ILE  27  -3.792   4.441   6.063
  232   2HG2  ILE  27          2HG2      ILE  27  -3.134   6.067   5.763
  233   3HG2  ILE  27          3HG2      ILE  27  -3.003   4.809   4.511
  234   1HD1  ILE  27          1HD1      ILE  27   0.194   5.298   3.330
  235   2HD1  ILE  27          2HD1      ILE  27  -1.017   4.025   3.613
  236   3HD1  ILE  27          3HD1      ILE  27  -1.512   5.736   3.590
  237    H    LYS  28           H        LYS  28  -1.532   7.312   6.619
  238    HA   LYS  28           HA       LYS  28  -3.411   8.330   8.613
  239   1HB   LYS  28          1HB       LYS  28  -2.582  10.515   8.070
  240   2HB   LYS  28          2HB       LYS  28  -1.216   9.459   8.368
  241   1HG   LYS  28          1HG       LYS  28  -1.722   9.175   5.600
  242   2HG   LYS  28          2HG       LYS  28  -1.960  10.885   5.909
  243   1HD   LYS  28          1HD       LYS  28   0.370  10.672   5.426
  244   2HD   LYS  28          2HD       LYS  28   0.288  10.850   7.168
  245   1HE   LYS  28          1HE       LYS  28   0.238   8.072   5.954
  246   2HE   LYS  28          2HE       LYS  28   1.766   8.919   6.100
  247   1HZ   LYS  28          1HZ       LYS  28   0.809   7.472   8.076
  248   2HZ   LYS  28          2HZ       LYS  28   1.679   8.813   8.383
  249    H    ASP  29           H        ASP  29  -5.111   6.997   7.446
  250    HA   ASP  29           HA       ASP  29  -5.807   7.989   4.858
  251   1HB   ASP  29          1HB       ASP  29  -6.562   5.841   4.829
  252   2HB   ASP  29          2HB       ASP  29  -6.493   5.717   6.576
  253    HD2  ASP  29           HD       ASP  29  -9.235   5.391   7.218
  254    HA   PRO  30           HA       PRO  30  -9.345   9.586   7.653
  255   1HB   PRO  30          1HB       PRO  30  -9.082   9.443  10.370
  256   2HB   PRO  30          2HB       PRO  30  -9.947   8.245   9.426
  257   1HG   PRO  30          1HG       PRO  30  -7.273   8.047  10.672
  258   2HG   PRO  30          2HG       PRO  30  -8.319   6.761  10.105
  259   1HD   PRO  30          1HD       PRO  30  -5.987   7.783   8.785
  260   2HD   PRO  30          2HD       PRO  30  -7.098   6.578   8.166
  261    H    ARG  31           H        ARG  31  -6.113  10.200   7.926
  262    HA   ARG  31           HA       ARG  31  -6.480  12.670   9.312
  263   1HB   ARG  31          1HB       ARG  31  -4.316  10.920   8.877
  264   2HB   ARG  31          2HB       ARG  31  -3.910  12.314   7.895
  265   1HG   ARG  31          1HG       ARG  31  -3.856  13.782   9.748
  266   2HG   ARG  31          2HG       ARG  31  -4.892  12.758  10.723
  267   1HD   ARG  31          1HD       ARG  31  -3.020  11.037  10.802
  268   2HD   ARG  31          2HD       ARG  31  -1.992  12.175   9.957
  269    HE   ARG  31           HE       ARG  31  -3.010  13.609  12.143
  270   1HH1  ARG  31          2HH2      ARG  31  -1.090  10.663  11.710
  271   2HH1  ARG  31          1HH2      ARG  31  -0.259  10.833  13.221
  272   1HH2  ARG  31          1HH       ARG  31  -0.761  12.706  14.630
  273    H    LEU  32           H        LEU  32  -5.799  11.472   5.976
  274    HA   LEU  32           HA       LEU  32  -5.493  14.067   4.872
  275   1HB   LEU  32          1HB       LEU  32  -6.019  11.371   3.618
  276   2HB   LEU  32          2HB       LEU  32  -5.687  12.835   2.714
  277    HG   LEU  32           HG       LEU  32  -3.773  11.688   4.759
  278   1HD1  LEU  32          1HD1      LEU  32  -3.232  10.066   3.347
  279   2HD1  LEU  32          2HD1      LEU  32  -4.436  10.648   2.172
  280   3HD1  LEU  32          3HD1      LEU  32  -2.778  11.292   2.138
  281   1HD2  LEU  32          1HD2      LEU  32  -2.712  13.293   2.552
  282   2HD2  LEU  32          2HD2      LEU  32  -3.840  14.187   3.601
  283   3HD2  LEU  32          3HD2      LEU  32  -2.408  13.394   4.302
  284    H    GLY  33           H        GLY  33  -8.213  11.999   5.723
  285   1HA   GLY  33          1HA       GLY  33 -10.386  12.735   5.924
  286   2HA   GLY  33          2HA       GLY  33 -10.034  14.123   4.914
  287    H    MET  34           H        MET  34  -8.961  10.897   3.900
  288    HA   MET  34           HA       MET  34 -11.283  10.645   2.194
  289   1HB   MET  34          1HB       MET  34  -8.368  10.830   1.270
  290   2HB   MET  34          2HB       MET  34  -9.619  10.137   0.256
  291   1HG   MET  34          1HG       MET  34  -9.646  12.368  -0.466
  292   2HG   MET  34          2HG       MET  34 -10.912  12.401   0.745
  293   1HE   MET  34          1HE       MET  34  -7.928  13.766  -0.623
  294   2HE   MET  34          2HE       MET  34  -7.089  14.709   0.632
  295   3HE   MET  34          3HE       MET  34  -6.834  12.951   0.521
  296    H    MET  35           H        MET  35 -11.330   8.446   1.072
  297    HA   MET  35           HA       MET  35 -10.151   6.520   2.901
  298   1HB   MET  35          1HB       MET  35 -12.751   6.832   2.029
  299   2HB   MET  35          2HB       MET  35 -12.170   5.695   0.829
  300   1HG   MET  35          1HG       MET  35 -11.746   4.004   2.426
  301   2HG   MET  35          2HG       MET  35 -11.578   5.145   3.745
  302   1HE   MET  35          1HE       MET  35 -14.736   4.386   5.454
  303   2HE   MET  35          2HE       MET  35 -13.215   3.494   5.199
  304   3HE   MET  35          3HE       MET  35 -13.182   5.255   5.467
  305    H    THR  36           H        THR  36  -8.023   6.425   1.966
  306    HA   THR  36           HA       THR  36  -7.379   6.235  -0.678
  307    HB   THR  36           HB       THR  36  -5.363   4.949   0.245
  308    HG1  THR  36           HG1      THR  36  -6.763   3.890   1.911
  309   1HG2  THR  36          1HG2      THR  36  -5.940   7.597   0.618
  310   2HG2  THR  36          2HG2      THR  36  -5.926   7.054   2.312
  311   3HG2  THR  36          3HG2      THR  36  -4.484   6.829   1.295
  312    H    THR  37           H        THR  37  -6.490   4.242  -1.855
  313    HA   THR  37           HA       THR  37  -8.106   1.871  -1.328
  314    HB   THR  37           HB       THR  37  -8.275   3.699  -3.750
  315    HG1  THR  37           HG1      THR  37 -10.138   1.973  -2.286
  316   1HG2  THR  37          1HG2      THR  37  -9.184   0.779  -3.674
  317   2HG2  THR  37          2HG2      THR  37  -9.318   1.914  -5.038
  318   3HG2  THR  37          3HG2      THR  37  -7.720   1.313  -4.534
  319    H    VAL  38           H        VAL  38  -7.388  -0.011  -2.679
  320    HA   VAL  38           HA       VAL  38  -4.562   0.296  -3.411
  321    HB   VAL  38           HB       VAL  38  -4.758  -0.685  -1.178
  322   1HG1  VAL  38          1HG1      VAL  38  -6.000  -2.564  -0.639
  323   2HG1  VAL  38          2HG1      VAL  38  -7.068  -1.759  -1.816
  324   3HG1  VAL  38          3HG1      VAL  38  -6.065  -3.139  -2.324
  325   1HG2  VAL  38          1HG2      VAL  38  -2.840  -1.566  -1.977
  326   2HG2  VAL  38          2HG2      VAL  38  -3.770  -3.084  -2.032
  327   3HG2  VAL  38          3HG2      VAL  38  -3.596  -2.094  -3.500
  328    H    SER  39           H        SER  39  -5.394   0.545  -5.614
  329    HA   SER  39           HA       SER  39  -6.755  -1.776  -6.648
  330   1HB   SER  39          1HB       SER  39  -6.770   0.992  -7.262
  331   2HB   SER  39          2HB       SER  39  -6.012   0.225  -8.644
  332    HG   SER  39           HG       SER  39  -7.869  -1.248  -8.736
  333    H    GLY  40           H        GLY  40  -3.957  -1.989  -5.674
  334   1HA   GLY  40          1HA       GLY  40  -2.843  -3.432  -7.832
  335   2HA   GLY  40          2HA       GLY  40  -2.055  -1.870  -7.706
  336    H    VAL  41           H        VAL  41  -1.421  -4.904  -6.969
  337    HA   VAL  41           HA       VAL  41   0.087  -4.175  -4.612
  338    HB   VAL  41           HB       VAL  41  -2.010  -4.932  -3.666
  339   1HG1  VAL  41          1HG1      VAL  41  -3.213  -6.360  -4.925
  340   2HG1  VAL  41          2HG1      VAL  41  -1.769  -7.020  -5.731
  341   3HG1  VAL  41          3HG1      VAL  41  -2.251  -7.630  -4.130
  342   1HG2  VAL  41          1HG2      VAL  41  -0.905  -7.251  -2.696
  343   2HG2  VAL  41          2HG2      VAL  41   0.527  -6.386  -3.301
  344   3HG2  VAL  41          3HG2      VAL  41  -0.539  -5.613  -2.103
  345    H    GLU  42           H        GLU  42   2.080  -5.163  -4.618
  346    HA   GLU  42           HA       GLU  42   2.363  -7.444  -6.395
  347   1HB   GLU  42          1HB       GLU  42   4.382  -5.167  -6.338
  348   2HB   GLU  42          2HB       GLU  42   4.349  -6.532  -7.436
  349   1HG   GLU  42          1HG       GLU  42   1.861  -5.527  -7.927
  350   2HG   GLU  42          2HG       GLU  42   2.666  -4.048  -7.440
  351    HE2  GLU  42           HE       GLU  42   2.395  -5.777 -10.510
  352    H    MET  43           H        MET  43   3.471  -9.108  -5.432
  353    HA   MET  43           HA       MET  43   5.224  -8.380  -3.224
  354   1HB   MET  43          1HB       MET  43   3.666 -10.956  -3.053
  355   2HB   MET  43          2HB       MET  43   4.165  -9.887  -1.758
  356   1HG   MET  43          1HG       MET  43   1.953  -9.225  -3.763
  357   2HG   MET  43          2HG       MET  43   1.665  -9.893  -2.168
  358   1HE   MET  43          1HE       MET  43   1.981  -7.106   0.232
  359   2HE   MET  43          2HE       MET  43   0.718  -8.145  -0.472
  360   3HE   MET  43          3HE       MET  43   2.285  -8.845   0.000
  361    H    SER  44           H        SER  44   7.238  -8.921  -3.978
  362    HA   SER  44           HA       SER  44   7.423 -11.474  -5.375
  363   1HB   SER  44          1HB       SER  44   8.378  -8.865  -6.076
  364   2HB   SER  44          2HB       SER  44   9.789  -9.838  -5.715
  365    HG   SER  44           HG       SER  44   9.080 -11.417  -7.254
  366    H    ARG  45           H        ARG  45   8.088 -13.014  -3.907
  367    HA   ARG  45           HA       ARG  45   9.987 -12.146  -1.897
  368   1HB   ARG  45          1HB       ARG  45   8.014 -14.439  -2.108
  369   2HB   ARG  45          2HB       ARG  45   9.388 -14.610  -1.036
  370   1HG   ARG  45          1HG       ARG  45   8.158 -13.495   0.517
  371   2HG   ARG  45          2HG       ARG  45   8.468 -12.047  -0.419
  372   1HD   ARG  45          1HD       ARG  45   6.014 -12.433   0.044
  373   2HD   ARG  45          2HD       ARG  45   6.384 -12.306  -1.664
  374    HE   ARG  45           HE       ARG  45   6.502 -15.064  -0.740
  375   1HH1  ARG  45          2HH2      ARG  45   4.277 -12.518  -1.797
  376   2HH1  ARG  45          1HH2      ARG  45   3.054 -13.630  -2.317
  377   1HH2  ARG  45          1HH       ARG  45   3.437 -15.984  -2.089
  378    H    ASP  46           H        ASP  46   9.943 -13.492  -4.967
  379    HA   ASP  46           HA       ASP  46  11.516 -15.718  -4.794
  380   1HB   ASP  46          1HB       ASP  46  10.361 -14.359  -6.821
  381   2HB   ASP  46          2HB       ASP  46  11.990 -13.745  -7.024
  382    HD2  ASP  46           HD       ASP  46  12.251 -15.741  -9.262
  383    H    LEU  47           H        LEU  47  12.221 -12.387  -4.097
  384    HA   LEU  47           HA       LEU  47  15.031 -13.051  -3.760
  385   1HB   LEU  47          1HB       LEU  47  14.053 -11.451  -5.911
  386   2HB   LEU  47          2HB       LEU  47  14.911 -10.404  -4.800
  387    HG   LEU  47           HG       LEU  47  16.581 -12.635  -5.075
  388   1HD1  LEU  47          1HD1      LEU  47  15.566 -11.815  -7.809
  389   2HD1  LEU  47          2HD1      LEU  47  16.868 -12.972  -7.446
  390   3HD1  LEU  47          3HD1      LEU  47  15.189 -13.352  -6.994
  391   1HD2  LEU  47          1HD2      LEU  47  17.442 -10.438  -4.813
  392   2HD2  LEU  47          2HD2      LEU  47  17.996 -11.020  -6.401
  393   3HD2  LEU  47          3HD2      LEU  47  16.641  -9.870  -6.298
  394    H    ALA  48           H        ALA  48  12.979 -10.057  -3.656
  395    HA   ALA  48           HA       ALA  48  12.291  -9.923  -1.097
  396   1HB   ALA  48          1HB       ALA  48  14.410  -8.490  -0.250
  397   2HB   ALA  48          2HB       ALA  48  14.285 -10.249  -0.007
  398   3HB   ALA  48          3HB       ALA  48  15.253  -9.604  -1.353
  399    H    TYR  49           H        TYR  49  11.053  -8.868  -3.084
  400    HA   TYR  49           HA       TYR  49  11.288  -6.033  -2.673
  401   1HB   TYR  49          1HB       TYR  49  11.622  -5.602  -5.112
  402   2HB   TYR  49          2HB       TYR  49  12.932  -6.611  -4.534
  403    HD1  TYR  49           HD1      TYR  49  13.114  -8.958  -5.210
  404    HD2  TYR  49           HD2      TYR  49   9.902  -6.502  -6.612
  405    HE1  TYR  49           HE1      TYR  49  12.573 -10.676  -7.005
  406    HE2  TYR  49           HE2      TYR  49   9.373  -8.228  -8.402
  407    HH   TYR  49           HH       TYR  49  10.090 -10.026  -9.432
  408    H    ALA  50           H        ALA  50   9.303  -5.032  -2.892
  409    HA   ALA  50           HA       ALA  50   7.220  -6.517  -4.306
  410   1HB   ALA  50          1HB       ALA  50   5.895  -5.491  -2.103
  411   2HB   ALA  50          2HB       ALA  50   6.404  -7.185  -2.304
  412   3HB   ALA  50          3HB       ALA  50   7.435  -6.047  -1.403
  413    H    LYS  51           H        LYS  51   5.163  -5.005  -4.425
  414    HA   LYS  51           HA       LYS  51   5.841  -2.201  -4.396
  415   1HB   LYS  51          1HB       LYS  51   4.784  -2.910  -7.029
  416   2HB   LYS  51          2HB       LYS  51   6.088  -1.826  -6.592
  417   1HG   LYS  51          1HG       LYS  51   7.637  -3.737  -6.315
  418   2HG   LYS  51          2HG       LYS  51   6.337  -4.872  -6.622
  419   1HD   LYS  51          1HD       LYS  51   6.856  -4.760  -8.826
  420   2HD   LYS  51          2HD       LYS  51   6.242  -3.119  -8.830
  421   1HE   LYS  51          1HE       LYS  51   8.331  -2.328  -9.217
  422   2HE   LYS  51          2HE       LYS  51   8.877  -3.008  -7.697
  423   1HZ   LYS  51          1HZ       LYS  51   9.235  -5.140  -8.878
  424   2HZ   LYS  51          2HZ       LYS  51   8.792  -4.457 -10.289
  425    H    VAL  52           H        VAL  52   4.173  -1.612  -3.083
  426    HA   VAL  52           HA       VAL  52   1.543  -2.741  -3.681
  427    HB   VAL  52           HB       VAL  52   2.542  -2.872  -1.387
  428   1HG1  VAL  52          1HG1      VAL  52   2.191   0.136  -1.527
  429   2HG1  VAL  52          2HG1      VAL  52   2.347  -0.765   0.000
  430   3HG1  VAL  52          3HG1      VAL  52   3.678  -0.782  -1.183
  431   1HG2  VAL  52          1HG2      VAL  52   0.012  -2.801  -2.052
  432   2HG2  VAL  52          2HG2      VAL  52   0.480  -2.669  -0.340
  433   3HG2  VAL  52          3HG2      VAL  52   0.039  -1.208  -1.257
  434    H    TYR  53           H        TYR  53  -0.136  -1.500  -4.456
  435    HA   TYR  53           HA       TYR  53   0.587   1.245  -5.167
  436   1HB   TYR  53          1HB       TYR  53  -0.641  -1.014  -6.431
  437   2HB   TYR  53          2HB       TYR  53  -1.974   0.076  -6.114
  438    HD1  TYR  53           HD1      TYR  53  -0.573  -0.874  -8.803
  439    HD2  TYR  53           HD2      TYR  53  -0.424   2.700  -6.457
  440    HE1  TYR  53           HE1      TYR  53   0.028   0.471 -10.877
  441    HE2  TYR  53           HE2      TYR  53   0.178   4.033  -8.536
  442    HH   TYR  53           HH       TYR  53   1.245   3.590 -10.709
  443    H    VAL  54           H        VAL  54  -0.661   3.027  -4.560
  444    HA   VAL  54           HA       VAL  54  -3.061   2.498  -3.001
  445    HB   VAL  54           HB       VAL  54  -2.192   4.191  -1.306
  446   1HG1  VAL  54          1HG1      VAL  54  -0.603   1.639  -1.186
  447   2HG1  VAL  54          2HG1      VAL  54  -1.484   2.491   0.106
  448   3HG1  VAL  54          3HG1      VAL  54  -2.381   1.585  -1.137
  449   1HG2  VAL  54          1HG2      VAL  54  -0.204   4.811  -2.797
  450   2HG2  VAL  54          2HG2      VAL  54   0.129   4.557  -1.067
  451   3HG2  VAL  54          3HG2      VAL  54   0.538   3.289  -2.245
  452    H    THR  55           H        THR  55  -4.644   3.763  -3.814
  453    HA   THR  55           HA       THR  55  -3.802   6.236  -5.173
  454    HB   THR  55           HB       THR  55  -4.842   4.958  -6.841
  455    HG1  THR  55           HG1      THR  55  -6.257   6.716  -6.744
  456   1HG2  THR  55          1HG2      THR  55  -7.051   3.661  -6.210
  457   2HG2  THR  55          2HG2      THR  55  -5.490   2.926  -5.774
  458   3HG2  THR  55          3HG2      THR  55  -6.448   3.779  -4.540
  459    H    PHE  56           H        PHE  56  -4.593   8.190  -4.564
  460    HA   PHE  56           HA       PHE  56  -6.623   8.121  -2.446
  461   1HB   PHE  56          1HB       PHE  56  -4.330  10.137  -2.739
  462   2HB   PHE  56          2HB       PHE  56  -5.324   9.874  -1.320
  463    HD1  PHE  56           HD1      PHE  56  -5.219   6.911  -1.111
  464    HD2  PHE  56           HD2      PHE  56  -2.165   9.726  -1.984
  465    HE1  PHE  56           HE1      PHE  56  -3.497   5.326  -0.200
  466    HE2  PHE  56           HE2      PHE  56  -0.444   8.143  -1.071
  467    HZ   PHE  56           HZ       PHE  56  -1.131   5.962  -0.190
  468    H    LEU  57           H        LEU  57  -7.700  10.354  -2.172
  469    HA   LEU  57           HA       LEU  57  -8.167  11.417  -4.862
  470   1HB   LEU  57          1HB       LEU  57 -10.033  10.334  -3.561
  471   2HB   LEU  57          2HB       LEU  57  -9.923  11.662  -2.420
  472    HG   LEU  57           HG       LEU  57 -10.163  13.026  -4.780
  473   1HD1  LEU  57          1HD1      LEU  57 -12.080  11.928  -5.977
  474   2HD1  LEU  57          2HD1      LEU  57 -10.505  11.126  -6.174
  475   3HD1  LEU  57          3HD1      LEU  57 -11.717  10.444  -5.063
  476   1HD2  LEU  57          1HD2      LEU  57 -11.379  13.498  -2.728
  477   2HD2  LEU  57          2HD2      LEU  57 -12.497  13.418  -4.110
  478   3HD2  LEU  57          3HD2      LEU  57 -12.393  12.054  -2.970
  479    H    ASN  58           H        ASN  58  -5.937  12.023  -2.787
  480    HA   ASN  58           HA       ASN  58  -6.397  14.477  -1.667
  481   1HB   ASN  58          1HB       ASN  58  -4.065  12.795  -2.352
  482   2HB   ASN  58          2HB       ASN  58  -3.678  14.502  -2.443
  483   1HD2  ASN  58          1HD2      ASN  58  -5.253  15.617  -0.539
  484   2HD2  ASN  58          2HD2      ASN  58  -4.820  15.062   1.044
  485    H    ASP  59           H        ASP  59  -5.747  13.472  -5.000
  486    HA   ASP  59           HA       ASP  59  -4.558  15.477  -6.201
  487   1HB   ASP  59          1HB       ASP  59  -5.382  13.764  -7.603
  488   2HB   ASP  59          2HB       ASP  59  -7.007  13.879  -6.957
  489    HD2  ASP  59           HD       ASP  59  -8.348  15.053  -9.015
  490    H    LYS  60           H        LYS  60  -7.949  15.446  -4.962
  491    HA   LYS  60           HA       LYS  60  -9.047  17.639  -6.030
  492   1HB   LYS  60          1HB       LYS  60  -9.247  16.259  -3.423
  493   2HB   LYS  60          2HB       LYS  60  -9.840  17.907  -3.427
  494   1HG   LYS  60          1HG       LYS  60 -10.876  16.908  -5.816
  495   2HG   LYS  60          2HG       LYS  60 -10.944  15.503  -4.770
  496   1HD   LYS  60          1HD       LYS  60 -11.944  18.192  -3.774
  497   2HD   LYS  60          2HD       LYS  60 -12.967  17.198  -4.793
  498   1HE   LYS  60          1HE       LYS  60 -12.240  15.285  -3.032
  499   2HE   LYS  60          2HE       LYS  60 -11.991  16.671  -1.989
  500   1HZ   LYS  60          1HZ       LYS  60 -14.274  15.851  -1.831
  501   2HZ   LYS  60          2HZ       LYS  60 -14.291  17.356  -2.454
  502    H    ASP  61           H        ASP  61  -6.551  17.572  -3.431
  503    HA   ASP  61           HA       ASP  61  -6.210  20.417  -3.959
  504   1HB   ASP  61          1HB       ASP  61  -5.351  19.384  -1.296
  505   2HB   ASP  61          2HB       ASP  61  -6.097  20.915  -1.705
  506    HD2  ASP  61           HD       ASP  61  -8.855  19.936  -2.473
  507    H    GLU  62           H        GLU  62  -4.169  20.724  -4.860
  508    HA   GLU  62           HA       GLU  62  -2.308  18.644  -4.920
  509   1HB   GLU  62          1HB       GLU  62  -2.685  20.695  -6.528
  510   2HB   GLU  62          2HB       GLU  62  -1.592  21.539  -5.450
  511   1HG   GLU  62          1HG       GLU  62   0.007  19.501  -5.760
  512   2HG   GLU  62          2HG       GLU  62  -1.025  19.047  -7.102
  513    HE2  GLU  62           HE       GLU  62   1.250  20.056  -8.587
  514    H    ASP  63           H        ASP  63  -3.041  21.086  -2.562
  515    HA   ASP  63           HA       ASP  63  -0.446  21.346  -1.514
  516   1HB   ASP  63          1HB       ASP  63  -2.910  22.592  -1.148
  517   2HB   ASP  63          2HB       ASP  63  -2.723  21.714   0.357
  518    HD2  ASP  63           HD       ASP  63  -1.626  23.394   1.905
  519    H    ALA  64           H        ALA  64  -3.386  19.364  -0.794
  520    HA   ALA  64           HA       ALA  64  -2.142  18.085   1.460
  521   1HB   ALA  64          1HB       ALA  64  -4.590  18.602   1.295
  522   2HB   ALA  64          2HB       ALA  64  -4.713  17.417  -0.028
  523   3HB   ALA  64          3HB       ALA  64  -4.251  16.883   1.606
  524    H    VAL  65           H        VAL  65  -2.210  17.723  -2.003
  525    HA   VAL  65           HA       VAL  65  -1.780  14.899  -2.007
  526    HB   VAL  65           HB       VAL  65  -2.571  16.802  -3.824
  527   1HG1  VAL  65          1HG1      VAL  65  -0.216  17.498  -4.165
  528   2HG1  VAL  65          2HG1      VAL  65   0.181  15.839  -4.677
  529   3HG1  VAL  65          3HG1      VAL  65  -0.951  16.822  -5.639
  530   1HG2  VAL  65          1HG2      VAL  65  -1.879  14.598  -5.385
  531   2HG2  VAL  65          2HG2      VAL  65  -2.089  13.925  -3.750
  532   3HG2  VAL  65          3HG2      VAL  65  -3.411  14.845  -4.511
  533    H    LYS  66           H        LYS  66   0.247  17.877  -2.246
  534    HA   LYS  66           HA       LYS  66   2.647  16.381  -2.585
  535   1HB   LYS  66          1HB       LYS  66   1.801  19.113  -2.744
  536   2HB   LYS  66          2HB       LYS  66   3.164  19.028  -1.647
  537   1HG   LYS  66          1HG       LYS  66   4.635  18.305  -3.291
  538   2HG   LYS  66          2HG       LYS  66   3.404  17.406  -4.157
  539   1HD   LYS  66          1HD       LYS  66   2.452  19.483  -5.072
  540   2HD   LYS  66          2HD       LYS  66   3.529  20.457  -4.092
  541   1HE   LYS  66          1HE       LYS  66   5.151  18.582  -5.572
  542   2HE   LYS  66          2HE       LYS  66   4.026  19.315  -6.698
  543   1HZ   LYS  66          1HZ       LYS  66   5.992  20.690  -6.497
  544   2HZ   LYS  66          2HZ       LYS  66   4.749  21.513  -5.841
  545    H    ALA  67           H        ALA  67   1.082  18.161   0.156
  546    HA   ALA  67           HA       ALA  67   3.103  17.486   2.001
  547   1HB   ALA  67          1HB       ALA  67   1.525  19.397   2.221
  548   2HB   ALA  67          2HB       ALA  67   0.189  18.244   2.457
  549   3HB   ALA  67          3HB       ALA  67   1.504  18.339   3.652
  550    H    GLY  68           H        GLY  68  -0.197  16.126   1.333
  551   1HA   GLY  68          1HA       GLY  68  -0.210  14.129   3.241
  552   2HA   GLY  68          2HA       GLY  68  -1.048  14.080   1.703
  553    H    ILE  69           H        ILE  69   0.668  13.755  -0.276
  554    HA   ILE  69           HA       ILE  69   1.560  11.155  -0.059
  555    HB   ILE  69           HB       ILE  69   1.054  12.630  -2.102
  556   1HG1  ILE  69          1HG1      ILE  69   3.436  10.759  -2.234
  557   2HG1  ILE  69          2HG1      ILE  69   1.772  10.225  -2.092
  558   1HG2  ILE  69          1HG2      ILE  69   2.620  14.007  -2.993
  559   2HG2  ILE  69          2HG2      ILE  69   3.094  14.161  -1.283
  560   3HG2  ILE  69          3HG2      ILE  69   3.985  13.057  -2.358
  561   1HD1  ILE  69          1HD1      ILE  69   1.833  12.149  -4.214
  562   2HD1  ILE  69          2HD1      ILE  69   3.202  11.040  -4.467
  563   3HD1  ILE  69          3HD1      ILE  69   1.547  10.396  -4.336
  564    H    LYS  70           H        LYS  70   3.187  14.250   0.672
  565    HA   LYS  70           HA       LYS  70   5.781  13.202   0.846
  566   1HB   LYS  70          1HB       LYS  70   5.635  15.518   0.619
  567   2HB   LYS  70          2HB       LYS  70   4.399  15.675   1.851
  568   1HG   LYS  70          1HG       LYS  70   6.004  15.167   3.628
  569   2HG   LYS  70          2HG       LYS  70   7.242  14.748   2.460
  570   1HD   LYS  70          1HD       LYS  70   7.746  16.949   1.990
  571   2HD   LYS  70          2HD       LYS  70   6.079  17.473   2.119
  572   1HE   LYS  70          1HE       LYS  70   6.181  17.488   4.553
  573   2HE   LYS  70          2HE       LYS  70   7.737  16.679   4.553
  574   1HZ   LYS  70          1HZ       LYS  70   7.925  19.022   2.990
  575   2HZ   LYS  70          2HZ       LYS  70   7.280  19.426   4.430
  576    H    ALA  71           H        ALA  71   3.004  13.295   3.083
  577    HA   ALA  71           HA       ALA  71   4.551  12.501   5.345
  578   1HB   ALA  71          1HB       ALA  71   2.520  13.776   5.656
  579   2HB   ALA  71          2HB       ALA  71   1.569  12.579   4.744
  580   3HB   ALA  71          3HB       ALA  71   2.253  12.150   6.330
  581    H    LEU  72           H        LEU  72   2.592  10.891   2.799
  582    HA   LEU  72           HA       LEU  72   2.745   8.340   4.052
  583   1HB   LEU  72          1HB       LEU  72   1.173   9.478   2.146
  584   2HB   LEU  72          2HB       LEU  72   2.240   8.505   1.153
  585    HG   LEU  72           HG       LEU  72   1.495   6.757   3.183
  586   1HD1  LEU  72          1HD1      LEU  72  -1.183   7.336   2.475
  587   2HD1  LEU  72          2HD1      LEU  72  -0.429   7.387   4.087
  588   3HD1  LEU  72          3HD1      LEU  72  -0.463   8.850   3.073
  589   1HD2  LEU  72          1HD2      LEU  72   0.384   7.125   0.390
  590   2HD2  LEU  72          2HD2      LEU  72   1.762   6.114   0.887
  591   3HD2  LEU  72          3HD2      LEU  72   0.114   5.689   1.406
  592    H    GLN  73           H        GLN  73   4.899  10.320   2.173
  593    HA   GLN  73           HA       GLN  73   6.347   8.108   1.115
  594   1HB   GLN  73          1HB       GLN  73   6.095  10.626   0.254
  595   2HB   GLN  73          2HB       GLN  73   7.493  10.893   1.276
  596   1HG   GLN  73          1HG       GLN  73   8.738   9.101   0.088
  597   2HG   GLN  73          2HG       GLN  73   7.332   8.751  -0.898
  598   1HE2  GLN  73          1HE2      GLN  73  10.195  10.378  -0.743
  599   2HE2  GLN  73          2HE2      GLN  73   9.968  11.570  -1.980
  600    H    GLU  74           H        GLU  74   6.745  10.526   3.773
  601    HA   GLU  74           HA       GLU  74   9.254   9.520   4.537
  602   1HB   GLU  74          1HB       GLU  74   9.070  11.032   6.416
  603   2HB   GLU  74          2HB       GLU  74   8.391  11.841   5.017
  604   1HG   GLU  74          1HG       GLU  74   6.095  11.221   5.745
  605   2HG   GLU  74          2HG       GLU  74   6.748  10.344   7.115
  606    HE2  GLU  74           HE       GLU  74   5.865  11.693   8.612
  607    H    ALA  75           H        ALA  75   5.887   8.683   5.253
  608    HA   ALA  75           HA       ALA  75   6.672   7.035   7.510
  609   1HB   ALA  75          1HB       ALA  75   4.046   7.812   6.206
  610   2HB   ALA  75          2HB       ALA  75   4.143   6.559   7.467
  611   3HB   ALA  75          3HB       ALA  75   4.643   8.227   7.831
  612    H    SER  76           H        SER  76   7.068   6.771   4.269
  613    HA   SER  76           HA       SER  76   5.824   4.457   3.529
  614   1HB   SER  76          1HB       SER  76   7.014   5.848   1.926
  615   2HB   SER  76          2HB       SER  76   8.541   5.594   2.748
  616    HG   SER  76           HG       SER  76   7.308   3.197   2.014
  617    H    GLY  77           H        GLY  77   9.330   4.702   4.496
  618   1HA   GLY  77          1HA       GLY  77   9.828   2.021   4.825
  619   2HA   GLY  77          2HA       GLY  77  10.645   3.313   5.681
  620    H    PHE  78           H        PHE  78   7.838   4.150   6.801
  621    HA   PHE  78           HA       PHE  78   8.101   2.640   9.196
  622   1HB   PHE  78          1HB       PHE  78   6.828   5.047   8.130
  623   2HB   PHE  78          2HB       PHE  78   5.608   4.116   8.977
  624    HD1  PHE  78           HD1      PHE  78   7.870   6.668   9.378
  625    HD2  PHE  78           HD2      PHE  78   6.580   3.131  11.336
  626    HE1  PHE  78           HE1      PHE  78   8.692   7.581  11.566
  627    HE2  PHE  78           HE2      PHE  78   7.401   4.045  13.526
  628    HZ   PHE  78           HZ       PHE  78   8.447   6.259  13.614
  629    H    ILE  79           H        ILE  79   5.759   2.770   6.457
  630    HA   ILE  79           HA       ILE  79   3.956   0.946   7.666
  631    HB   ILE  79           HB       ILE  79   2.672   1.244   5.819
  632   1HG1  ILE  79          1HG1      ILE  79   5.244   1.196   4.275
  633   2HG1  ILE  79          2HG1      ILE  79   3.817   0.195   4.098
  634   1HG2  ILE  79          1HG2      ILE  79   3.852   3.487   6.796
  635   2HG2  ILE  79          2HG2      ILE  79   4.222   3.640   5.061
  636   3HG2  ILE  79          3HG2      ILE  79   2.533   3.477   5.600
  637   1HD1  ILE  79          1HD1      ILE  79   4.355   2.947   3.037
  638   2HD1  ILE  79          2HD1      ILE  79   3.477   1.591   2.288
  639   3HD1  ILE  79          3HD1      ILE  79   2.683   2.586   3.532
  640    H    ARG  80           H        ARG  80   6.755   0.694   5.434
  641    HA   ARG  80           HA       ARG  80   6.316  -1.964   4.776
  642   1HB   ARG  80          1HB       ARG  80   7.838  -0.706   3.407
  643   2HB   ARG  80          2HB       ARG  80   8.772  -0.165   4.787
  644   1HG   ARG  80          1HG       ARG  80   9.536  -2.522   5.186
  645   2HG   ARG  80          2HG       ARG  80   8.618  -3.049   3.788
  646   1HD   ARG  80          1HD       ARG  80  10.693  -2.739   2.779
  647   2HD   ARG  80          2HD       ARG  80  10.022  -1.138   2.540
  648    HE   ARG  80           HE       ARG  80  11.680  -0.309   3.949
  649   1HH1  ARG  80          2HH2      ARG  80  11.139  -3.710   4.779
  650   2HH1  ARG  80          1HH2      ARG  80  12.396  -3.749   5.970
  651   1HH2  ARG  80          1HH       ARG  80  13.675  -1.766   6.389
  652    H    SER  81           H        SER  81   8.304  -0.357   7.344
  653    HA   SER  81           HA       SER  81   9.315  -2.794   8.318
  654   1HB   SER  81          1HB       SER  81  10.433  -0.573   8.615
  655   2HB   SER  81          2HB       SER  81   9.133  -0.068   9.676
  656    HG   SER  81           HG       SER  81  11.360  -1.522  10.284
  657    H    LEU  82           H        LEU  82   6.485  -0.720   9.011
  658    HA   LEU  82           HA       LEU  82   5.794  -1.927  11.456
  659   1HB   LEU  82          1HB       LEU  82   5.023   0.270  10.798
  660   2HB   LEU  82          2HB       LEU  82   4.165  -0.398   9.424
  661    HG   LEU  82           HG       LEU  82   3.374  -1.572  12.011
  662   1HD1  LEU  82          1HD1      LEU  82   3.529   0.449  13.070
  663   2HD1  LEU  82          2HD1      LEU  82   3.286   1.385  11.575
  664   3HD1  LEU  82          3HD1      LEU  82   1.901   0.592  12.365
  665   1HD2  LEU  82          1HD2      LEU  82   2.237  -0.948   9.399
  666   2HD2  LEU  82          2HD2      LEU  82   1.760  -2.174  10.599
  667   3HD2  LEU  82          3HD2      LEU  82   1.151  -0.507  10.740
  668    H    LEU  83           H        LEU  83   5.262  -2.756   8.036
  669    HA   LEU  83           HA       LEU  83   3.240  -4.675   8.577
  670   1HB   LEU  83          1HB       LEU  83   5.017  -4.157   6.193
  671   2HB   LEU  83          2HB       LEU  83   3.778  -5.396   6.225
  672    HG   LEU  83           HG       LEU  83   2.907  -2.647   6.955
  673   1HD1  LEU  83          1HD1      LEU  83   3.380  -1.591   5.053
  674   2HD1  LEU  83          2HD1      LEU  83   4.532  -2.907   4.721
  675   3HD1  LEU  83          3HD1      LEU  83   2.881  -2.983   4.061
  676   1HD2  LEU  83          1HD2      LEU  83   1.271  -4.398   6.941
  677   2HD2  LEU  83          2HD2      LEU  83   0.953  -3.322   5.560
  678   3HD2  LEU  83          3HD2      LEU  83   1.741  -4.896   5.299
  679    H    GLY  84           H        GLY  84   6.712  -5.030   7.545
  680   1HA   GLY  84          1HA       GLY  84   7.018  -7.707   7.786
  681   2HA   GLY  84          2HA       GLY  84   8.263  -6.541   8.191
  682    H    LYS  85           H        LYS  85   7.105  -5.273  10.471
  683    HA   LYS  85           HA       LYS  85   7.653  -7.291  12.420
  684   1HB   LYS  85          1HB       LYS  85   7.277  -4.339  12.370
  685   2HB   LYS  85          2HB       LYS  85   6.903  -5.147  13.879
  686   1HG   LYS  85          1HG       LYS  85   9.116  -6.062  14.073
  687   2HG   LYS  85          2HG       LYS  85   9.493  -5.731  12.394
  688   1HD   LYS  85          1HD       LYS  85  10.625  -4.034  13.663
  689   2HD   LYS  85          2HD       LYS  85   9.250  -3.238  12.925
  690   1HE   LYS  85          1HE       LYS  85   8.793  -2.503  15.044
  691   2HE   LYS  85          2HE       LYS  85   8.123  -4.104  15.291
  692   1HZ   LYS  85          1HZ       LYS  85  10.906  -3.284  15.928
  693   2HZ   LYS  85          2HZ       LYS  85   9.738  -3.631  17.008
  694    H    ALA  86           H        ALA  86   4.781  -5.521  11.187
  695    HA   ALA  86           HA       ALA  86   3.000  -6.403  13.154
  696   1HB   ALA  86          1HB       ALA  86   2.389  -4.559  11.775
  697   2HB   ALA  86          2HB       ALA  86   2.701  -5.472  10.279
  698   3HB   ALA  86          3HB       ALA  86   1.301  -5.885  11.298
  699    H    MET  87           H        MET  87   4.404  -7.940  10.279
  700    HA   MET  87           HA       MET  87   2.658 -10.222  10.788
  701   1HB   MET  87          1HB       MET  87   4.286  -9.808   8.245
  702   2HB   MET  87          2HB       MET  87   2.822 -10.749   8.449
  703   1HG   MET  87          1HG       MET  87   1.860  -8.285   9.143
  704   2HG   MET  87          2HG       MET  87   3.141  -7.792   8.053
  705   1HE   MET  87          1HE       MET  87   1.490  -7.981   4.795
  706   2HE   MET  87          2HE       MET  87   1.963  -6.877   6.108
  707   3HE   MET  87          3HE       MET  87   3.119  -8.090   5.506
  708    H    ARG  88           H        ARG  88   5.434  -9.237  11.923
  709    HA   ARG  88           HA       ARG  88   7.540 -10.025  12.021
  710   1HB   ARG  88          1HB       ARG  88   5.633 -12.059  13.240
  711   2HB   ARG  88          2HB       ARG  88   7.365 -12.279  13.392
  712   1HG   ARG  88          1HG       ARG  88   7.558  -9.996  14.418
  713   2HG   ARG  88          2HG       ARG  88   5.822  -9.796  14.282
  714   1HD   ARG  88          1HD       ARG  88   6.476 -12.334  15.606
  715   2HD   ARG  88          2HD       ARG  88   7.227 -10.985  16.436
  716    HE   ARG  88           HE       ARG  88   4.403 -11.593  16.376
  717   1HH1  ARG  88          2HH2      ARG  88   6.652  -8.856  16.439
  718   2HH1  ARG  88          1HH2      ARG  88   5.520  -7.783  17.193
  719   1HH2  ARG  88          1HH       ARG  88   3.325  -8.582  17.732
  720    H    LEU  89           H        LEU  89   7.867 -10.335   9.605
  721    HA   LEU  89           HA       LEU  89   7.954 -13.196   8.939
  722   1HB   LEU  89          1HB       LEU  89   6.657 -11.109   7.622
  723   2HB   LEU  89          2HB       LEU  89   8.114 -11.375   6.683
  724    HG   LEU  89           HG       LEU  89   6.091 -13.517   7.400
  725   1HD1  LEU  89          1HD1      LEU  89   6.531 -12.046   4.785
  726   2HD1  LEU  89          2HD1      LEU  89   5.435 -13.427   5.035
  727   3HD1  LEU  89          3HD1      LEU  89   5.129 -11.885   5.870
  728   1HD2  LEU  89          1HD2      LEU  89   7.289 -14.966   5.900
  729   2HD2  LEU  89          2HD2      LEU  89   8.421 -13.661   5.468
  730   3HD2  LEU  89          3HD2      LEU  89   8.423 -14.332   7.117
  731    H    ARG  90           H        ARG  90   9.610 -12.575   6.539
  732    HA   ARG  90           HA       ARG  90  12.005 -11.559   7.788
  733   1HB   ARG  90          1HB       ARG  90  13.241 -13.596   6.667
  734   2HB   ARG  90          2HB       ARG  90  12.435 -13.848   8.202
  735   1HG   ARG  90          1HG       ARG  90  10.386 -14.648   6.932
  736   2HG   ARG  90          2HG       ARG  90  11.303 -14.514   5.445
  737   1HD   ARG  90          1HD       ARG  90  12.349 -16.164   7.777
  738   2HD   ARG  90          2HD       ARG  90  11.209 -16.846   6.634
  739    HE   ARG  90           HE       ARG  90  13.091 -15.826   4.944
  740   1HH1  ARG  90          2HH2      ARG  90  13.425 -17.816   7.855
  741   2HH1  ARG  90          1HH2      ARG  90  14.884 -18.579   7.317
  742   1HH2  ARG  90          1HH       ARG  90  15.801 -17.984   5.184
  743    H    ILE  91           H        ILE  91  10.334 -12.871   4.865
  744    HA   ILE  91           HA       ILE  91  11.985 -12.299   2.860
  745    HB   ILE  91           HB       ILE  91   9.874 -11.567   1.600
  746   1HG1  ILE  91          1HG1      ILE  91   8.161 -12.685   3.693
  747   2HG1  ILE  91          2HG1      ILE  91   8.893 -11.166   4.170
  748   1HG2  ILE  91          1HG2      ILE  91  10.072 -13.712   1.061
  749   2HG2  ILE  91          2HG2      ILE  91  10.733 -14.120   2.661
  750   3HG2  ILE  91          3HG2      ILE  91   8.971 -14.087   2.409
  751   1HD1  ILE  91          1HD1      ILE  91   7.950 -11.090   1.383
  752   2HD1  ILE  91          2HD1      ILE  91   6.643 -11.463   2.532
  753   3HD1  ILE  91          3HD1      ILE  91   7.602  -9.976   2.725
  754    H    VAL  92           H        VAL  92  10.204  -9.904   4.851
  755    HA   VAL  92           HA       VAL  92  10.080  -7.637   4.477
  756    HB   VAL  92           HB       VAL  92  12.966  -8.222   5.172
  757   1HG1  VAL  92          1HG1      VAL  92  11.299  -5.733   5.237
  758   2HG1  VAL  92          2HG1      VAL  92  12.478  -6.002   6.543
  759   3HG1  VAL  92          3HG1      VAL  92  13.024  -5.948   4.850
  760   1HG2  VAL  92          1HG2      VAL  92  10.433  -8.163   6.819
  761   2HG2  VAL  92          2HG2      VAL  92  11.685  -9.426   6.732
  762   3HG2  VAL  92          3HG2      VAL  92  12.032  -7.883   7.549
  763    HA   PRO  93           HA       PRO  93  11.973  -7.553   0.315
  764   1HB   PRO  93          1HB       PRO  93   9.699  -7.519  -1.198
  765   2HB   PRO  93          2HB       PRO  93  10.605  -8.980  -0.864
  766   1HG   PRO  93          1HG       PRO  93   8.037  -8.084   0.296
  767   2HG   PRO  93          2HG       PRO  93   8.735  -9.692   0.285
  768   1HD   PRO  93          1HD       PRO  93   8.663  -7.866   2.496
  769   2HD   PRO  93          2HD       PRO  93   9.462  -9.424   2.450
  770    H    GLU  94           H        GLU  94  12.248  -5.793  -1.136
  771    HA   GLU  94           HA       GLU  94  11.698  -3.390   0.174
  772   1HB   GLU  94          1HB       GLU  94  13.311  -4.279  -1.985
  773   2HB   GLU  94          2HB       GLU  94  12.273  -3.040  -2.667
  774   1HG   GLU  94          1HG       GLU  94  12.997  -1.399  -1.038
  775   2HG   GLU  94          2HG       GLU  94  13.775  -2.617  -0.049
  776    HE2  GLU  94           HE       GLU  94  16.408  -2.005  -0.793
  777    H    LEU  95           H        LEU  95   9.276  -3.850   0.427
  778    HA   LEU  95           HA       LEU  95   7.645  -3.697  -1.888
  779   1HB   LEU  95          1HB       LEU  95   5.818  -3.452  -0.243
  780   2HB   LEU  95          2HB       LEU  95   6.832  -4.860   0.000
  781    HG   LEU  95           HG       LEU  95   7.964  -2.840   1.609
  782   1HD1  LEU  95          1HD1      LEU  95   5.061  -2.993   2.346
  783   2HD1  LEU  95          2HD1      LEU  95   6.296  -1.797   2.806
  784   3HD1  LEU  95          3HD1      LEU  95   5.612  -1.782   1.163
  785   1HD2  LEU  95          1HD2      LEU  95   6.967  -4.320   3.464
  786   2HD2  LEU  95          2HD2      LEU  95   6.356  -5.332   2.134
  787   3HD2  LEU  95          3HD2      LEU  95   8.106  -5.060   2.312
  788    H    THR  96           H        THR  96   8.097  -1.887  -3.143
  789    HA   THR  96           HA       THR  96   8.481   0.680  -2.015
  790    HB   THR  96           HB       THR  96   9.276  -0.258  -4.286
  791    HG1  THR  96           HG1      THR  96   8.734   1.942  -5.225
  792   1HG2  THR  96          1HG2      THR  96   7.148   0.788  -5.851
  793   2HG2  THR  96          2HG2      THR  96   7.657  -0.916  -5.761
  794   3HG2  THR  96          3HG2      THR  96   6.369  -0.314  -4.690
  795    H    PHE  97           H        PHE  97   7.097   2.600  -2.421
  796    HA   PHE  97           HA       PHE  97   4.296   1.823  -2.020
  797   1HB   PHE  97          1HB       PHE  97   6.012   3.238  -0.388
  798   2HB   PHE  97          2HB       PHE  97   5.421   4.560  -1.375
  799    HD1  PHE  97           HD1      PHE  97   2.681   2.698  -1.554
  800    HD2  PHE  97           HD2      PHE  97   4.947   4.646   1.459
  801    HE1  PHE  97           HE1      PHE  97   0.631   2.858  -0.113
  802    HE2  PHE  97           HE2      PHE  97   2.899   4.805   2.898
  803    HZ   PHE  97           HZ       PHE  97   0.764   3.908   2.097
  804    H    PHE  98           H        PHE  98   3.313   1.943  -4.014
  805    HA   PHE  98           HA       PHE  98   4.024   4.163  -5.748
  806   1HB   PHE  98          1HB       PHE  98   3.154   1.417  -5.967
  807   2HB   PHE  98          2HB       PHE  98   1.849   2.386  -6.620
  808    HD1  PHE  98           HD1      PHE  98   2.698   4.318  -8.281
  809    HD2  PHE  98           HD2      PHE  98   4.785   0.722  -7.435
  810    HE1  PHE  98           HE1      PHE  98   3.938   4.527 -10.454
  811    HE2  PHE  98           HE2      PHE  98   6.025   0.930  -9.608
  812    HZ   PHE  98           HZ       PHE  98   5.586   2.830 -11.091
  813    H    TYR  99           H        TYR  99   2.967   6.066  -5.431
  814    HA   TYR  99           HA       TYR  99   0.244   5.954  -4.378
  815   1HB   TYR  99          1HB       TYR  99   1.827   8.469  -5.018
  816   2HB   TYR  99          2HB       TYR  99   0.782   8.171  -3.644
  817    HD1  TYR  99           HD1      TYR  99   4.179   8.044  -4.908
  818    HD2  TYR  99           HD2      TYR  99   1.619   6.761  -1.728
  819    HE1  TYR  99           HE1      TYR  99   6.209   7.551  -3.462
  820    HE2  TYR  99           HE2      TYR  99   3.658   6.271  -0.293
  821    HH   TYR  99           HH       TYR  99   6.931   6.899  -1.537
  822    H    ASP 100           H        ASP 100  -1.315   5.761  -5.922
  823    HA   ASP 100           HA       ASP 100  -0.879   7.297  -8.358
  824   1HB   ASP 100          1HB       ASP 100  -1.642   4.591  -7.940
  825   2HB   ASP 100          2HB       ASP 100  -3.112   5.397  -8.448
  826    HD2  ASP 100           HD       ASP 100   0.249   5.748  -9.660
  827    H    ASN 101           H        ASN 101  -1.774   9.290  -7.437
  828    HA   ASN 101           HA       ASN 101  -4.420   9.123  -6.331
  829   1HB   ASN 101          1HB       ASN 101  -3.079  11.766  -6.898
  830   2HB   ASN 101          2HB       ASN 101  -4.031  11.293  -5.506
  831   1HD2  ASN 101          1HD2      ASN 101  -3.006   9.257  -4.364
  832   2HD2  ASN 101          2HD2      ASN 101  -1.334   9.421  -3.942
  833    H    SER 102           H        SER 102  -5.544  11.577  -7.200
  834    HA   SER 102           HA       SER 102  -6.102  10.905  -9.941
  835   1HB   SER 102          1HB       SER 102  -7.541  13.237  -8.965
  836   2HB   SER 102          2HB       SER 102  -8.173  11.683  -9.470
  837    HG   SER 102           HG       SER 102  -8.678  11.510  -7.383
  838    H    LEU 103           H        LEU 103  -3.622  12.463  -8.638
  839    HA   LEU 103           HA       LEU 103  -3.828  14.921 -10.182
  840   1HB   LEU 103          1HB       LEU 103  -3.072  14.985  -7.842
  841   2HB   LEU 103          2HB       LEU 103  -1.715  13.955  -8.250
  842    HG   LEU 103           HG       LEU 103  -1.494  16.067 -10.053
  843   1HD1  LEU 103          1HD1      LEU 103  -2.166  17.210  -7.329
  844   2HD1  LEU 103          2HD1      LEU 103  -1.647  18.106  -8.777
  845   3HD1  LEU 103          3HD1      LEU 103  -3.226  17.284  -8.758
  846   1HD2  LEU 103          1HD2      LEU 103   0.540  15.504  -9.304
  847   2HD2  LEU 103          2HD2      LEU 103   0.252  16.740  -8.057
  848   3HD2  LEU 103          3HD2      LEU 103  -0.069  15.025  -7.701
  849    H    VAL 104           H        VAL 104  -3.191  11.767 -10.858
  850    HA   VAL 104           HA       VAL 104  -1.289  12.546 -12.944
  851    HB   VAL 104           HB       VAL 104  -0.951  10.576 -10.786
  852   1HG1  VAL 104          1HG1      VAL 104  -1.445   9.014 -12.595
  853   2HG1  VAL 104          2HG1      VAL 104  -0.259   9.824 -13.647
  854   3HG1  VAL 104          3HG1      VAL 104   0.287   8.960 -12.189
  855   1HG2  VAL 104          1HG2      VAL 104   1.451  11.023 -12.188
  856   2HG2  VAL 104          2HG2      VAL 104   0.572  12.569 -12.226
  857   3HG2  VAL 104          3HG2      VAL 104   0.922  11.782 -10.668
  858    H    GLU 105           H        GLU 105  -4.349  11.655 -12.227
  859    HA   GLU 105           HA       GLU 105  -4.625  10.391 -14.793
  860   1HB   GLU 105          1HB       GLU 105  -5.493   9.065 -12.193
  861   2HB   GLU 105          2HB       GLU 105  -6.176   8.622 -13.746
  862   1HG   GLU 105          1HG       GLU 105  -3.542   8.483 -14.406
  863   2HG   GLU 105          2HG       GLU 105  -3.399   8.164 -12.688
  864    HE2  GLU 105           HE       GLU 105  -3.722   4.989 -13.933
  865    H    GLY 106           H        GLY 106  -6.080  11.736 -11.793
  866   1HA   GLY 106          1HA       GLY 106  -7.671  13.386 -11.695
  867   2HA   GLY 106          2HA       GLY 106  -8.010  13.191 -13.404
  868    H    MET 107           H        MET 107  -8.034  10.072 -12.702
  869    HA   MET 107           HA       MET 107 -10.760  10.132 -11.659
  870   1HB   MET 107          1HB       MET 107 -11.397   8.502 -13.285
  871   2HB   MET 107          2HB       MET 107 -10.329   9.553 -14.194
  872   1HG   MET 107          1HG       MET 107  -8.544   7.716 -13.072
  873   2HG   MET 107          2HG       MET 107  -9.951   6.722 -13.400
  874   1HE   MET 107          1HE       MET 107  -7.999   9.609 -16.245
  875   2HE   MET 107          2HE       MET 107  -7.781   9.439 -14.486
  876   3HE   MET 107          3HE       MET 107  -6.806   8.454 -15.602
  877    H    ARG 108           H        ARG 108  -8.279   9.853 -10.111
  878    HA   ARG 108           HA       ARG 108  -8.521   7.048  -9.372
  879   1HB   ARG 108          1HB       ARG 108  -6.212   8.811  -9.743
  880   2HB   ARG 108          2HB       ARG 108  -6.219   8.173  -8.112
  881   1HG   ARG 108          1HG       ARG 108  -5.157   6.392  -9.115
  882   2HG   ARG 108          2HG       ARG 108  -6.800   5.878  -9.437
  883   1HD   ARG 108          1HD       ARG 108  -6.610   7.253 -11.650
  884   2HD   ARG 108          2HD       ARG 108  -4.887   7.297 -11.335
  885    HE   ARG 108           HE       ARG 108  -4.740   5.020 -11.884
  886   1HH1  ARG 108          2HH2      ARG 108  -8.141   5.867 -11.363
  887   2HH1  ARG 108          1HH2      ARG 108  -8.736   4.346 -11.936
  888   1HH2  ARG 108          1HH       ARG 108  -7.182   2.682 -12.681
  Start of MODEL   11
    1    H    MET   1           H        MET   1 -13.691  -9.054  -0.727
    2    HA   MET   1           HA       MET   1 -12.155  -9.104  -2.452
    3   1HB   MET   1          1HB       MET   1 -11.208  -7.572   0.013
    4   2HB   MET   1          2HB       MET   1 -10.306  -7.457  -1.487
    5   1HG   MET   1          1HG       MET   1 -11.853  -6.065  -2.425
    6   2HG   MET   1          2HG       MET   1 -13.182  -7.113  -1.969
    7   1HE   MET   1          1HE       MET   1 -11.483  -3.560   0.355
    8   2HE   MET   1          2HE       MET   1 -10.466  -4.771  -0.462
    9   3HE   MET   1          3HE       MET   1 -11.565  -3.744  -1.413
   10    H    ALA   2           H        ALA   2 -11.789 -11.650  -1.192
   11    HA   ALA   2           HA       ALA   2  -8.856 -11.831  -1.290
   12   1HB   ALA   2          1HB       ALA   2  -8.815 -13.215   0.559
   13   2HB   ALA   2          2HB       ALA   2 -10.194 -12.177   0.993
   14   3HB   ALA   2          3HB       ALA   2 -10.480 -13.792   0.302
   15    H    LYS   3           H        LYS   3  -8.330 -14.375  -1.643
   16    HA   LYS   3           HA       LYS   3 -10.251 -15.542  -3.475
   17   1HB   LYS   3          1HB       LYS   3  -8.613 -13.913  -4.695
   18   2HB   LYS   3          2HB       LYS   3  -7.425 -15.177  -4.451
   19   1HG   LYS   3          1HG       LYS   3  -8.961 -16.823  -5.564
   20   2HG   LYS   3          2HG       LYS   3 -10.128 -15.543  -5.829
   21   1HD   LYS   3          1HD       LYS   3  -8.957 -14.664  -7.592
   22   2HD   LYS   3          2HD       LYS   3  -7.412 -14.845  -6.785
   23   1HE   LYS   3          1HE       LYS   3  -7.027 -16.944  -7.679
   24   2HE   LYS   3          2HE       LYS   3  -8.715 -17.407  -7.603
   25   1HZ   LYS   3          1HZ       LYS   3  -9.124 -15.941  -9.533
   26   2HZ   LYS   3          2HZ       LYS   3  -7.540 -15.568  -9.619
   27    H    GLU   4           H        GLU   4 -10.499 -17.147  -1.843
   28    HA   GLU   4           HA       GLU   4  -8.277 -18.426  -0.728
   29   1HB   GLU   4          1HB       GLU   4  -9.975 -20.105   0.057
   30   2HB   GLU   4          2HB       GLU   4 -10.414 -18.447   0.425
   31   1HG   GLU   4          1HG       GLU   4 -11.511 -18.859  -2.132
   32   2HG   GLU   4          2HG       GLU   4 -11.767 -20.397  -1.330
   33    HE2  GLU   4           HE       GLU   4 -13.724 -20.351  -0.409
   34    H    PHE   5           H        PHE   5  -6.884 -19.015  -2.503
   35    HA   PHE   5           HA       PHE   5  -7.742 -21.490  -3.766
   36   1HB   PHE   5          1HB       PHE   5  -8.109 -19.311  -5.211
   37   2HB   PHE   5          2HB       PHE   5  -6.360 -19.190  -5.256
   38    HD1  PHE   5           HD1      PHE   5  -7.450 -19.269  -7.787
   39    HD2  PHE   5           HD2      PHE   5  -6.853 -22.571  -5.189
   40    HE1  PHE   5           HE1      PHE   5  -7.393 -20.815  -9.765
   41    HE2  PHE   5           HE2      PHE   5  -6.798 -24.117  -7.167
   42    HZ   PHE   5           HZ       PHE   5  -7.069 -23.220  -9.429
   43    H    GLY   6           H        GLY   6  -6.180 -22.999  -3.442
   44   1HA   GLY   6          1HA       GLY   6  -3.893 -22.760  -2.088
   45   2HA   GLY   6          2HA       GLY   6  -4.095 -23.901  -3.403
   46    H    ARG   7           H        ARG   7  -4.459 -21.623  -5.412
   47    HA   ARG   7           HA       ARG   7  -1.864 -21.532  -6.274
   48   1HB   ARG   7          1HB       ARG   7  -4.437 -20.482  -7.089
   49   2HB   ARG   7          2HB       ARG   7  -3.255 -19.197  -7.253
   50   1HG   ARG   7          1HG       ARG   7  -1.812 -21.235  -8.339
   51   2HG   ARG   7          2HG       ARG   7  -3.423 -21.824  -8.698
   52   1HD   ARG   7          1HD       ARG   7  -3.744 -20.257 -10.327
   53   2HD   ARG   7          2HD       ARG   7  -3.186 -18.954  -9.297
   54    HE   ARG   7           HE       ARG   7  -1.064 -19.125 -10.268
   55   1HH1  ARG   7          2HH2      ARG   7  -2.869 -22.096 -10.956
   56   2HH1  ARG   7          1HH2      ARG   7  -1.665 -22.726 -12.028
   57   1HH2  ARG   7          1HH       ARG   7   0.322 -21.452 -12.443
   58    HA   PRO   8           HA       PRO   8  -0.146 -17.957  -4.424
   59   1HB   PRO   8          1HB       PRO   8   0.854 -16.386  -6.424
   60   2HB   PRO   8          2HB       PRO   8   1.656 -17.835  -5.853
   61   1HG   PRO   8          1HG       PRO   8   0.127 -17.424  -8.351
   62   2HG   PRO   8          2HG       PRO   8   1.272 -18.691  -7.961
   63   1HD   PRO   8          1HD       PRO   8  -1.587 -18.914  -8.004
   64   2HD   PRO   8          2HD       PRO   8  -0.447 -20.147  -7.503
   65    H    GLN   9           H        GLN   9  -2.986 -17.699  -5.872
   66    HA   GLN   9           HA       GLN   9  -3.202 -14.869  -5.842
   67   1HB   GLN   9          1HB       GLN   9  -4.699 -17.064  -6.871
   68   2HB   GLN   9          2HB       GLN   9  -5.768 -16.236  -5.757
   69   1HG   GLN   9          1HG       GLN   9  -5.928 -15.300  -8.065
   70   2HG   GLN   9          2HG       GLN   9  -5.403 -14.093  -6.908
   71   1HE2  GLN   9          1HE2      GLN   9  -3.459 -13.152  -7.081
   72   2HE2  GLN   9          2HE2      GLN   9  -2.301 -13.462  -8.333
   73    H    ARG  10           H        ARG  10  -3.977 -17.597  -3.651
   74    HA   ARG  10           HA       ARG  10  -5.609 -16.242  -1.921
   75   1HB   ARG  10          1HB       ARG  10  -5.077 -18.748  -1.972
   76   2HB   ARG  10          2HB       ARG  10  -3.566 -18.389  -1.160
   77   1HG   ARG  10          1HG       ARG  10  -6.182 -17.397   0.014
   78   2HG   ARG  10          2HG       ARG  10  -5.689 -19.060   0.267
   79   1HD   ARG  10          1HD       ARG  10  -3.363 -17.515   0.806
   80   2HD   ARG  10          2HD       ARG  10  -4.679 -16.625   1.545
   81    HE   ARG  10           HE       ARG  10  -5.184 -19.233   2.323
   82   1HH1  ARG  10          2HH2      ARG  10  -2.342 -17.131   2.559
   83   2HH1  ARG  10          1HH2      ARG  10  -1.750 -17.884   4.002
   84   1HH2  ARG  10          1HH       ARG  10  -2.979 -19.702   4.964
   85    H    VAL  11           H        VAL  11  -2.056 -16.971  -1.514
   86    HA   VAL  11           HA       VAL  11  -1.680 -15.375   0.712
   87    HB   VAL  11           HB       VAL  11   0.013 -16.576  -1.417
   88   1HG1  VAL  11          1HG1      VAL  11   1.993 -15.521   0.041
   89   2HG1  VAL  11          2HG1      VAL  11   1.339 -14.716  -1.407
   90   3HG1  VAL  11          3HG1      VAL  11   0.806 -14.205   0.213
   91   1HG2  VAL  11          1HG2      VAL  11   0.004 -18.129   0.200
   92   2HG2  VAL  11          2HG2      VAL  11   1.133 -17.064   1.071
   93   3HG2  VAL  11          3HG2      VAL  11  -0.612 -16.983   1.415
   94    H    ALA  12           H        ALA  12  -1.492 -14.599  -2.807
   95    HA   ALA  12           HA       ALA  12  -0.497 -12.021  -2.536
   96   1HB   ALA  12          1HB       ALA  12  -0.492 -12.997  -4.688
   97   2HB   ALA  12          2HB       ALA  12  -2.214 -13.441  -4.590
   98   3HB   ALA  12          3HB       ALA  12  -1.744 -11.736  -4.792
   99    H    GLN  13           H        GLN  13  -3.781 -13.377  -2.137
  100    HA   GLN  13           HA       GLN  13  -4.989 -10.814  -2.077
  101   1HB   GLN  13          1HB       GLN  13  -5.895 -13.646  -1.542
  102   2HB   GLN  13          2HB       GLN  13  -6.918 -12.317  -1.035
  103   1HG   GLN  13          1HG       GLN  13  -5.961 -12.942  -3.859
  104   2HG   GLN  13          2HG       GLN  13  -7.612 -12.946  -3.270
  105   1HE2  GLN  13          1HE2      GLN  13  -4.941 -11.060  -4.378
  106   2HE2  GLN  13          2HE2      GLN  13  -5.725  -9.519  -4.477
  107    H    GLU  14           H        GLU  14  -4.878 -13.397   0.486
  108    HA   GLU  14           HA       GLU  14  -5.589 -11.963   2.586
  109   1HB   GLU  14          1HB       GLU  14  -4.007 -14.360   2.138
  110   2HB   GLU  14          2HB       GLU  14  -3.368 -13.493   3.519
  111   1HG   GLU  14          1HG       GLU  14  -6.084 -13.305   3.999
  112   2HG   GLU  14          2HG       GLU  14  -5.996 -14.859   3.191
  113    HE2  GLU  14           HE       GLU  14  -5.347 -13.321   6.162
  114    H    MET  15           H        MET  15  -2.505 -11.706   0.841
  115    HA   MET  15           HA       MET  15  -1.302 -10.134   2.893
  116   1HB   MET  15          1HB       MET  15  -0.592 -10.960   0.042
  117   2HB   MET  15          2HB       MET  15   0.382  -9.761   0.867
  118   1HG   MET  15          1HG       MET  15   0.627 -11.442   2.800
  119   2HG   MET  15          2HG       MET  15  -0.130 -12.634   1.764
  120   1HE   MET  15          1HE       MET  15   4.032 -10.784   1.346
  121   2HE   MET  15          2HE       MET  15   2.578  -9.871   1.818
  122   3HE   MET  15          3HE       MET  15   3.190 -11.176   2.863
  123    H    GLN  16           H        GLN  16  -2.799  -9.579  -0.350
  124    HA   GLN  16           HA       GLN  16  -2.198  -6.873  -0.457
  125   1HB   GLN  16          1HB       GLN  16  -2.908  -8.262  -2.404
  126   2HB   GLN  16          2HB       GLN  16  -4.522  -8.385  -1.730
  127   1HG   GLN  16          1HG       GLN  16  -3.630  -5.585  -1.857
  128   2HG   GLN  16          2HG       GLN  16  -3.559  -6.348  -3.434
  129   1HE2  GLN  16          1HE2      GLN  16  -5.245  -4.705  -3.820
  130   2HE2  GLN  16          2HE2      GLN  16  -6.901  -5.116  -3.525
  131    H    LYS  17           H        LYS  17  -4.898  -8.716   1.013
  132    HA   LYS  17           HA       LYS  17  -6.396  -6.345   1.599
  133   1HB   LYS  17          1HB       LYS  17  -7.908  -7.887   2.754
  134   2HB   LYS  17          2HB       LYS  17  -7.540  -8.437   1.130
  135   1HG   LYS  17          1HG       LYS  17  -6.254 -10.240   1.872
  136   2HG   LYS  17          2HG       LYS  17  -5.754  -9.426   3.343
  137   1HD   LYS  17          1HD       LYS  17  -8.631  -9.745   3.414
  138   2HD   LYS  17          2HD       LYS  17  -7.919 -11.289   2.993
  139   1HE   LYS  17          1HE       LYS  17  -6.478 -11.242   4.977
  140   2HE   LYS  17          2HE       LYS  17  -6.959  -9.598   5.348
  141   1HZ   LYS  17          1HZ       LYS  17  -8.371 -12.041   5.900
  142   2HZ   LYS  17          2HZ       LYS  17  -8.541 -10.580   6.601
  143    H    GLU  18           H        GLU  18  -4.066  -8.503   3.255
  144    HA   GLU  18           HA       GLU  18  -4.496  -7.421   5.792
  145   1HB   GLU  18          1HB       GLU  18  -3.426  -9.594   5.506
  146   2HB   GLU  18          2HB       GLU  18  -2.116  -8.888   4.580
  147   1HG   GLU  18          1HG       GLU  18  -1.073  -8.955   6.644
  148   2HG   GLU  18          2HG       GLU  18  -1.827  -7.378   6.787
  149    HE2  GLU  18           HE       GLU  18  -2.720  -9.954   9.484
  150    H    ILE  19           H        ILE  19  -1.930  -6.818   3.288
  151    HA   ILE  19           HA       ILE  19  -0.675  -4.779   4.757
  152    HB   ILE  19           HB       ILE  19   0.638  -4.442   2.862
  153   1HG1  ILE  19          1HG1      ILE  19  -1.696  -5.498   1.255
  154   2HG1  ILE  19          2HG1      ILE  19  -0.976  -3.901   1.196
  155   1HG2  ILE  19          1HG2      ILE  19  -0.039  -7.113   3.667
  156   2HG2  ILE  19          2HG2      ILE  19   0.380  -7.103   1.936
  157   3HG2  ILE  19          3HG2      ILE  19   1.526  -6.455   3.135
  158   1HD1  ILE  19          1HD1      ILE  19  -0.222  -6.283  -0.274
  159   2HD1  ILE  19          2HD1      ILE  19   0.393  -4.623  -0.453
  160   3HD1  ILE  19          3HD1      ILE  19   1.155  -5.734   0.710
  161    H    ALA  20           H        ALA  20  -3.294  -4.804   2.286
  162    HA   ALA  20           HA       ALA  20  -3.460  -2.066   1.901
  163   1HB   ALA  20          1HB       ALA  20  -5.888  -2.660   1.313
  164   2HB   ALA  20          2HB       ALA  20  -4.615  -3.532   0.424
  165   3HB   ALA  20          3HB       ALA  20  -5.474  -4.331   1.763
  166    H    LEU  21           H        LEU  21  -4.757  -4.194   4.483
  167    HA   LEU  21           HA       LEU  21  -6.423  -2.243   5.634
  168   1HB   LEU  21          1HB       LEU  21  -6.869  -4.489   6.113
  169   2HB   LEU  21          2HB       LEU  21  -5.212  -4.827   6.571
  170    HG   LEU  21           HG       LEU  21  -6.261  -2.796   8.318
  171   1HD1  LEU  21          1HD1      LEU  21  -8.368  -4.264   7.421
  172   2HD1  LEU  21          2HD1      LEU  21  -7.856  -5.225   8.831
  173   3HD1  LEU  21          3HD1      LEU  21  -8.271  -3.505   9.027
  174   1HD2  LEU  21          1HD2      LEU  21  -5.812  -4.654  10.020
  175   2HD2  LEU  21          2HD2      LEU  21  -5.245  -5.620   8.636
  176   3HD2  LEU  21          3HD2      LEU  21  -4.440  -4.084   9.040
  177    H    ILE  22           H        ILE  22  -3.135  -3.454   6.614
  178    HA   ILE  22           HA       ILE  22  -2.774  -1.537   8.600
  179    HB   ILE  22           HB       ILE  22  -0.748  -3.050   6.949
  180   1HG1  ILE  22          1HG1      ILE  22  -1.881  -3.730   9.676
  181   2HG1  ILE  22          2HG1      ILE  22  -2.474  -4.416   8.177
  182   1HG2  ILE  22          1HG2      ILE  22  -0.382  -1.736   9.653
  183   2HG2  ILE  22          2HG2      ILE  22   0.842  -2.604   8.697
  184   3HG2  ILE  22          3HG2      ILE  22   0.185  -1.058   8.109
  185   1HD1  ILE  22          1HD1      ILE  22   0.316  -4.692   9.366
  186   2HD1  ILE  22          2HD1      ILE  22  -0.864  -5.982   9.032
  187   3HD1  ILE  22          3HD1      ILE  22  -0.056  -5.143   7.684
  188    H    LEU  23           H        LEU  23  -2.677  -1.327   5.108
  189    HA   LEU  23           HA       LEU  23  -1.090   1.090   5.157
  190   1HB   LEU  23          1HB       LEU  23  -0.998  -0.760   3.399
  191   2HB   LEU  23          2HB       LEU  23  -2.522  -0.131   2.806
  192    HG   LEU  23           HG       LEU  23  -1.506   2.015   2.294
  193   1HD1  LEU  23          1HD1      LEU  23   0.930   0.848   3.641
  194   2HD1  LEU  23          2HD1      LEU  23   1.035   2.206   2.494
  195   3HD1  LEU  23          3HD1      LEU  23   0.081   2.373   3.987
  196   1HD2  LEU  23          1HD2      LEU  23  -0.032   1.342   0.484
  197   2HD2  LEU  23          2HD2      LEU  23   0.189  -0.260   1.227
  198   3HD2  LEU  23          3HD2      LEU  23  -1.410   0.224   0.612
  199    H    GLN  24           H        GLN  24  -4.380   0.120   5.564
  200    HA   GLN  24           HA       GLN  24  -5.228   2.823   4.870
  201   1HB   GLN  24          1HB       GLN  24  -6.459   0.157   4.517
  202   2HB   GLN  24          2HB       GLN  24  -7.554   1.329   5.222
  203   1HG   GLN  24          1HG       GLN  24  -7.804   2.396   3.236
  204   2HG   GLN  24          2HG       GLN  24  -6.071   2.591   3.062
  205   1HE2  GLN  24          1HE2      GLN  24  -8.813   0.473   2.513
  206   2HE2  GLN  24          2HE2      GLN  24  -8.119  -0.503   1.262
  207    H    ARG  25           H        ARG  25  -4.347   0.834   7.447
  208    HA   ARG  25           HA       ARG  25  -6.182   2.236   9.219
  209   1HB   ARG  25          1HB       ARG  25  -5.818  -0.483   9.031
  210   2HB   ARG  25          2HB       ARG  25  -4.622  -0.105  10.257
  211   1HG   ARG  25          1HG       ARG  25  -6.906   1.389  11.013
  212   2HG   ARG  25          2HG       ARG  25  -7.550  -0.150  10.473
  213   1HD   ARG  25          1HD       ARG  25  -7.087  -0.574  12.748
  214   2HD   ARG  25          2HD       ARG  25  -5.663  -1.222  11.958
  215    HE   ARG  25           HE       ARG  25  -4.374   0.479  12.926
  216   1HH1  ARG  25          2HH2      ARG  25  -7.797   1.364  13.156
  217   2HH1  ARG  25          1HH2      ARG  25  -7.501   2.739  14.168
  218   1HH2  ARG  25          1HH       ARG  25  -5.252   3.267  14.802
  219    H    GLU  26           H        GLU  26  -2.828   0.823   9.041
  220    HA   GLU  26           HA       GLU  26  -1.915   2.382  11.192
  221   1HB   GLU  26          1HB       GLU  26  -0.090   1.041  11.034
  222   2HB   GLU  26          2HB       GLU  26  -0.994   0.163   9.817
  223   1HG   GLU  26          1HG       GLU  26   1.015   0.647   8.688
  224   2HG   GLU  26          2HG       GLU  26  -0.040   1.930   8.128
  225    HE2  GLU  26           HE       GLU  26   1.388   3.832  10.960
  226    H    ILE  27           H        ILE  27  -2.539   3.050   7.855
  227    HA   ILE  27           HA       ILE  27  -0.599   5.216   7.768
  228    HB   ILE  27           HB       ILE  27  -1.698   3.456   5.882
  229   1HG1  ILE  27          1HG1      ILE  27   0.236   5.745   5.875
  230   2HG1  ILE  27          2HG1      ILE  27   0.525   4.035   5.621
  231   1HG2  ILE  27          1HG2      ILE  27  -2.762   4.796   4.237
  232   2HG2  ILE  27          2HG2      ILE  27  -3.606   5.105   5.773
  233   3HG2  ILE  27          3HG2      ILE  27  -2.440   6.294   5.146
  234   1HD1  ILE  27          1HD1      ILE  27  -0.876   4.279   3.450
  235   2HD1  ILE  27          2HD1      ILE  27  -0.694   6.033   3.683
  236   3HD1  ILE  27          3HD1      ILE  27   0.745   5.011   3.458
  237    H    LYS  28           H        LYS  28  -1.672   7.293   6.572
  238    HA   LYS  28           HA       LYS  28  -3.861   8.035   8.365
  239   1HB   LYS  28          1HB       LYS  28  -3.167  10.365   7.833
  240   2HB   LYS  28          2HB       LYS  28  -1.925   9.419   8.630
  241   1HG   LYS  28          1HG       LYS  28  -1.715   9.085   5.740
  242   2HG   LYS  28          2HG       LYS  28  -1.729  10.791   6.136
  243   1HD   LYS  28          1HD       LYS  28   0.553  10.302   6.340
  244   2HD   LYS  28          2HD       LYS  28   0.021  10.122   8.001
  245   1HE   LYS  28          1HE       LYS  28  -0.135   7.682   7.752
  246   2HE   LYS  28          2HE       LYS  28   0.185   7.792   6.032
  247   1HZ   LYS  28          1HZ       LYS  28   2.372   8.895   6.748
  248   2HZ   LYS  28          2HZ       LYS  28   2.071   8.330   8.245
  249    H    ASP  29           H        ASP  29  -5.269   6.655   6.895
  250    HA   ASP  29           HA       ASP  29  -5.700   7.763   4.300
  251   1HB   ASP  29          1HB       ASP  29  -6.292   5.579   4.049
  252   2HB   ASP  29          2HB       ASP  29  -6.415   5.341   5.780
  253    HD2  ASP  29           HD       ASP  29  -8.255   4.671   3.382
  254    HA   PRO  30           HA       PRO  30  -9.700   8.929   6.649
  255   1HB   PRO  30          1HB       PRO  30  -9.822   8.589   9.358
  256   2HB   PRO  30          2HB       PRO  30 -10.452   7.419   8.216
  257   1HG   PRO  30          1HG       PRO  30  -7.981   7.287   9.832
  258   2HG   PRO  30          2HG       PRO  30  -8.838   5.986   9.029
  259   1HD   PRO  30          1HD       PRO  30  -6.419   7.251   8.145
  260   2HD   PRO  30          2HD       PRO  30  -7.340   6.031   7.286
  261    H    ARG  31           H        ARG  31  -6.706   9.482   8.322
  262    HA   ARG  31           HA       ARG  31  -7.504  11.928   9.397
  263   1HB   ARG  31          1HB       ARG  31  -5.592  10.936  10.405
  264   2HB   ARG  31          2HB       ARG  31  -4.841  10.577   8.863
  265   1HG   ARG  31          1HG       ARG  31  -5.333  13.474   9.540
  266   2HG   ARG  31          2HG       ARG  31  -4.037  12.649  10.385
  267   1HD   ARG  31          1HD       ARG  31  -2.794  12.274   8.412
  268   2HD   ARG  31          2HD       ARG  31  -4.207  12.361   7.378
  269    HE   ARG  31           HE       ARG  31  -4.137  14.903   8.356
  270   1HH1  ARG  31          2HH2      ARG  31  -1.563  12.878   7.006
  271   2HH1  ARG  31          1HH2      ARG  31  -0.653  14.223   6.401
  272   1HH2  ARG  31          1HH       ARG  31  -1.480  16.446   6.738
  273    H    LEU  32           H        LEU  32  -6.558  10.886   6.197
  274    HA   LEU  32           HA       LEU  32  -5.616  13.453   5.335
  275   1HB   LEU  32          1HB       LEU  32  -5.641  10.752   4.372
  276   2HB   LEU  32          2HB       LEU  32  -6.315  11.802   3.142
  277    HG   LEU  32           HG       LEU  32  -4.297  13.205   3.204
  278   1HD1  LEU  32          1HD1      LEU  32  -3.321  13.177   5.260
  279   2HD1  LEU  32          2HD1      LEU  32  -3.618  11.441   5.510
  280   3HD1  LEU  32          3HD1      LEU  32  -2.293  11.974   4.447
  281   1HD2  LEU  32          1HD2      LEU  32  -3.870  10.244   2.745
  282   2HD2  LEU  32          2HD2      LEU  32  -4.326  11.488   1.556
  283   3HD2  LEU  32          3HD2      LEU  32  -2.697  11.499   2.275
  284    H    GLY  33           H        GLY  33  -8.690  11.763   5.647
  285   1HA   GLY  33          1HA       GLY  33 -10.716  12.925   5.642
  286   2HA   GLY  33          2HA       GLY  33 -10.034  14.145   4.587
  287    H    MET  34           H        MET  34  -9.103  10.952   3.647
  288    HA   MET  34           HA       MET  34 -11.343  10.844   1.783
  289   1HB   MET  34          1HB       MET  34  -8.442  10.115   1.116
  290   2HB   MET  34          2HB       MET  34  -9.774  10.245  -0.015
  291   1HG   MET  34          1HG       MET  34  -9.787  12.600   0.046
  292   2HG   MET  34          2HG       MET  34  -9.078  12.671   1.647
  293   1HE   MET  34          1HE       MET  34  -7.392  13.879   1.770
  294   2HE   MET  34          2HE       MET  34  -5.781  13.681   1.038
  295   3HE   MET  34          3HE       MET  34  -7.020  14.657   0.213
  296    H    MET  35           H        MET  35 -10.533   8.458   0.432
  297    HA   MET  35           HA       MET  35 -10.269   6.553   2.609
  298   1HB   MET  35          1HB       MET  35 -12.696   7.133   1.273
  299   2HB   MET  35          2HB       MET  35 -12.123   5.689   0.463
  300   1HG   MET  35          1HG       MET  35 -11.787   4.636   2.780
  301   2HG   MET  35          2HG       MET  35 -12.599   6.031   3.461
  302   1HE   MET  35          1HE       MET  35 -12.923   2.668   2.696
  303   2HE   MET  35          2HE       MET  35 -14.471   2.344   1.880
  304   3HE   MET  35          3HE       MET  35 -13.076   2.926   0.941
  305    H    THR  36           H        THR  36  -8.032   6.430   1.748
  306    HA   THR  36           HA       THR  36  -7.266   5.920  -0.800
  307    HB   THR  36           HB       THR  36  -5.349   4.697   0.314
  308    HG1  THR  36           HG1      THR  36  -7.107   3.835   1.914
  309   1HG2  THR  36          1HG2      THR  36  -4.510   6.598   1.342
  310   2HG2  THR  36          2HG2      THR  36  -5.947   7.364   0.622
  311   3HG2  THR  36          3HG2      THR  36  -5.978   6.830   2.319
  312    H    THR  37           H        THR  37  -6.713   3.985  -2.010
  313    HA   THR  37           HA       THR  37  -8.265   1.625  -1.241
  314    HB   THR  37           HB       THR  37  -8.620   3.396  -3.673
  315    HG1  THR  37           HG1      THR  37 -10.056   3.206  -1.710
  316   1HG2  THR  37          1HG2      THR  37  -9.755   1.533  -4.842
  317   2HG2  THR  37          2HG2      THR  37  -8.045   1.110  -4.586
  318   3HG2  THR  37          3HG2      THR  37  -9.300   0.412  -3.536
  319    H    VAL  38           H        VAL  38  -7.646  -0.327  -2.506
  320    HA   VAL  38           HA       VAL  38  -4.850  -0.088  -3.380
  321    HB   VAL  38           HB       VAL  38  -4.905  -1.108  -1.214
  322   1HG1  VAL  38          1HG1      VAL  38  -6.779  -2.125  -0.541
  323   2HG1  VAL  38          2HG1      VAL  38  -7.344  -2.344  -2.215
  324   3HG1  VAL  38          3HG1      VAL  38  -6.251  -3.541  -1.481
  325   1HG2  VAL  38          1HG2      VAL  38  -4.289  -2.801  -3.594
  326   2HG2  VAL  38          2HG2      VAL  38  -3.218  -2.190  -2.311
  327   3HG2  VAL  38          3HG2      VAL  38  -4.272  -3.589  -1.998
  328    H    SER  39           H        SER  39  -5.941   0.306  -5.522
  329    HA   SER  39           HA       SER  39  -7.664  -1.305  -6.754
  330   1HB   SER  39          1HB       SER  39  -6.435   0.774  -7.642
  331   2HB   SER  39          2HB       SER  39  -5.135  -0.300  -8.123
  332    HG   SER  39           HG       SER  39  -6.255  -0.723  -9.886
  333    H    GLY  40           H        GLY  40  -4.081  -1.824  -6.498
  334   1HA   GLY  40          1HA       GLY  40  -4.493  -4.694  -6.696
  335   2HA   GLY  40          2HA       GLY  40  -3.596  -3.964  -8.013
  336    H    VAL  41           H        VAL  41  -2.235  -5.812  -6.548
  337    HA   VAL  41           HA       VAL  41  -0.194  -4.182  -5.335
  338    HB   VAL  41           HB       VAL  41  -1.609  -6.339  -3.754
  339   1HG1  VAL  41          1HG1      VAL  41   1.036  -5.725  -3.601
  340   2HG1  VAL  41          2HG1      VAL  41   0.360  -4.557  -2.440
  341   3HG1  VAL  41          3HG1      VAL  41   0.062  -6.299  -2.228
  342   1HG2  VAL  41          1HG2      VAL  41  -2.109  -4.413  -2.187
  343   2HG2  VAL  41          2HG2      VAL  41  -1.596  -3.319  -3.495
  344   3HG2  VAL  41          3HG2      VAL  41  -2.993  -4.398  -3.732
  345    H    GLU  42           H        GLU  42   1.782  -4.990  -5.887
  346    HA   GLU  42           HA       GLU  42   1.751  -7.715  -6.930
  347   1HB   GLU  42          1HB       GLU  42   3.518  -5.357  -7.722
  348   2HB   GLU  42          2HB       GLU  42   3.695  -6.983  -8.351
  349   1HG   GLU  42          1HG       GLU  42   0.997  -5.614  -8.524
  350   2HG   GLU  42          2HG       GLU  42   2.251  -5.188  -9.673
  351    HE2  GLU  42           HE       GLU  42   3.153  -7.402 -10.852
  352    H    MET  43           H        MET  43   2.674  -9.118  -5.500
  353    HA   MET  43           HA       MET  43   4.879  -8.065  -3.909
  354   1HB   MET  43          1HB       MET  43   3.524 -10.662  -3.199
  355   2HB   MET  43          2HB       MET  43   4.112  -9.403  -2.133
  356   1HG   MET  43          1HG       MET  43   1.859  -8.962  -1.892
  357   2HG   MET  43          2HG       MET  43   2.115  -8.007  -3.339
  358   1HE   MET  43          1HE       MET  43  -1.330  -9.658  -4.078
  359   2HE   MET  43          2HE       MET  43  -0.711  -9.052  -2.523
  360   3HE   MET  43          3HE       MET  43  -0.396  -8.144  -4.022
  361    H    SER  44           H        SER  44   6.788  -8.590  -4.919
  362    HA   SER  44           HA       SER  44   6.943 -11.274  -6.036
  363   1HB   SER  44          1HB       SER  44   8.222  -8.644  -6.736
  364   2HB   SER  44          2HB       SER  44   9.160 -10.096  -7.028
  365    HG   SER  44           HG       SER  44   6.448  -9.740  -7.975
  366    H    ARG  45           H        ARG  45   7.799 -12.676  -4.531
  367    HA   ARG  45           HA       ARG  45   9.791 -11.605  -2.733
  368   1HB   ARG  45          1HB       ARG  45   7.781 -13.773  -2.635
  369   2HB   ARG  45          2HB       ARG  45   9.341 -14.293  -2.032
  370   1HG   ARG  45          1HG       ARG  45   9.030 -13.149  -0.101
  371   2HG   ARG  45          2HG       ARG  45   8.806 -11.650  -0.981
  372   1HD   ARG  45          1HD       ARG  45   6.619 -11.682  -0.370
  373   2HD   ARG  45          2HD       ARG  45   6.396 -13.085  -1.395
  374    HE   ARG  45           HE       ARG  45   7.516 -13.708   1.252
  375   1HH1  ARG  45          2HH2      ARG  45   4.547 -13.332  -0.645
  376   2HH1  ARG  45          1HH2      ARG  45   3.591 -14.298   0.429
  377   1HH2  ARG  45          1HH       ARG  45   4.616 -15.259   2.369
  378    H    ASP  46           H        ASP  46   9.745 -12.908  -5.768
  379    HA   ASP  46           HA       ASP  46  11.312 -15.083  -5.819
  380   1HB   ASP  46          1HB       ASP  46  10.654 -12.880  -7.616
  381   2HB   ASP  46          2HB       ASP  46  12.316 -13.371  -7.873
  382    HD2  ASP  46           HD       ASP  46  11.500 -14.769 -10.136
  383    H    LEU  47           H        LEU  47  12.112 -11.800  -4.832
  384    HA   LEU  47           HA       LEU  47  14.826 -12.655  -4.255
  385   1HB   LEU  47          1HB       LEU  47  14.164 -10.930  -6.441
  386   2HB   LEU  47          2HB       LEU  47  15.016  -9.998  -5.226
  387    HG   LEU  47           HG       LEU  47  16.485 -12.380  -5.460
  388   1HD1  LEU  47          1HD1      LEU  47  16.996 -12.510  -7.864
  389   2HD1  LEU  47          2HD1      LEU  47  15.305 -12.943  -7.510
  390   3HD1  LEU  47          3HD1      LEU  47  15.691 -11.346  -8.196
  391   1HD2  LEU  47          1HD2      LEU  47  17.040  -9.782  -5.247
  392   2HD2  LEU  47          2HD2      LEU  47  18.234 -10.974  -5.814
  393   3HD2  LEU  47          3HD2      LEU  47  17.347  -9.975  -6.990
  394    H    ALA  48           H        ALA  48  12.669  -9.725  -4.220
  395    HA   ALA  48           HA       ALA  48  12.024  -9.671  -1.618
  396   1HB   ALA  48          1HB       ALA  48  14.898  -9.138  -1.965
  397   2HB   ALA  48          2HB       ALA  48  14.047  -7.851  -1.074
  398   3HB   ALA  48          3HB       ALA  48  13.979  -9.533  -0.493
  399    H    TYR  49           H        TYR  49  10.309  -8.753  -2.976
  400    HA   TYR  49           HA       TYR  49  10.472  -5.887  -2.990
  401   1HB   TYR  49          1HB       TYR  49   9.897  -7.482  -5.557
  402   2HB   TYR  49          2HB       TYR  49  10.058  -5.741  -5.439
  403    HD1  TYR  49           HD1      TYR  49  11.738  -8.778  -6.190
  404    HD2  TYR  49           HD2      TYR  49  12.394  -4.841  -4.648
  405    HE1  TYR  49           HE1      TYR  49  14.212  -8.961  -6.753
  406    HE2  TYR  49           HE2      TYR  49  14.864  -5.038  -5.216
  407    HH   TYR  49           HH       TYR  49  16.288  -8.014  -6.055
  408    H    ALA  50           H        ALA  50   8.456  -4.991  -2.670
  409    HA   ALA  50           HA       ALA  50   6.125  -6.584  -3.345
  410   1HB   ALA  50          1HB       ALA  50   5.887  -7.344  -1.238
  411   2HB   ALA  50          2HB       ALA  50   7.214  -6.316  -0.648
  412   3HB   ALA  50          3HB       ALA  50   5.562  -5.660  -0.758
  413    H    LYS  51           H        LYS  51   5.471  -5.039  -4.849
  414    HA   LYS  51           HA       LYS  51   5.315  -2.282  -3.910
  415   1HB   LYS  51          1HB       LYS  51   4.459  -2.605  -6.627
  416   2HB   LYS  51          2HB       LYS  51   5.847  -1.741  -5.998
  417   1HG   LYS  51          1HG       LYS  51   7.028  -4.038  -5.826
  418   2HG   LYS  51          2HG       LYS  51   5.696  -4.689  -6.762
  419   1HD   LYS  51          1HD       LYS  51   7.142  -4.151  -8.499
  420   2HD   LYS  51          2HD       LYS  51   6.257  -2.642  -8.394
  421   1HE   LYS  51          1HE       LYS  51   8.020  -1.616  -7.042
  422   2HE   LYS  51          2HE       LYS  51   8.851  -3.149  -6.866
  423   1HZ   LYS  51          1HZ       LYS  51   8.983  -3.093  -9.419
  424   2HZ   LYS  51          2HZ       LYS  51   8.600  -1.514  -9.314
  425    H    VAL  52           H        VAL  52   3.466  -1.551  -3.024
  426    HA   VAL  52           HA       VAL  52   1.000  -2.958  -3.790
  427    HB   VAL  52           HB       VAL  52   1.555  -3.387  -1.503
  428   1HG1  VAL  52          1HG1      VAL  52   2.229  -0.487  -1.468
  429   2HG1  VAL  52          2HG1      VAL  52   1.499  -1.159   0.009
  430   3HG1  VAL  52          3HG1      VAL  52   3.002  -1.859  -0.638
  431   1HG2  VAL  52          1HG2      VAL  52  -0.701  -3.264  -1.402
  432   2HG2  VAL  52          2HG2      VAL  52  -0.386  -1.797  -0.446
  433   3HG2  VAL  52          3HG2      VAL  52  -0.757  -1.665  -2.183
  434    H    TYR  53           H        TYR  53  -0.465  -1.779  -4.910
  435    HA   TYR  53           HA       TYR  53   0.086   1.000  -5.372
  436   1HB   TYR  53          1HB       TYR  53  -1.225  -1.245  -6.585
  437   2HB   TYR  53          2HB       TYR  53  -2.528  -0.134  -6.211
  438    HD1  TYR  53           HD1      TYR  53  -1.597  -1.015  -8.992
  439    HD2  TYR  53           HD2      TYR  53  -0.613   2.382  -6.584
  440    HE1  TYR  53           HE1      TYR  53  -1.061   0.322 -11.087
  441    HE2  TYR  53           HE2      TYR  53  -0.080   3.709  -8.687
  442    HH   TYR  53           HH       TYR  53   0.166   2.185 -11.765
  443    H    VAL  54           H        VAL  54  -1.018   2.785  -4.604
  444    HA   VAL  54           HA       VAL  54  -3.411   2.303  -3.016
  445    HB   VAL  54           HB       VAL  54  -2.225   4.086  -1.418
  446   1HG1  VAL  54          1HG1      VAL  54  -1.840   2.302   0.144
  447   2HG1  VAL  54          2HG1      VAL  54  -3.264   1.873  -0.837
  448   3HG1  VAL  54          3HG1      VAL  54  -1.690   1.110  -1.171
  449   1HG2  VAL  54          1HG2      VAL  54  -0.125   4.033  -2.782
  450   2HG2  VAL  54          2HG2      VAL  54   0.110   3.618  -1.068
  451   3HG2  VAL  54          3HG2      VAL  54   0.090   2.333  -2.300
  452    H    THR  55           H        THR  55  -4.948   3.621  -3.831
  453    HA   THR  55           HA       THR  55  -4.034   6.112  -5.101
  454    HB   THR  55           HB       THR  55  -5.190   4.924  -6.763
  455    HG1  THR  55           HG1      THR  55  -6.621   6.625  -6.728
  456   1HG2  THR  55          1HG2      THR  55  -6.797   3.788  -4.441
  457   2HG2  THR  55          2HG2      THR  55  -7.442   3.732  -6.099
  458   3HG2  THR  55          3HG2      THR  55  -5.914   2.907  -5.710
  459    H    PHE  56           H        PHE  56  -4.521   8.043  -4.250
  460    HA   PHE  56           HA       PHE  56  -6.514   8.019  -2.092
  461   1HB   PHE  56          1HB       PHE  56  -4.150   9.930  -2.526
  462   2HB   PHE  56          2HB       PHE  56  -5.091   9.755  -1.059
  463    HD1  PHE  56           HD1      PHE  56  -5.126   6.687  -1.049
  464    HD2  PHE  56           HD2      PHE  56  -2.008   9.511  -1.598
  465    HE1  PHE  56           HE1      PHE  56  -3.464   5.020  -0.180
  466    HE2  PHE  56           HE2      PHE  56  -0.344   7.843  -0.729
  467    HZ   PHE  56           HZ       PHE  56  -1.093   5.619  -0.029
  468    H    LEU  57           H        LEU  57  -7.631  10.162  -1.751
  469    HA   LEU  57           HA       LEU  57  -8.241  11.296  -4.369
  470   1HB   LEU  57          1HB       LEU  57  -9.946  10.300  -2.690
  471   2HB   LEU  57          2HB       LEU  57  -9.749  11.811  -1.826
  472    HG   LEU  57           HG       LEU  57 -10.369  13.001  -3.987
  473   1HD1  LEU  57          1HD1      LEU  57 -10.146  10.426  -5.063
  474   2HD1  LEU  57          2HD1      LEU  57 -11.890  10.783  -5.058
  475   3HD1  LEU  57          3HD1      LEU  57 -10.757  11.889  -5.871
  476   1HD2  LEU  57          1HD2      LEU  57 -12.307  13.246  -2.944
  477   2HD2  LEU  57          2HD2      LEU  57 -12.842  11.648  -3.519
  478   3HD2  LEU  57          3HD2      LEU  57 -11.971  11.792  -1.974
  479    H    ASN  58           H        ASN  58  -5.762  11.830  -2.614
  480    HA   ASN  58           HA       ASN  58  -5.991  14.305  -1.455
  481   1HB   ASN  58          1HB       ASN  58  -3.863  12.483  -2.277
  482   2HB   ASN  58          2HB       ASN  58  -3.389  14.127  -2.657
  483   1HD2  ASN  58          1HD2      ASN  58  -4.539  15.618  -0.730
  484   2HD2  ASN  58          2HD2      ASN  58  -3.918  15.229   0.839
  485    H    ASP  59           H        ASP  59  -5.567  13.249  -4.846
  486    HA   ASP  59           HA       ASP  59  -4.539  15.313  -6.112
  487   1HB   ASP  59          1HB       ASP  59  -6.474  14.873  -7.881
  488   2HB   ASP  59          2HB       ASP  59  -5.273  13.640  -7.552
  489    HD2  ASP  59           HD       ASP  59  -7.584  11.425  -6.263
  490    H    LYS  60           H        LYS  60  -7.765  15.130  -4.560
  491    HA   LYS  60           HA       LYS  60  -9.148  17.162  -5.622
  492   1HB   LYS  60          1HB       LYS  60  -8.957  15.925  -2.951
  493   2HB   LYS  60          2HB       LYS  60  -9.638  17.540  -2.948
  494   1HG   LYS  60          1HG       LYS  60 -10.758  16.087  -5.188
  495   2HG   LYS  60          2HG       LYS  60 -10.896  15.082  -3.760
  496   1HD   LYS  60          1HD       LYS  60 -11.594  17.931  -3.283
  497   2HD   LYS  60          2HD       LYS  60 -12.638  17.138  -4.447
  498   1HE   LYS  60          1HE       LYS  60 -13.293  15.441  -2.870
  499   2HE   LYS  60          2HE       LYS  60 -11.981  15.833  -1.776
  500   1HZ   LYS  60          1HZ       LYS  60 -14.555  16.997  -1.883
  501   2HZ   LYS  60          2HZ       LYS  60 -13.392  17.242  -0.772
  502    H    ASP  61           H        ASP  61  -6.504  17.485  -3.170
  503    HA   ASP  61           HA       ASP  61  -6.334  20.266  -4.025
  504   1HB   ASP  61          1HB       ASP  61  -5.571  19.307  -1.242
  505   2HB   ASP  61          2HB       ASP  61  -5.835  20.956  -1.776
  506    HD2  ASP  61           HD       ASP  61  -8.059  21.437  -2.329
  507    H    GLU  62           H        GLU  62  -4.264  20.781  -4.787
  508    HA   GLU  62           HA       GLU  62  -2.329  18.767  -4.901
  509   1HB   GLU  62          1HB       GLU  62  -2.720  20.710  -6.539
  510   2HB   GLU  62          2HB       GLU  62  -1.877  21.737  -5.396
  511   1HG   GLU  62          1HG       GLU  62   0.146  20.337  -5.551
  512   2HG   GLU  62          2HG       GLU  62  -0.689  19.176  -6.564
  513    HE2  GLU  62           HE       GLU  62  -0.285  22.919  -7.651
  514    H    ASP  63           H        ASP  63  -3.086  21.281  -2.569
  515    HA   ASP  63           HA       ASP  63  -0.525  21.546  -1.489
  516   1HB   ASP  63          1HB       ASP  63  -3.165  22.561  -1.020
  517   2HB   ASP  63          2HB       ASP  63  -2.619  21.890   0.505
  518    HD2  ASP  63           HD       ASP  63   0.235  23.749   0.600
  519    H    ALA  64           H        ALA  64  -3.411  19.478  -0.788
  520    HA   ALA  64           HA       ALA  64  -2.145  18.222   1.462
  521   1HB   ALA  64          1HB       ALA  64  -4.617  18.667   1.238
  522   2HB   ALA  64          2HB       ALA  64  -4.666  17.439  -0.049
  523   3HB   ALA  64          3HB       ALA  64  -4.212  16.973   1.608
  524    H    VAL  65           H        VAL  65  -2.152  17.888  -2.001
  525    HA   VAL  65           HA       VAL  65  -1.665  15.083  -2.054
  526    HB   VAL  65           HB       VAL  65  -2.353  17.066  -3.856
  527   1HG1  VAL  65          1HG1      VAL  65  -0.667  17.045  -5.608
  528   2HG1  VAL  65          2HG1      VAL  65   0.044  17.661  -4.097
  529   3HG1  VAL  65          3HG1      VAL  65   0.382  15.996  -4.627
  530   1HG2  VAL  65          1HG2      VAL  65  -1.854  14.967  -5.498
  531   2HG2  VAL  65          2HG2      VAL  65  -1.823  14.148  -3.917
  532   3HG2  VAL  65          3HG2      VAL  65  -3.264  15.068  -4.414
  533    H    LYS  66           H        LYS  66   0.340  18.079  -2.092
  534    HA   LYS  66           HA       LYS  66   2.766  16.594  -2.354
  535   1HB   LYS  66          1HB       LYS  66   2.036  19.157  -2.900
  536   2HB   LYS  66          2HB       LYS  66   2.845  19.386  -1.363
  537   1HG   LYS  66          1HG       LYS  66   4.826  19.284  -2.460
  538   2HG   LYS  66          2HG       LYS  66   4.516  17.587  -2.769
  539   1HD   LYS  66          1HD       LYS  66   2.948  18.833  -4.710
  540   2HD   LYS  66          2HD       LYS  66   4.332  19.902  -4.613
  541   1HE   LYS  66          1HE       LYS  66   5.881  18.114  -5.122
  542   2HE   LYS  66          2HE       LYS  66   4.661  16.883  -4.860
  543   1HZ   LYS  66          1HZ       LYS  66   4.887  17.242  -7.212
  544   2HZ   LYS  66          2HZ       LYS  66   3.440  17.861  -6.797
  545    H    ALA  67           H        ALA  67   1.089  18.388   0.315
  546    HA   ALA  67           HA       ALA  67   3.004  17.748   2.258
  547   1HB   ALA  67          1HB       ALA  67   0.980  19.474   2.145
  548   2HB   ALA  67          2HB       ALA  67   0.107  18.147   2.949
  549   3HB   ALA  67          3HB       ALA  67   1.563  18.839   3.704
  550    H    GLY  68           H        GLY  68  -0.186  16.240   1.403
  551   1HA   GLY  68          1HA       GLY  68  -0.191  14.223   3.299
  552   2HA   GLY  68          2HA       GLY  68  -0.965  14.159   1.729
  553    H    ILE  69           H        ILE  69   0.836  13.934  -0.186
  554    HA   ILE  69           HA       ILE  69   1.830  11.375   0.027
  555    HB   ILE  69           HB       ILE  69   1.352  12.859  -2.010
  556   1HG1  ILE  69          1HG1      ILE  69   3.867  11.364  -2.504
  557   2HG1  ILE  69          2HG1      ILE  69   2.593  10.467  -1.705
  558   1HG2  ILE  69          1HG2      ILE  69   2.947  14.657  -1.348
  559   2HG2  ILE  69          2HG2      ILE  69   4.286  13.530  -1.674
  560   3HG2  ILE  69          3HG2      ILE  69   3.202  14.030  -2.995
  561   1HD1  ILE  69          1HD1      ILE  69   1.511  10.230  -3.676
  562   2HD1  ILE  69          2HD1      ILE  69   1.380  11.998  -3.823
  563   3HD1  ILE  69          3HD1      ILE  69   2.800  11.153  -4.485
  564    H    LYS  70           H        LYS  70   3.238  14.495   0.985
  565    HA   LYS  70           HA       LYS  70   5.886  13.552   1.228
  566   1HB   LYS  70          1HB       LYS  70   5.591  15.878   1.000
  567   2HB   LYS  70          2HB       LYS  70   4.380  15.951   2.263
  568   1HG   LYS  70          1HG       LYS  70   6.031  15.515   3.995
  569   2HG   LYS  70          2HG       LYS  70   7.255  15.098   2.813
  570   1HD   LYS  70          1HD       LYS  70   7.914  17.277   3.088
  571   2HD   LYS  70          2HD       LYS  70   6.630  17.616   1.945
  572   1HE   LYS  70          1HE       LYS  70   6.071  19.086   3.680
  573   2HE   LYS  70          2HE       LYS  70   5.085  17.700   4.098
  574   1HZ   LYS  70          1HZ       LYS  70   6.693  18.780   5.858
  575   2HZ   LYS  70          2HZ       LYS  70   6.463  17.167   5.854
  576    H    ALA  71           H        ALA  71   2.991  13.479   3.301
  577    HA   ALA  71           HA       ALA  71   4.481  12.682   5.619
  578   1HB   ALA  71          1HB       ALA  71   2.387  12.717   6.708
  579   2HB   ALA  71          2HB       ALA  71   2.247  13.994   5.475
  580   3HB   ALA  71          3HB       ALA  71   1.496  12.404   5.200
  581    H    LEU  72           H        LEU  72   2.415  11.129   3.096
  582    HA   LEU  72           HA       LEU  72   2.544   8.565   4.266
  583   1HB   LEU  72          1HB       LEU  72   1.061   9.757   2.332
  584   2HB   LEU  72          2HB       LEU  72   2.152   8.799   1.349
  585    HG   LEU  72           HG       LEU  72   0.956   7.320   3.603
  586   1HD1  LEU  72          1HD1      LEU  72  -0.746   8.944   1.886
  587   2HD1  LEU  72          2HD1      LEU  72  -1.125   7.209   1.770
  588   3HD1  LEU  72          3HD1      LEU  72  -1.142   8.021   3.356
  589   1HD2  LEU  72          1HD2      LEU  72   2.175   6.033   2.083
  590   2HD2  LEU  72          2HD2      LEU  72   0.480   5.732   1.635
  591   3HD2  LEU  72          3HD2      LEU  72   1.468   6.854   0.670
  592    H    GLN  73           H        GLN  73   4.787  10.516   2.433
  593    HA   GLN  73           HA       GLN  73   6.240   8.267   1.456
  594   1HB   GLN  73          1HB       GLN  73   6.138  10.449   0.237
  595   2HB   GLN  73          2HB       GLN  73   6.997  11.220   1.555
  596   1HG   GLN  73          1HG       GLN  73   8.388   8.797   0.622
  597   2HG   GLN  73          2HG       GLN  73   8.152   9.948  -0.679
  598   1HE2  GLN  73          1HE2      GLN  73   8.506  12.320   0.081
  599   2HE2  GLN  73          2HE2      GLN  73   9.981  12.624   0.937
  600    H    GLU  74           H        GLU  74   6.777  10.868   3.935
  601    HA   GLU  74           HA       GLU  74   9.203   9.929   4.816
  602   1HB   GLU  74          1HB       GLU  74   8.983  11.481   6.559
  603   2HB   GLU  74          2HB       GLU  74   7.902  12.138   5.346
  604   1HG   GLU  74          1HG       GLU  74   6.463  12.191   7.162
  605   2HG   GLU  74          2HG       GLU  74   6.102  10.576   6.587
  606    HE2  GLU  74           HE       GLU  74   5.626  10.349   9.044
  607    H    ALA  75           H        ALA  75   5.887   8.844   5.493
  608    HA   ALA  75           HA       ALA  75   6.781   7.163   7.679
  609   1HB   ALA  75          1HB       ALA  75   4.437   6.711   7.990
  610   2HB   ALA  75          2HB       ALA  75   4.597   8.454   7.664
  611   3HB   ALA  75          3HB       ALA  75   4.039   7.355   6.380
  612    H    SER  76           H        SER  76   7.515   6.972   4.608
  613    HA   SER  76           HA       SER  76   6.345   4.718   3.588
  614   1HB   SER  76          1HB       SER  76   7.663   5.967   2.089
  615   2HB   SER  76          2HB       SER  76   9.016   6.071   3.198
  616    HG   SER  76           HG       SER  76   9.686   4.031   2.671
  617    H    GLY  77           H        GLY  77   9.755   4.796   4.853
  618   1HA   GLY  77          1HA       GLY  77  10.093   2.095   5.187
  619   2HA   GLY  77          2HA       GLY  77  10.911   3.336   6.114
  620    H    PHE  78           H        PHE  78   8.059   4.288   7.033
  621    HA   PHE  78           HA       PHE  78   8.089   2.767   9.433
  622   1HB   PHE  78          1HB       PHE  78   6.938   5.200   8.259
  623   2HB   PHE  78          2HB       PHE  78   5.669   4.310   9.078
  624    HD1  PHE  78           HD1      PHE  78   8.427   6.531   9.478
  625    HD2  PHE  78           HD2      PHE  78   6.080   3.646  11.522
  626    HE1  PHE  78           HE1      PHE  78   9.189   7.468  11.677
  627    HE2  PHE  78           HE2      PHE  78   6.842   4.585  13.721
  628    HZ   PHE  78           HZ       PHE  78   8.388   6.486  13.773
  629    H    ILE  79           H        ILE  79   5.910   3.019   6.560
  630    HA   ILE  79           HA       ILE  79   4.017   1.194   7.635
  631    HB   ILE  79           HB       ILE  79   3.163   1.218   5.269
  632   1HG1  ILE  79          1HG1      ILE  79   5.190   3.415   4.814
  633   2HG1  ILE  79          2HG1      ILE  79   5.481   1.759   4.318
  634   1HG2  ILE  79          1HG2      ILE  79   2.677   3.800   5.442
  635   2HG2  ILE  79          2HG2      ILE  79   2.010   2.658   6.632
  636   3HG2  ILE  79          3HG2      ILE  79   3.452   3.620   7.034
  637   1HD1  ILE  79          1HD1      ILE  79   4.179   3.648   2.784
  638   2HD1  ILE  79          2HD1      ILE  79   4.011   1.889   2.571
  639   3HD1  ILE  79          3HD1      ILE  79   2.810   2.788   3.529
  640    H    ARG  80           H        ARG  80   6.862   0.977   5.448
  641    HA   ARG  80           HA       ARG  80   6.390  -1.661   4.718
  642   1HB   ARG  80          1HB       ARG  80   7.916  -0.457   3.345
  643   2HB   ARG  80          2HB       ARG  80   8.814   0.164   4.716
  644   1HG   ARG  80          1HG       ARG  80   9.685  -2.125   5.198
  645   2HG   ARG  80          2HG       ARG  80   8.767  -2.766   3.848
  646   1HD   ARG  80          1HD       ARG  80  10.269  -1.989   2.292
  647   2HD   ARG  80          2HD       ARG  80  10.469  -0.450   3.106
  648    HE   ARG  80           HE       ARG  80  11.701  -2.457   4.719
  649   1HH1  ARG  80          2HH2      ARG  80  12.175  -0.877   1.583
  650   2HH1  ARG  80          1HH2      ARG  80  13.892  -1.107   1.587
  651   1HH2  ARG  80          1HH       ARG  80  14.923  -2.216   3.445
  652    H    SER  81           H        SER  81   8.453  -0.132   7.281
  653    HA   SER  81           HA       SER  81   9.446  -2.585   8.203
  654   1HB   SER  81          1HB       SER  81  10.646  -0.490   8.604
  655   2HB   SER  81          2HB       SER  81   9.289   0.171   9.495
  656    HG   SER  81           HG       SER  81  10.255  -2.300  10.462
  657    H    LEU  82           H        LEU  82   6.613  -0.538   8.971
  658    HA   LEU  82           HA       LEU  82   5.934  -1.813  11.381
  659   1HB   LEU  82          1HB       LEU  82   5.124   0.375  10.846
  660   2HB   LEU  82          2HB       LEU  82   4.344  -0.203   9.386
  661    HG   LEU  82           HG       LEU  82   3.415  -1.577  11.812
  662   1HD1  LEU  82          1HD1      LEU  82   3.916   0.708  12.707
  663   2HD1  LEU  82          2HD1      LEU  82   2.743   1.363  11.539
  664   3HD1  LEU  82          3HD1      LEU  82   2.204   0.230  12.801
  665   1HD2  LEU  82          1HD2      LEU  82   2.465  -0.846   9.209
  666   2HD2  LEU  82          2HD2      LEU  82   1.755  -1.967  10.395
  667   3HD2  LEU  82          3HD2      LEU  82   1.330  -0.238  10.439
  668    H    LEU  83           H        LEU  83   5.364  -2.545   7.938
  669    HA   LEU  83           HA       LEU  83   3.361  -4.484   8.424
  670   1HB   LEU  83          1HB       LEU  83   5.144  -3.828   6.090
  671   2HB   LEU  83          2HB       LEU  83   4.039  -5.188   6.055
  672    HG   LEU  83           HG       LEU  83   2.850  -2.586   6.848
  673   1HD1  LEU  83          1HD1      LEU  83   2.947  -2.723   3.956
  674   2HD1  LEU  83          2HD1      LEU  83   3.340  -1.377   5.051
  675   3HD1  LEU  83          3HD1      LEU  83   4.580  -2.588   4.651
  676   1HD2  LEU  83          1HD2      LEU  83   1.546  -4.678   6.604
  677   2HD2  LEU  83          2HD2      LEU  83   0.985  -3.373   5.532
  678   3HD2  LEU  83          3HD2      LEU  83   1.963  -4.707   4.873
  679    H    GLY  84           H        GLY  84   6.885  -4.762   7.573
  680   1HA   GLY  84          1HA       GLY  84   7.199  -7.458   7.707
  681   2HA   GLY  84          2HA       GLY  84   8.412  -6.297   8.208
  682    H    LYS  85           H        LYS  85   7.353  -5.128  10.495
  683    HA   LYS  85           HA       LYS  85   7.748  -7.211  12.379
  684   1HB   LYS  85          1HB       LYS  85   7.530  -4.276  12.369
  685   2HB   LYS  85          2HB       LYS  85   6.866  -5.025  13.808
  686   1HG   LYS  85          1HG       LYS  85   9.185  -6.471  13.546
  687   2HG   LYS  85          2HG       LYS  85   9.694  -4.952  12.837
  688   1HD   LYS  85          1HD       LYS  85   8.170  -4.837  15.435
  689   2HD   LYS  85          2HD       LYS  85   9.826  -5.405  15.493
  690   1HE   LYS  85          1HE       LYS  85  10.184  -3.210  13.915
  691   2HE   LYS  85          2HE       LYS  85   8.773  -2.677  14.808
  692   1HZ   LYS  85          1HZ       LYS  85  11.200  -2.371  15.773
  693   2HZ   LYS  85          2HZ       LYS  85   9.946  -2.654  16.771
  694    H    ALA  86           H        ALA  86   4.924  -5.359  11.146
  695    HA   ALA  86           HA       ALA  86   3.072  -6.278  13.006
  696   1HB   ALA  86          1HB       ALA  86   2.490  -4.434  11.633
  697   2HB   ALA  86          2HB       ALA  86   2.901  -5.309  10.138
  698   3HB   ALA  86          3HB       ALA  86   1.451  -5.763  11.066
  699    H    MET  87           H        MET  87   4.516  -7.770  10.109
  700    HA   MET  87           HA       MET  87   2.783 -10.070  10.579
  701   1HB   MET  87          1HB       MET  87   3.057 -10.600   8.226
  702   2HB   MET  87          2HB       MET  87   2.765  -8.873   8.285
  703   1HG   MET  87          1HG       MET  87   5.581  -9.157   8.574
  704   2HG   MET  87          2HG       MET  87   5.131 -10.306   7.330
  705   1HE   MET  87          1HE       MET  87   2.395  -8.277   5.892
  706   2HE   MET  87          2HE       MET  87   3.581  -8.520   4.587
  707   3HE   MET  87          3HE       MET  87   3.288  -9.812   5.776
  708    H    ARG  88           H        ARG  88   5.578  -9.055  11.710
  709    HA   ARG  88           HA       ARG  88   7.675  -9.854  11.832
  710   1HB   ARG  88          1HB       ARG  88   5.647 -11.429  13.273
  711   2HB   ARG  88          2HB       ARG  88   7.103 -12.368  13.010
  712   1HG   ARG  88          1HG       ARG  88   8.371 -10.220  13.860
  713   2HG   ARG  88          2HG       ARG  88   6.810  -9.731  14.487
  714   1HD   ARG  88          1HD       ARG  88   6.685 -11.578  15.986
  715   2HD   ARG  88          2HD       ARG  88   7.867 -12.512  15.091
  716    HE   ARG  88           HE       ARG  88   9.294 -10.268  15.889
  717   1HH1  ARG  88          2HH2      ARG  88   7.371 -12.697  17.608
  718   2HH1  ARG  88          1HH2      ARG  88   8.287 -12.567  19.072
  719   1HH2  ARG  88          1HH       ARG  88  10.124 -11.031  19.174
  720    H    LEU  89           H        LEU  89   8.278 -10.208   9.558
  721    HA   LEU  89           HA       LEU  89   8.207 -13.053   8.825
  722   1HB   LEU  89          1HB       LEU  89   6.927 -11.109   7.487
  723   2HB   LEU  89          2HB       LEU  89   8.501 -10.978   6.725
  724    HG   LEU  89           HG       LEU  89   8.410 -13.342   6.072
  725   1HD1  LEU  89          1HD1      LEU  89   6.273 -13.431   8.007
  726   2HD1  LEU  89          2HD1      LEU  89   5.709 -14.034   6.430
  727   3HD1  LEU  89          3HD1      LEU  89   7.136 -14.764   7.201
  728   1HD2  LEU  89          1HD2      LEU  89   7.404 -11.431   4.694
  729   2HD2  LEU  89          2HD2      LEU  89   6.937 -13.094   4.270
  730   3HD2  LEU  89          3HD2      LEU  89   5.821 -12.066   5.202
  731    H    ARG  90           H        ARG  90  10.030 -12.373   6.511
  732    HA   ARG  90           HA       ARG  90  12.385 -11.490   7.891
  733   1HB   ARG  90          1HB       ARG  90  13.595 -13.618   6.885
  734   2HB   ARG  90          2HB       ARG  90  12.741 -13.761   8.408
  735   1HG   ARG  90          1HG       ARG  90  10.723 -14.614   7.202
  736   2HG   ARG  90          2HG       ARG  90  11.566 -14.458   5.674
  737   1HD   ARG  90          1HD       ARG  90  13.394 -16.003   6.780
  738   2HD   ARG  90          2HD       ARG  90  12.149 -16.383   7.954
  739    HE   ARG  90           HE       ARG  90  12.263 -17.310   5.208
  740   1HH1  ARG  90          2HH2      ARG  90   9.995 -16.443   7.788
  741   2HH1  ARG  90          1HH2      ARG  90   8.721 -17.445   7.175
  742   1HH2  ARG  90          1HH       ARG  90   9.089 -18.723   5.182
  743    H    ILE  91           H        ILE  91  10.828 -12.830   4.922
  744    HA   ILE  91           HA       ILE  91  12.639 -12.371   3.008
  745    HB   ILE  91           HB       ILE  91  10.545 -11.574   1.647
  746   1HG1  ILE  91          1HG1      ILE  91   8.903 -12.946   3.679
  747   2HG1  ILE  91          2HG1      ILE  91   9.448 -11.349   4.150
  748   1HG2  ILE  91          1HG2      ILE  91  10.642 -13.676   0.946
  749   2HG2  ILE  91          2HG2      ILE  91  11.680 -14.056   2.340
  750   3HG2  ILE  91          3HG2      ILE  91   9.916 -14.265   2.460
  751   1HD1  ILE  91          1HD1      ILE  91   8.214 -10.283   2.514
  752   2HD1  ILE  91          2HD1      ILE  91   8.417 -11.613   1.349
  753   3HD1  ILE  91          3HD1      ILE  91   7.222 -11.753   2.659
  754    H    VAL  92           H        VAL  92  11.018  -9.942   5.004
  755    HA   VAL  92           HA       VAL  92  10.911  -7.679   4.704
  756    HB   VAL  92           HB       VAL  92  13.859  -8.320   4.924
  757   1HG1  VAL  92          1HG1      VAL  92  12.348  -5.786   5.018
  758   2HG1  VAL  92          2HG1      VAL  92  13.452  -6.044   6.390
  759   3HG1  VAL  92          3HG1      VAL  92  14.078  -6.084   4.724
  760   1HG2  VAL  92          1HG2      VAL  92  11.722  -8.953   6.658
  761   2HG2  VAL  92          2HG2      VAL  92  13.467  -9.063   6.990
  762   3HG2  VAL  92          3HG2      VAL  92  12.575  -7.578   7.401
  763    HA   PRO  93           HA       PRO  93  12.138  -7.597   0.289
  764   1HB   PRO  93          1HB       PRO  93   9.666  -7.649  -0.872
  765   2HB   PRO  93          2HB       PRO  93  10.662  -9.077  -0.673
  766   1HG   PRO  93          1HG       PRO  93   8.263  -8.261   0.852
  767   2HG   PRO  93          2HG       PRO  93   9.008  -9.843   0.741
  768   1HD   PRO  93          1HD       PRO  93   9.200  -8.007   2.936
  769   2HD   PRO  93          2HD       PRO  93  10.037  -9.538   2.774
  770    H    GLU  94           H        GLU  94  11.551  -5.950  -1.467
  771    HA   GLU  94           HA       GLU  94  11.586  -3.487  -0.141
  772   1HB   GLU  94          1HB       GLU  94  12.498  -4.267  -2.518
  773   2HB   GLU  94          2HB       GLU  94  10.929  -3.723  -3.077
  774   1HG   GLU  94          1HG       GLU  94  11.309  -1.475  -2.325
  775   2HG   GLU  94          2HG       GLU  94  12.653  -1.950  -1.306
  776    HE2  GLU  94           HE       GLU  94  13.343  -1.033  -5.077
  777    H    LEU  95           H        LEU  95   9.448  -4.200   1.085
  778    HA   LEU  95           HA       LEU  95   7.017  -4.039  -0.316
  779   1HB   LEU  95          1HB       LEU  95   7.822  -4.813   2.172
  780   2HB   LEU  95          2HB       LEU  95   7.038  -3.287   2.533
  781    HG   LEU  95           HG       LEU  95   5.180  -4.457   0.894
  782   1HD1  LEU  95          1HD1      LEU  95   5.702  -6.774   2.631
  783   2HD1  LEU  95          2HD1      LEU  95   5.156  -6.696   0.938
  784   3HD1  LEU  95          3HD1      LEU  95   6.888  -6.545   1.324
  785   1HD2  LEU  95          1HD2      LEU  95   4.400  -3.439   2.811
  786   2HD2  LEU  95          2HD2      LEU  95   4.113  -5.159   3.170
  787   3HD2  LEU  95          3HD2      LEU  95   5.520  -4.326   3.873
  788    H    THR  96           H        THR  96   7.097  -2.210  -1.703
  789    HA   THR  96           HA       THR  96   7.124   0.372  -0.290
  790    HB   THR  96           HB       THR  96   8.646  -0.535  -2.448
  791    HG1  THR  96           HG1      THR  96   8.862   1.919  -2.633
  792   1HG2  THR  96          1HG2      THR  96   6.519  -0.344  -3.892
  793   2HG2  THR  96          2HG2      THR  96   6.521   1.393  -3.507
  794   3HG2  THR  96          3HG2      THR  96   7.879   0.681  -4.411
  795    H    PHE  97           H        PHE  97   5.743   2.081  -1.590
  796    HA   PHE  97           HA       PHE  97   3.241   0.820  -2.413
  797   1HB   PHE  97          1HB       PHE  97   2.074   2.526  -0.934
  798   2HB   PHE  97          2HB       PHE  97   3.045   1.405  -0.002
  799    HD1  PHE  97           HD1      PHE  97   2.240   4.759  -0.402
  800    HD2  PHE  97           HD2      PHE  97   5.577   2.244   0.340
  801    HE1  PHE  97           HE1      PHE  97   3.462   6.687   0.640
  802    HE2  PHE  97           HE2      PHE  97   6.798   4.173   1.383
  803    HZ   PHE  97           HZ       PHE  97   5.726   6.371   1.520
  804    H    PHE  98           H        PHE  98   2.536   1.684  -4.308
  805    HA   PHE  98           HA       PHE  98   3.808   4.135  -5.198
  806   1HB   PHE  98          1HB       PHE  98   2.715   1.654  -6.295
  807   2HB   PHE  98          2HB       PHE  98   1.858   2.995  -7.030
  808    HD1  PHE  98           HD1      PHE  98   3.110   4.690  -8.344
  809    HD2  PHE  98           HD2      PHE  98   4.993   1.195  -6.847
  810    HE1  PHE  98           HE1      PHE  98   5.015   5.032  -9.941
  811    HE2  PHE  98           HE2      PHE  98   6.899   1.537  -8.444
  812    HZ   PHE  98           HZ       PHE  98   6.887   3.453  -9.973
  813    H    TYR  99           H        TYR  99   2.833   6.089  -4.980
  814    HA   TYR  99           HA       TYR  99   0.077   6.181  -4.155
  815   1HB   TYR  99          1HB       TYR  99   1.504   8.675  -4.946
  816   2HB   TYR  99          2HB       TYR  99   0.825   8.264  -3.384
  817    HD1  TYR  99           HD1      TYR  99   2.323   5.932  -2.514
  818    HD2  TYR  99           HD2      TYR  99   3.695   9.382  -4.640
  819    HE1  TYR  99           HE1      TYR  99   4.667   5.576  -1.596
  820    HE2  TYR  99           HE2      TYR  99   6.033   9.014  -3.715
  821    HH   TYR  99           HH       TYR  99   7.344   7.021  -2.880
  822    H    ASP 100           H        ASP 100  -1.376   5.730  -5.789
  823    HA   ASP 100           HA       ASP 100  -0.937   7.168  -8.280
  824   1HB   ASP 100          1HB       ASP 100  -1.641   4.486  -7.741
  825   2HB   ASP 100          2HB       ASP 100  -3.147   5.222  -8.249
  826    HD2  ASP 100           HD       ASP 100  -0.334   5.686 -11.024
  827    H    ASN 101           H        ASN 101  -1.894   9.207  -7.630
  828    HA   ASN 101           HA       ASN 101  -4.624   9.033  -6.660
  829   1HB   ASN 101          1HB       ASN 101  -3.141  11.656  -6.909
  830   2HB   ASN 101          2HB       ASN 101  -4.307  11.164  -5.696
  831   1HD2  ASN 101          1HD2      ASN 101  -1.274  12.030  -6.005
  832   2HD2  ASN 101          2HD2      ASN 101  -0.465  11.062  -4.818
  833    H    SER 102           H        SER 102  -5.654  11.499  -7.515
  834    HA   SER 102           HA       SER 102  -5.807  11.034 -10.353
  835   1HB   SER 102          1HB       SER 102  -7.943  11.766 -10.156
  836   2HB   SER 102          2HB       SER 102  -7.694  11.683  -8.424
  837    HG   SER 102           HG       SER 102  -8.487  13.795  -9.382
  838    H    LEU 103           H        LEU 103  -3.525  12.458  -8.697
  839    HA   LEU 103           HA       LEU 103  -3.608  15.036 -10.078
  840   1HB   LEU 103          1HB       LEU 103  -3.285  14.894  -7.586
  841   2HB   LEU 103          2HB       LEU 103  -1.738  14.128  -7.890
  842    HG   LEU 103           HG       LEU 103  -1.755  16.493  -9.444
  843   1HD1  LEU 103          1HD1      LEU 103  -2.821  16.953  -6.647
  844   2HD1  LEU 103          2HD1      LEU 103  -2.101  18.216  -7.673
  845   3HD1  LEU 103          3HD1      LEU 103  -3.591  17.392  -8.191
  846   1HD2  LEU 103          1HD2      LEU 103   0.277  15.691  -8.615
  847   2HD2  LEU 103          2HD2      LEU 103  -0.015  17.176  -7.678
  848   3HD2  LEU 103          3HD2      LEU 103  -0.333  15.585  -6.946
  849    H    VAL 104           H        VAL 104  -2.634  11.903 -10.627
  850    HA   VAL 104           HA       VAL 104  -0.435  12.852 -12.321
  851    HB   VAL 104           HB       VAL 104  -0.470  10.727 -10.257
  852   1HG1  VAL 104          1HG1      VAL 104   1.277   9.416 -11.474
  853   2HG1  VAL 104          2HG1      VAL 104  -0.344   9.311 -12.206
  854   3HG1  VAL 104          3HG1      VAL 104   0.899  10.354 -12.940
  855   1HG2  VAL 104          1HG2      VAL 104   1.449  11.704  -9.612
  856   2HG2  VAL 104          2HG2      VAL 104   2.087  11.769 -11.272
  857   3HG2  VAL 104          3HG2      VAL 104   0.969  13.029 -10.698
  858    H    GLU 105           H        GLU 105  -3.525  11.611 -12.109
  859    HA   GLU 105           HA       GLU 105  -3.234  10.478 -14.760
  860   1HB   GLU 105          1HB       GLU 105  -4.907   9.122 -12.605
  861   2HB   GLU 105          2HB       GLU 105  -4.611   8.539 -14.231
  862   1HG   GLU 105          1HG       GLU 105  -2.024   8.950 -13.189
  863   2HG   GLU 105          2HG       GLU 105  -2.922   8.304 -11.830
  864    HE2  GLU 105           HE       GLU 105  -0.933   7.070 -13.500
  865    H    GLY 106           H        GLY 106  -5.286  11.808 -12.133
  866   1HA   GLY 106          1HA       GLY 106  -6.938  13.369 -12.332
  867   2HA   GLY 106          2HA       GLY 106  -6.858  13.256 -14.079
  868    H    MET 107           H        MET 107  -7.041  10.213 -12.340
  869    HA   MET 107           HA       MET 107  -9.896  10.158 -12.368
  870   1HB   MET 107          1HB       MET 107 -10.184   8.559 -14.110
  871   2HB   MET 107          2HB       MET 107  -8.942   9.601 -14.775
  872   1HG   MET 107          1HG       MET 107  -7.407   7.781 -13.355
  873   2HG   MET 107          2HG       MET 107  -8.747   6.772 -13.862
  874   1HE   MET 107          1HE       MET 107  -5.415   8.680 -16.014
  875   2HE   MET 107          2HE       MET 107  -6.773   9.789 -16.324
  876   3HE   MET 107          3HE       MET 107  -6.334   9.363 -14.651
  877    H    ARG 108           H        ARG 108  -7.676   9.886 -10.416
  878    HA   ARG 108           HA       ARG 108  -8.246   7.144  -9.622
  879   1HB   ARG 108          1HB       ARG 108  -5.669   8.533  -9.939
  880   2HB   ARG 108          2HB       ARG 108  -5.852   7.906  -8.312
  881   1HG   ARG 108          1HG       ARG 108  -5.180   5.903  -9.158
  882   2HG   ARG 108          2HG       ARG 108  -6.780   5.784  -9.860
  883   1HD   ARG 108          1HD       ARG 108  -5.799   7.163 -11.860
  884   2HD   ARG 108          2HD       ARG 108  -4.227   6.771 -11.189
  885    HE   ARG 108           HE       ARG 108  -4.483   4.570 -11.939
  886   1HH1  ARG 108          2HH2      ARG 108  -7.665   6.128 -11.893
  887   2HH1  ARG 108          1HH2      ARG 108  -8.464   4.802 -12.671
  888   1HH2  ARG 108          1HH       ARG 108  -7.192   2.866 -13.290
  Start of MODEL   12
    1    H    MET   1           H        MET   1  -7.596 -10.068  -2.086
    2    HA   MET   1           HA       MET   1  -9.555  -8.020  -1.624
    3   1HB   MET   1          1HB       MET   1  -7.918  -8.265  -3.661
    4   2HB   MET   1          2HB       MET   1  -8.989  -9.533  -4.223
    5   1HG   MET   1          1HG       MET   1 -10.900  -7.737  -3.896
    6   2HG   MET   1          2HG       MET   1  -9.589  -6.575  -3.888
    7   1HE   MET   1          1HE       MET   1 -10.961  -5.979  -7.271
    8   2HE   MET   1          2HE       MET   1 -12.055  -7.258  -6.690
    9   3HE   MET   1          3HE       MET   1 -11.476  -6.004  -5.567
   10    H    ALA   2           H        ALA   2  -9.598 -11.224  -3.361
   11    HA   ALA   2           HA       ALA   2 -11.662 -12.345  -1.935
   12   1HB   ALA   2          1HB       ALA   2 -13.603 -11.499  -2.713
   13   2HB   ALA   2          2HB       ALA   2 -12.636 -10.161  -3.380
   14   3HB   ALA   2          3HB       ALA   2 -13.041 -11.561  -4.400
   15    H    LYS   3           H        LYS   3  -9.506 -13.566  -2.668
   16    HA   LYS   3           HA       LYS   3 -10.383 -15.320  -4.798
   17   1HB   LYS   3          1HB       LYS   3  -8.353 -13.310  -5.211
   18   2HB   LYS   3          2HB       LYS   3  -7.632 -14.903  -5.319
   19   1HG   LYS   3          1HG       LYS   3  -9.595 -15.551  -6.864
   20   2HG   LYS   3          2HG       LYS   3 -10.018 -13.850  -6.900
   21   1HD   LYS   3          1HD       LYS   3  -8.376 -13.390  -8.402
   22   2HD   LYS   3          2HD       LYS   3  -7.161 -14.170  -7.408
   23   1HE   LYS   3          1HE       LYS   3  -7.327 -16.193  -8.529
   24   2HE   LYS   3          2HE       LYS   3  -9.046 -16.015  -8.824
   25   1HZ   LYS   3          1HZ       LYS   3  -7.215 -14.185 -10.212
   26   2HZ   LYS   3          2HZ       LYS   3  -7.339 -15.710 -10.769
   27    H    GLU   4           H        GLU   4 -10.654 -16.999  -3.338
   28    HA   GLU   4           HA       GLU   4  -8.311 -17.620  -1.727
   29   1HB   GLU   4          1HB       GLU   4 -10.520 -17.280  -0.555
   30   2HB   GLU   4          2HB       GLU   4 -11.164 -18.656  -1.428
   31   1HG   GLU   4          1HG       GLU   4  -9.176 -20.013  -0.460
   32   2HG   GLU   4          2HG       GLU   4  -8.893 -18.649   0.603
   33    HE2  GLU   4           HE       GLU   4 -10.218 -21.487   1.042
   34    H    PHE   5           H        PHE   5  -7.079 -18.662  -3.393
   35    HA   PHE   5           HA       PHE   5  -8.118 -21.312  -4.038
   36   1HB   PHE   5          1HB       PHE   5  -8.447 -19.647  -5.955
   37   2HB   PHE   5          2HB       PHE   5  -6.727 -19.316  -5.924
   38    HD1  PHE   5           HD1      PHE   5  -7.898 -22.728  -5.375
   39    HD2  PHE   5           HD2      PHE   5  -6.533 -19.948  -8.275
   40    HE1  PHE   5           HE1      PHE   5  -7.509 -24.608  -6.993
   41    HE2  PHE   5           HE2      PHE   5  -6.144 -21.827  -9.894
   42    HZ   PHE   5           HZ       PHE   5  -6.636 -24.134  -9.233
   43    H    GLY   6           H        GLY   6  -6.581 -22.942  -3.934
   44   1HA   GLY   6          1HA       GLY   6  -4.361 -22.780  -2.434
   45   2HA   GLY   6          2HA       GLY   6  -4.539 -23.911  -3.760
   46    H    ARG   7           H        ARG   7  -4.742 -21.564  -5.746
   47    HA   ARG   7           HA       ARG   7  -2.126 -21.589  -6.532
   48   1HB   ARG   7          1HB       ARG   7  -4.613 -20.310  -7.349
   49   2HB   ARG   7          2HB       ARG   7  -3.300 -19.160  -7.507
   50   1HG   ARG   7          1HG       ARG   7  -1.994 -20.860  -8.821
   51   2HG   ARG   7          2HG       ARG   7  -3.336 -21.978  -8.691
   52   1HD   ARG   7          1HD       ARG   7  -4.335 -21.022 -10.490
   53   2HD   ARG   7          2HD       ARG   7  -4.401 -19.482  -9.655
   54    HE   ARG   7           HE       ARG   7  -1.747 -19.715 -10.532
   55   1HH1  ARG   7          2HH2      ARG   7  -4.938 -19.671 -12.072
   56   2HH1  ARG   7          1HH2      ARG   7  -4.352 -18.990 -13.553
   57   1HH2  ARG   7          1HH       ARG   7  -2.016 -18.495 -13.773
   58    HA   PRO   8           HA       PRO   8  -0.256 -18.185  -4.516
   59   1HB   PRO   8          1HB       PRO   8   0.911 -16.630  -6.436
   60   2HB   PRO   8          2HB       PRO   8   1.599 -18.142  -5.878
   61   1HG   PRO   8          1HG       PRO   8   0.192 -17.570  -8.414
   62   2HG   PRO   8          2HG       PRO   8   1.240 -18.918  -8.020
   63   1HD   PRO   8          1HD       PRO   8  -1.624 -18.957  -8.169
   64   2HD   PRO   8          2HD       PRO   8  -0.584 -20.272  -7.662
   65    H    GLN   9           H        GLN   9  -3.019 -17.708  -6.063
   66    HA   GLN   9           HA       GLN   9  -3.059 -14.873  -5.966
   67   1HB   GLN   9          1HB       GLN   9  -4.686 -16.972  -7.049
   68   2HB   GLN   9          2HB       GLN   9  -5.715 -16.019  -5.997
   69   1HG   GLN   9          1HG       GLN   9  -5.645 -15.160  -8.365
   70   2HG   GLN   9          2HG       GLN   9  -5.162 -13.962  -7.181
   71   1HE2  GLN   9          1HE2      GLN   9  -3.851 -12.740  -8.392
   72   2HE2  GLN   9          2HE2      GLN   9  -2.367 -13.264  -9.114
   73    H    ARG  10           H        ARG  10  -4.248 -17.593  -3.921
   74    HA   ARG  10           HA       ARG  10  -5.772 -16.143  -2.196
   75   1HB   ARG  10          1HB       ARG  10  -5.542 -18.665  -2.277
   76   2HB   ARG  10          2HB       ARG  10  -3.979 -18.523  -1.498
   77   1HG   ARG  10          1HG       ARG  10  -6.117 -17.056  -0.066
   78   2HG   ARG  10          2HG       ARG  10  -6.433 -18.776  -0.188
   79   1HD   ARG  10          1HD       ARG  10  -3.628 -18.070   0.557
   80   2HD   ARG  10          2HD       ARG  10  -4.839 -17.630   1.746
   81    HE   ARG  10           HE       ARG  10  -5.244 -20.339   0.765
   82   1HH1  ARG  10          2HH2      ARG  10  -3.328 -18.410   3.036
   83   2HH1  ARG  10          1HH2      ARG  10  -3.005 -19.745   4.091
   84   1HH2  ARG  10          1HH       ARG  10  -3.891 -21.907   3.553
   85    H    VAL  11           H        VAL  11  -2.289 -17.146  -1.777
   86    HA   VAL  11           HA       VAL  11  -1.816 -15.780   0.564
   87    HB   VAL  11           HB       VAL  11  -0.427 -17.421  -1.053
   88   1HG1  VAL  11          1HG1      VAL  11   1.498 -16.339  -2.003
   89   2HG1  VAL  11          2HG1      VAL  11   0.044 -15.531  -2.638
   90   3HG1  VAL  11          3HG1      VAL  11   0.999 -14.760  -1.349
   91   1HG2  VAL  11          1HG2      VAL  11   1.579 -16.851   0.430
   92   2HG2  VAL  11          2HG2      VAL  11   0.549 -15.590   1.149
   93   3HG2  VAL  11          3HG2      VAL  11   0.067 -17.300   1.255
   94    H    ALA  12           H        ALA  12  -1.742 -14.645  -2.850
   95    HA   ALA  12           HA       ALA  12  -0.620 -12.141  -2.326
   96   1HB   ALA  12          1HB       ALA  12  -0.658 -12.261  -4.569
   97   2HB   ALA  12          2HB       ALA  12  -1.833 -13.598  -4.522
   98   3HB   ALA  12          3HB       ALA  12  -2.403 -11.912  -4.512
   99    H    GLN  13           H        GLN  13  -3.989 -13.391  -2.207
  100    HA   GLN  13           HA       GLN  13  -5.141 -10.861  -1.873
  101   1HB   GLN  13          1HB       GLN  13  -6.132 -13.664  -1.205
  102   2HB   GLN  13          2HB       GLN  13  -7.132 -12.235  -1.047
  103   1HG   GLN  13          1HG       GLN  13  -6.131 -13.591  -3.531
  104   2HG   GLN  13          2HG       GLN  13  -7.694 -12.862  -3.216
  105   1HE2  GLN  13          1HE2      GLN  13  -4.293 -12.207  -3.865
  106   2HE2  GLN  13          2HE2      GLN  13  -4.486 -10.641  -4.581
  107    H    GLU  14           H        GLU  14  -4.735 -13.578   0.525
  108    HA   GLU  14           HA       GLU  14  -5.491 -12.346   2.743
  109   1HB   GLU  14          1HB       GLU  14  -3.886 -14.607   2.090
  110   2HB   GLU  14          2HB       GLU  14  -3.000 -13.735   3.323
  111   1HG   GLU  14          1HG       GLU  14  -5.202 -13.632   4.661
  112   2HG   GLU  14          2HG       GLU  14  -5.870 -14.755   3.493
  113    HE2  GLU  14           HE       GLU  14  -4.521 -17.385   5.253
  114    H    MET  15           H        MET  15  -2.295 -11.948   1.118
  115    HA   MET  15           HA       MET  15  -1.302 -10.259   3.147
  116   1HB   MET  15          1HB       MET  15  -0.409 -11.495   0.654
  117   2HB   MET  15          2HB       MET  15   0.049  -9.805   0.639
  118   1HG   MET  15          1HG       MET  15   0.688 -10.618   3.253
  119   2HG   MET  15          2HG       MET  15   1.112 -12.015   2.284
  120   1HE   MET  15          1HE       MET  15   4.103 -11.736   2.106
  121   2HE   MET  15          2HE       MET  15   4.398 -10.228   3.005
  122   3HE   MET  15          3HE       MET  15   3.155 -11.372   3.567
  123    H    GLN  16           H        GLN  16  -2.998  -9.799   0.022
  124    HA   GLN  16           HA       GLN  16  -2.497  -7.079  -0.204
  125   1HB   GLN  16          1HB       GLN  16  -3.396  -8.664  -1.989
  126   2HB   GLN  16          2HB       GLN  16  -4.960  -8.571  -1.204
  127   1HG   GLN  16          1HG       GLN  16  -3.955  -5.875  -1.545
  128   2HG   GLN  16          2HG       GLN  16  -3.800  -6.717  -3.075
  129   1HE2  GLN  16          1HE2      GLN  16  -5.410  -5.096  -3.696
  130   2HE2  GLN  16          2HE2      GLN  16  -7.093  -5.439  -3.479
  131    H    LYS  17           H        LYS  17  -4.940  -8.965   1.599
  132    HA   LYS  17           HA       LYS  17  -6.518  -6.668   2.230
  133   1HB   LYS  17          1HB       LYS  17  -7.813  -8.196   3.579
  134   2HB   LYS  17          2HB       LYS  17  -7.477  -8.927   2.023
  135   1HG   LYS  17          1HG       LYS  17  -5.864 -10.424   2.922
  136   2HG   LYS  17          2HG       LYS  17  -5.609  -9.445   4.355
  137   1HD   LYS  17          1HD       LYS  17  -8.414 -10.354   4.061
  138   2HD   LYS  17          2HD       LYS  17  -7.275 -11.682   4.185
  139   1HE   LYS  17          1HE       LYS  17  -6.276 -10.217   6.195
  140   2HE   LYS  17          2HE       LYS  17  -7.876  -9.503   6.195
  141   1HZ   LYS  17          1HZ       LYS  17  -8.758 -11.840   6.330
  142   2HZ   LYS  17          2HZ       LYS  17  -7.238 -12.380   6.551
  143    H    GLU  18           H        GLU  18  -3.871  -8.552   3.747
  144    HA   GLU  18           HA       GLU  18  -4.090  -7.260   6.224
  145   1HB   GLU  18          1HB       GLU  18  -2.946  -9.482   5.751
  146   2HB   GLU  18          2HB       GLU  18  -1.625  -8.591   5.022
  147   1HG   GLU  18          1HG       GLU  18  -0.914  -8.930   7.264
  148   2HG   GLU  18          2HG       GLU  18  -1.477  -7.272   7.248
  149    HE2  GLU  18           HE       GLU  18  -2.251  -7.123   9.229
  150    H    ILE  19           H        ILE  19  -2.338  -6.582   3.180
  151    HA   ILE  19           HA       ILE  19  -0.811  -4.461   4.372
  152    HB   ILE  19           HB       ILE  19   0.160  -4.197   2.241
  153   1HG1  ILE  19          1HG1      ILE  19  -2.212  -5.737   1.170
  154   2HG1  ILE  19          2HG1      ILE  19  -1.746  -4.088   0.806
  155   1HG2  ILE  19          1HG2      ILE  19   1.317  -6.033   2.704
  156   2HG2  ILE  19          2HG2      ILE  19  -0.100  -6.806   3.455
  157   3HG2  ILE  19          3HG2      ILE  19   0.167  -6.948   1.700
  158   1HD1  ILE  19          1HD1      ILE  19  -0.547  -6.666  -0.172
  159   2HD1  ILE  19          2HD1      ILE  19  -0.854  -5.152  -1.054
  160   3HD1  ILE  19          3HD1      ILE  19   0.544  -5.274   0.040
  161    H    ALA  20           H        ALA  20  -3.768  -4.857   2.370
  162    HA   ALA  20           HA       ALA  20  -4.121  -2.141   1.803
  163   1HB   ALA  20          1HB       ALA  20  -5.320  -3.733   0.514
  164   2HB   ALA  20          2HB       ALA  20  -5.958  -4.548   1.962
  165   3HB   ALA  20          3HB       ALA  20  -6.558  -2.933   1.512
  166    H    LEU  21           H        LEU  21  -4.856  -4.168   4.645
  167    HA   LEU  21           HA       LEU  21  -6.529  -2.192   5.851
  168   1HB   LEU  21          1HB       LEU  21  -6.958  -4.456   6.358
  169   2HB   LEU  21          2HB       LEU  21  -5.285  -4.774   6.773
  170    HG   LEU  21           HG       LEU  21  -6.194  -2.714   8.515
  171   1HD1  LEU  21          1HD1      LEU  21  -7.986  -4.979   9.093
  172   2HD1  LEU  21          2HD1      LEU  21  -8.251  -3.225   9.246
  173   3HD1  LEU  21          3HD1      LEU  21  -8.433  -4.017   7.662
  174   1HD2  LEU  21          1HD2      LEU  21  -5.870  -4.573  10.229
  175   2HD2  LEU  21          2HD2      LEU  21  -5.443  -5.618   8.853
  176   3HD2  LEU  21          3HD2      LEU  21  -4.476  -4.165   9.202
  177    H    ILE  22           H        ILE  22  -3.193  -3.463   6.545
  178    HA   ILE  22           HA       ILE  22  -2.616  -1.571   8.496
  179    HB   ILE  22           HB       ILE  22  -0.913  -3.252   6.671
  180   1HG1  ILE  22          1HG1      ILE  22  -1.380  -3.450   9.656
  181   2HG1  ILE  22          2HG1      ILE  22  -2.348  -4.303   8.471
  182   1HG2  ILE  22          1HG2      ILE  22   0.707  -2.470   8.787
  183   2HG2  ILE  22          2HG2      ILE  22   0.824  -1.928   7.096
  184   3HG2  ILE  22          3HG2      ILE  22  -0.098  -0.966   8.277
  185   1HD1  ILE  22          1HD1      ILE  22   0.661  -4.571   8.901
  186   2HD1  ILE  22          2HD1      ILE  22  -0.586  -5.802   9.218
  187   3HD1  ILE  22          3HD1      ILE  22  -0.215  -5.322   7.545
  188    H    LEU  23           H        LEU  23  -2.809  -1.338   5.001
  189    HA   LEU  23           HA       LEU  23  -1.245   1.099   4.956
  190   1HB   LEU  23          1HB       LEU  23  -1.102  -0.634   3.180
  191   2HB   LEU  23          2HB       LEU  23  -2.766  -0.295   2.750
  192    HG   LEU  23           HG       LEU  23  -1.208   2.152   2.776
  193   1HD1  LEU  23          1HD1      LEU  23   0.517   0.235   2.216
  194   2HD1  LEU  23          2HD1      LEU  23  -0.261   0.312   0.615
  195   3HD1  LEU  23          3HD1      LEU  23   0.504   1.765   1.305
  196   1HD2  LEU  23          1HD2      LEU  23  -3.420   1.734   1.675
  197   2HD2  LEU  23          2HD2      LEU  23  -2.191   2.478   0.624
  198   3HD2  LEU  23          3HD2      LEU  23  -2.566   0.746   0.465
  199    H    GLN  24           H        GLN  24  -4.499   0.068   5.529
  200    HA   GLN  24           HA       GLN  24  -5.441   2.747   4.880
  201   1HB   GLN  24          1HB       GLN  24  -6.771   0.042   4.963
  202   2HB   GLN  24          2HB       GLN  24  -7.751   1.457   5.294
  203   1HG   GLN  24          1HG       GLN  24  -6.459   2.358   3.076
  204   2HG   GLN  24          2HG       GLN  24  -6.390   0.639   2.744
  205   1HE2  GLN  24          1HE2      GLN  24  -7.864   0.296   1.246
  206   2HE2  GLN  24          2HE2      GLN  24  -9.540   0.723   1.326
  207    H    ARG  25           H        ARG  25  -4.274   0.899   7.425
  208    HA   ARG  25           HA       ARG  25  -6.003   2.298   9.303
  209   1HB   ARG  25          1HB       ARG  25  -5.715  -0.384   9.201
  210   2HB   ARG  25          2HB       ARG  25  -4.290  -0.039  10.161
  211   1HG   ARG  25          1HG       ARG  25  -6.808   1.346  11.012
  212   2HG   ARG  25          2HG       ARG  25  -6.780  -0.391  11.235
  213   1HD   ARG  25          1HD       ARG  25  -4.764  -0.265  12.605
  214   2HD   ARG  25          2HD       ARG  25  -4.527   1.425  12.208
  215    HE   ARG  25           HE       ARG  25  -7.098   1.274  13.344
  216   1HH1  ARG  25          2HH2      ARG  25  -3.785   0.570  14.385
  217   2HH1  ARG  25          1HH2      ARG  25  -4.107   0.900  16.054
  218   1HH2  ARG  25          1HH       ARG  25  -6.312   1.567  16.714
  219    H    GLU  26           H        GLU  26  -2.645   0.925   8.929
  220    HA   GLU  26           HA       GLU  26  -1.583   2.546  10.941
  221   1HB   GLU  26          1HB       GLU  26   0.310   1.326  10.583
  222   2HB   GLU  26          2HB       GLU  26  -0.722   0.341   9.566
  223   1HG   GLU  26          1HG       GLU  26   1.046   0.815   8.102
  224   2HG   GLU  26          2HG       GLU  26  -0.103   2.065   7.667
  225    HE2  GLU  26           HE       GLU  26   2.605   3.212  10.339
  226    H    ILE  27           H        ILE  27  -2.482   3.149   7.637
  227    HA   ILE  27           HA       ILE  27  -0.627   5.345   7.328
  228    HB   ILE  27           HB       ILE  27  -1.807   3.600   5.594
  229   1HG1  ILE  27          1HG1      ILE  27  -0.333   6.184   5.329
  230   2HG1  ILE  27          2HG1      ILE  27   0.156   4.561   4.887
  231   1HG2  ILE  27          1HG2      ILE  27  -3.253   6.243   5.276
  232   2HG2  ILE  27          2HG2      ILE  27  -3.327   4.855   4.167
  233   3HG2  ILE  27          3HG2      ILE  27  -3.985   4.713   5.813
  234   1HD1  ILE  27          1HD1      ILE  27  -1.678   4.652   3.066
  235   2HD1  ILE  27          2HD1      ILE  27  -1.764   6.397   3.407
  236   3HD1  ILE  27          3HD1      ILE  27  -0.248   5.679   2.813
  237    H    LYS  28           H        LYS  28  -1.862   7.435   6.307
  238    HA   LYS  28           HA       LYS  28  -3.674   8.223   8.456
  239   1HB   LYS  28          1HB       LYS  28  -3.153  10.540   7.618
  240   2HB   LYS  28          2HB       LYS  28  -1.799   9.658   8.294
  241   1HG   LYS  28          1HG       LYS  28  -2.129   9.186   5.393
  242   2HG   LYS  28          2HG       LYS  28  -1.868  10.877   5.775
  243   1HD   LYS  28          1HD       LYS  28   0.313  10.529   6.347
  244   2HD   LYS  28          2HD       LYS  28  -0.074   9.124   7.319
  245   1HE   LYS  28          1HE       LYS  28  -0.515   8.113   4.795
  246   2HE   LYS  28          2HE       LYS  28   0.752   9.275   4.454
  247   1HZ   LYS  28          1HZ       LYS  28   1.034   7.368   6.696
  248   2HZ   LYS  28          2HZ       LYS  28   1.462   6.942   5.185
  249    H    ASP  29           H        ASP  29  -5.405   6.852   7.460
  250    HA   ASP  29           HA       ASP  29  -6.361   7.735   4.926
  251   1HB   ASP  29          1HB       ASP  29  -7.182   5.625   5.000
  252   2HB   ASP  29          2HB       ASP  29  -6.741   5.478   6.690
  253    HD2  ASP  29           HD       ASP  29  -8.494   4.382   7.188
  254    HA   PRO  30           HA       PRO  30  -9.723   9.355   7.911
  255   1HB   PRO  30          1HB       PRO  30  -9.323   9.229  10.611
  256   2HB   PRO  30          2HB       PRO  30 -10.226   8.021   9.718
  257   1HG   PRO  30          1HG       PRO  30  -7.492   7.845  10.827
  258   2HG   PRO  30          2HG       PRO  30  -8.555   6.549  10.322
  259   1HD   PRO  30          1HD       PRO  30  -6.301   7.579   8.880
  260   2HD   PRO  30          2HD       PRO  30  -7.434   6.364   8.323
  261    H    ARG  31           H        ARG  31  -6.410   9.884   8.511
  262    HA   ARG  31           HA       ARG  31  -6.771  12.388   9.724
  263   1HB   ARG  31          1HB       ARG  31  -4.576  10.647   8.993
  264   2HB   ARG  31          2HB       ARG  31  -4.220  12.246   8.373
  265   1HG   ARG  31          1HG       ARG  31  -4.399  13.253  10.556
  266   2HG   ARG  31          2HG       ARG  31  -5.178  11.837  11.234
  267   1HD   ARG  31          1HD       ARG  31  -3.056  10.519  10.824
  268   2HD   ARG  31          2HD       ARG  31  -2.286  11.985  10.249
  269    HE   ARG  31           HE       ARG  31  -3.489  12.327  12.887
  270   1HH1  ARG  31          2HH2      ARG  31  -0.603  11.171  11.190
  271   2HH1  ARG  31          1HH2      ARG  31   0.440  11.390  12.557
  272   1HH2  ARG  31          1HH       ARG  31  -0.471  12.240  14.604
  273    H    LEU  32           H        LEU  32  -6.607  11.172   6.394
  274    HA   LEU  32           HA       LEU  32  -6.603  13.941   5.419
  275   1HB   LEU  32          1HB       LEU  32  -5.540  11.372   4.327
  276   2HB   LEU  32          2HB       LEU  32  -6.103  12.595   3.203
  277    HG   LEU  32           HG       LEU  32  -4.536  14.203   4.540
  278   1HD1  LEU  32          1HD1      LEU  32  -3.738  11.514   5.557
  279   2HD1  LEU  32          2HD1      LEU  32  -2.452  12.695   5.205
  280   3HD1  LEU  32          3HD1      LEU  32  -3.739  13.100   6.367
  281   1HD2  LEU  32          1HD2      LEU  32  -2.654  13.617   3.064
  282   2HD2  LEU  32          2HD2      LEU  32  -3.458  12.078   2.666
  283   3HD2  LEU  32          3HD2      LEU  32  -4.215  13.622   2.205
  284    H    GLY  33           H        GLY  33  -8.879  12.378   6.634
  285   1HA   GLY  33          1HA       GLY  33 -10.992  11.702   6.129
  286   2HA   GLY  33          2HA       GLY  33 -10.998  13.224   5.263
  287    H    MET  34           H        MET  34  -8.927  10.441   4.362
  288    HA   MET  34           HA       MET  34 -10.692  10.014   2.080
  289   1HB   MET  34          1HB       MET  34  -7.682  10.470   2.202
  290   2HB   MET  34          2HB       MET  34  -8.345   9.500   0.901
  291   1HG   MET  34          1HG       MET  34  -9.808  11.363   0.194
  292   2HG   MET  34          2HG       MET  34  -9.295  12.328   1.564
  293   1HE   MET  34          1HE       MET  34  -7.470  14.536   0.072
  294   2HE   MET  34          2HE       MET  34  -7.934  13.788   1.618
  295   3HE   MET  34          3HE       MET  34  -6.236  13.748   1.084
  296    H    MET  35           H        MET  35 -10.757   7.838   1.247
  297    HA   MET  35           HA       MET  35  -9.674   5.929   3.165
  298   1HB   MET  35          1HB       MET  35 -12.282   6.313   2.152
  299   2HB   MET  35          2HB       MET  35 -11.692   4.957   1.210
  300   1HG   MET  35          1HG       MET  35 -12.442   3.745   3.026
  301   2HG   MET  35          2HG       MET  35 -10.857   4.137   3.665
  302   1HE   MET  35          1HE       MET  35 -13.646   3.906   6.093
  303   2HE   MET  35          2HE       MET  35 -12.042   3.335   5.574
  304   3HE   MET  35          3HE       MET  35 -12.178   4.579   6.840
  305    H    THR  36           H        THR  36  -7.554   6.128   1.981
  306    HA   THR  36           HA       THR  36  -7.006   5.720  -0.597
  307    HB   THR  36           HB       THR  36  -4.927   4.566   0.248
  308    HG1  THR  36           HG1      THR  36  -6.428   4.770   2.760
  309   1HG2  THR  36          1HG2      THR  36  -5.617   6.549   2.421
  310   2HG2  THR  36          2HG2      THR  36  -4.108   6.382   1.491
  311   3HG2  THR  36          3HG2      THR  36  -5.534   7.144   0.746
  312    H    THR  37           H        THR  37  -6.679   4.009  -2.073
  313    HA   THR  37           HA       THR  37  -7.993   1.494  -1.295
  314    HB   THR  37           HB       THR  37  -8.519   3.352  -3.644
  315    HG1  THR  37           HG1      THR  37 -10.136   1.596  -1.940
  316   1HG2  THR  37          1HG2      THR  37  -8.050   0.970  -4.507
  317   2HG2  THR  37          2HG2      THR  37  -9.389   0.425  -3.469
  318   3HG2  THR  37          3HG2      THR  37  -9.702   1.567  -4.798
  319    H    VAL  38           H        VAL  38  -7.366  -0.377  -2.623
  320    HA   VAL  38           HA       VAL  38  -4.653   0.011  -3.685
  321    HB   VAL  38           HB       VAL  38  -5.840  -2.251  -2.073
  322   1HG1  VAL  38          1HG1      VAL  38  -4.427  -3.034  -4.021
  323   2HG1  VAL  38          2HG1      VAL  38  -3.056  -2.181  -3.270
  324   3HG1  VAL  38          3HG1      VAL  38  -3.849  -3.524  -2.411
  325   1HG2  VAL  38          1HG2      VAL  38  -3.254  -0.949  -1.372
  326   2HG2  VAL  38          2HG2      VAL  38  -4.732   0.014  -1.135
  327   3HG2  VAL  38          3HG2      VAL  38  -4.555  -1.561  -0.323
  328    H    SER  39           H        SER  39  -5.414   0.356  -5.834
  329    HA   SER  39           HA       SER  39  -7.093  -1.696  -6.942
  330   1HB   SER  39          1HB       SER  39  -6.708   1.040  -7.453
  331   2HB   SER  39          2HB       SER  39  -5.972   0.257  -8.837
  332    HG   SER  39           HG       SER  39  -8.640   0.547  -8.218
  333    H    GLY  40           H        GLY  40  -4.141  -2.039  -6.004
  334   1HA   GLY  40          1HA       GLY  40  -3.347  -3.770  -8.134
  335   2HA   GLY  40          2HA       GLY  40  -2.374  -2.313  -8.089
  336    H    VAL  41           H        VAL  41  -2.007  -5.349  -7.307
  337    HA   VAL  41           HA       VAL  41  -0.445  -4.726  -4.942
  338    HB   VAL  41           HB       VAL  41  -2.525  -5.412  -3.978
  339   1HG1  VAL  41          1HG1      VAL  41  -3.880  -6.618  -5.313
  340   2HG1  VAL  41          2HG1      VAL  41  -2.521  -7.364  -6.188
  341   3HG1  VAL  41          3HG1      VAL  41  -3.042  -8.027  -4.620
  342   1HG2  VAL  41          1HG2      VAL  41  -0.165  -6.462  -3.299
  343   2HG2  VAL  41          2HG2      VAL  41  -1.677  -6.914  -2.477
  344   3HG2  VAL  41          3HG2      VAL  41  -1.001  -7.970  -3.740
  345    H    GLU  42           H        GLU  42   1.565  -5.545  -5.228
  346    HA   GLU  42           HA       GLU  42   1.774  -8.000  -6.753
  347   1HB   GLU  42          1HB       GLU  42   3.441  -5.504  -7.303
  348   2HB   GLU  42          2HB       GLU  42   3.698  -7.070  -8.046
  349   1HG   GLU  42          1HG       GLU  42   2.112  -6.636  -9.606
  350   2HG   GLU  42          2HG       GLU  42   0.908  -6.387  -8.359
  351    HE2  GLU  42           HE       GLU  42   0.527  -4.758 -10.287
  352    H    MET  43           H        MET  43   3.028  -9.458  -5.666
  353    HA   MET  43           HA       MET  43   4.952  -8.328  -3.783
  354   1HB   MET  43          1HB       MET  43   3.885 -11.070  -3.243
  355   2HB   MET  43          2HB       MET  43   4.164  -9.756  -2.117
  356   1HG   MET  43          1HG       MET  43   1.816  -9.914  -4.071
  357   2HG   MET  43          2HG       MET  43   1.727 -10.297  -2.364
  358   1HE   MET  43          1HE       MET  43   2.397  -8.543  -0.453
  359   2HE   MET  43          2HE       MET  43   1.413  -7.066  -0.590
  360   3HE   MET  43          3HE       MET  43   0.670  -8.660  -0.872
  361    H    SER  44           H        SER  44   6.939  -8.634  -4.725
  362    HA   SER  44           HA       SER  44   7.340 -11.167  -6.093
  363   1HB   SER  44          1HB       SER  44   8.712  -8.465  -6.258
  364   2HB   SER  44          2HB       SER  44   9.500  -9.903  -6.876
  365    HG   SER  44           HG       SER  44   7.022 -10.009  -7.857
  366    H    ARG  45           H        ARG  45   8.122 -12.708  -4.683
  367    HA   ARG  45           HA       ARG  45   9.948 -11.791  -2.636
  368   1HB   ARG  45          1HB       ARG  45   8.092 -14.131  -2.960
  369   2HB   ARG  45          2HB       ARG  45   9.560 -14.438  -2.055
  370   1HG   ARG  45          1HG       ARG  45   8.557 -13.513  -0.245
  371   2HG   ARG  45          2HG       ARG  45   8.643 -11.961  -1.055
  372   1HD   ARG  45          1HD       ARG  45   6.305 -12.631  -0.294
  373   2HD   ARG  45          2HD       ARG  45   6.425 -12.212  -1.990
  374    HE   ARG  45           HE       ARG  45   5.975 -14.447  -2.567
  375   1HH1  ARG  45          2HH2      ARG  45   6.736 -14.259   0.889
  376   2HH1  ARG  45          1HH2      ARG  45   6.266 -15.896   1.208
  377   1HH2  ARG  45          1HH       ARG  45   5.457 -17.258  -0.591
  378    H    ASP  46           H        ASP  46  10.086 -12.868  -5.780
  379    HA   ASP  46           HA       ASP  46  11.723 -14.988  -5.892
  380   1HB   ASP  46          1HB       ASP  46  11.154 -12.631  -7.562
  381   2HB   ASP  46          2HB       ASP  46  12.793 -13.202  -7.802
  382    HD2  ASP  46           HD       ASP  46  10.078 -16.039  -8.409
  383    H    LEU  47           H        LEU  47  12.371 -11.754  -4.660
  384    HA   LEU  47           HA       LEU  47  15.076 -12.569  -3.996
  385   1HB   LEU  47          1HB       LEU  47  14.382 -10.487  -5.954
  386   2HB   LEU  47          2HB       LEU  47  15.498  -9.966  -4.708
  387    HG   LEU  47           HG       LEU  47  16.034 -12.534  -6.168
  388   1HD1  LEU  47          1HD1      LEU  47  16.620  -9.766  -7.252
  389   2HD1  LEU  47          2HD1      LEU  47  17.301 -11.284  -7.884
  390   3HD1  LEU  47          3HD1      LEU  47  15.546 -10.992  -7.967
  391   1HD2  LEU  47          1HD2      LEU  47  18.415 -11.287  -5.847
  392   2HD2  LEU  47          2HD2      LEU  47  17.515 -10.624  -4.461
  393   3HD2  LEU  47          3HD2      LEU  47  17.691 -12.386  -4.650
  394    H    ALA  48           H        ALA  48  12.815  -9.719  -3.892
  395    HA   ALA  48           HA       ALA  48  12.025  -9.831  -1.346
  396   1HB   ALA  48          1HB       ALA  48  14.911  -9.224  -1.470
  397   2HB   ALA  48          2HB       ALA  48  13.968  -8.053  -0.515
  398   3HB   ALA  48          3HB       ALA  48  13.918  -9.785  -0.104
  399    H    TYR  49           H        TYR  49  10.381  -8.818  -2.703
  400    HA   TYR  49           HA       TYR  49  10.476  -5.975  -2.486
  401   1HB   TYR  49          1HB       TYR  49  10.262  -7.332  -5.242
  402   2HB   TYR  49          2HB       TYR  49  10.308  -5.604  -4.950
  403    HD1  TYR  49           HD1      TYR  49  12.464  -4.596  -3.980
  404    HD2  TYR  49           HD2      TYR  49  12.255  -8.549  -5.603
  405    HE1  TYR  49           HE1      TYR  49  14.991  -4.620  -4.268
  406    HE2  TYR  49           HE2      TYR  49  14.780  -8.559  -5.886
  407    HH   TYR  49           HH       TYR  49  16.770  -6.772  -4.360
  408    H    ALA  50           H        ALA  50   8.407  -5.145  -2.341
  409    HA   ALA  50           HA       ALA  50   6.230  -6.856  -3.288
  410   1HB   ALA  50          1HB       ALA  50   5.285  -5.791  -0.898
  411   2HB   ALA  50          2HB       ALA  50   5.828  -7.467  -1.151
  412   3HB   ALA  50          3HB       ALA  50   6.958  -6.253  -0.506
  413    H    LYS  51           H        LYS  51   5.723  -5.468  -4.993
  414    HA   LYS  51           HA       LYS  51   5.497  -2.642  -4.449
  415   1HB   LYS  51          1HB       LYS  51   4.565  -3.716  -7.042
  416   2HB   LYS  51          2HB       LYS  51   5.617  -2.360  -6.692
  417   1HG   LYS  51          1HG       LYS  51   7.316  -4.262  -5.908
  418   2HG   LYS  51          2HG       LYS  51   6.319  -5.296  -6.914
  419   1HD   LYS  51          1HD       LYS  51   7.240  -4.463  -8.815
  420   2HD   LYS  51          2HD       LYS  51   6.896  -2.814  -8.333
  421   1HE   LYS  51          1HE       LYS  51   9.013  -2.475  -7.459
  422   2HE   LYS  51          2HE       LYS  51   9.149  -4.117  -6.861
  423   1HZ   LYS  51          1HZ       LYS  51   9.531  -4.855  -9.163
  424   2HZ   LYS  51          2HZ       LYS  51   9.413  -3.327  -9.714
  425    H    VAL  52           H        VAL  52   3.739  -1.860  -3.425
  426    HA   VAL  52           HA       VAL  52   1.180  -3.180  -4.026
  427    HB   VAL  52           HB       VAL  52   2.180  -3.390  -1.687
  428   1HG1  VAL  52          1HG1      VAL  52   1.558  -1.366  -0.224
  429   2HG1  VAL  52          2HG1      VAL  52   3.035  -1.250  -1.212
  430   3HG1  VAL  52          3HG1      VAL  52   1.543  -0.435  -1.741
  431   1HG2  VAL  52          1HG2      VAL  52   0.026  -3.291  -0.646
  432   2HG2  VAL  52          2HG2      VAL  52  -0.562  -2.101  -1.833
  433   3HG2  VAL  52          3HG2      VAL  52  -0.225  -3.773  -2.341
  434    H    TYR  53           H        TYR  53  -0.488  -1.909  -4.777
  435    HA   TYR  53           HA       TYR  53   0.237   0.824  -5.434
  436   1HB   TYR  53          1HB       TYR  53  -1.118  -1.313  -6.651
  437   2HB   TYR  53          2HB       TYR  53  -2.460  -0.371  -6.036
  438    HD1  TYR  53           HD1      TYR  53  -3.428   1.045  -7.586
  439    HD2  TYR  53           HD2      TYR  53   0.791   0.365  -7.782
  440    HE1  TYR  53           HE1      TYR  53  -3.269   2.582  -9.604
  441    HE2  TYR  53           HE2      TYR  53   0.938   1.905  -9.800
  442    HH   TYR  53           HH       TYR  53  -0.356   3.799 -10.713
  443    H    VAL  54           H        VAL  54  -1.080   2.663  -4.910
  444    HA   VAL  54           HA       VAL  54  -3.253   2.279  -3.059
  445    HB   VAL  54           HB       VAL  54  -2.309   3.529  -1.261
  446   1HG1  VAL  54          1HG1      VAL  54  -0.590   2.006  -0.461
  447   2HG1  VAL  54          2HG1      VAL  54  -1.848   1.092  -1.329
  448   3HG1  VAL  54          3HG1      VAL  54  -0.287   1.431  -2.117
  449   1HG2  VAL  54          1HG2      VAL  54  -0.942   5.121  -2.465
  450   2HG2  VAL  54          2HG2      VAL  54   0.073   4.268  -1.276
  451   3HG2  VAL  54          3HG2      VAL  54   0.163   3.831  -2.999
  452    H    THR  55           H        THR  55  -4.810   3.660  -3.724
  453    HA   THR  55           HA       THR  55  -3.911   6.120  -5.074
  454    HB   THR  55           HB       THR  55  -5.036   4.947  -6.760
  455    HG1  THR  55           HG1      THR  55  -7.274   5.912  -5.140
  456   1HG2  THR  55          1HG2      THR  55  -5.716   2.896  -5.737
  457   2HG2  THR  55          2HG2      THR  55  -6.638   3.738  -4.468
  458   3HG2  THR  55          3HG2      THR  55  -7.259   3.688  -6.137
  459    H    PHE  56           H        PHE  56  -4.570   8.069  -4.332
  460    HA   PHE  56           HA       PHE  56  -6.517   7.982  -2.135
  461   1HB   PHE  56          1HB       PHE  56  -4.272  10.025  -2.552
  462   2HB   PHE  56          2HB       PHE  56  -5.144   9.700  -1.066
  463    HD1  PHE  56           HD1      PHE  56  -2.059   9.693  -1.824
  464    HD2  PHE  56           HD2      PHE  56  -4.959   6.676  -1.122
  465    HE1  PHE  56           HE1      PHE  56  -0.245   8.115  -1.103
  466    HE2  PHE  56           HE2      PHE  56  -3.144   5.099  -0.401
  467    HZ   PHE  56           HZ       PHE  56  -0.809   5.837  -0.400
  468    H    LEU  57           H        LEU  57  -7.535  10.247  -1.756
  469    HA   LEU  57           HA       LEU  57  -8.231  11.300  -4.399
  470   1HB   LEU  57          1HB       LEU  57  -9.937  10.252  -2.774
  471   2HB   LEU  57          2HB       LEU  57  -9.767  11.733  -1.853
  472    HG   LEU  57           HG       LEU  57 -10.310  12.907  -4.136
  473   1HD1  LEU  57          1HD1      LEU  57 -11.978  11.490  -5.434
  474   2HD1  LEU  57          2HD1      LEU  57 -10.253  11.107  -5.652
  475   3HD1  LEU  57          3HD1      LEU  57 -11.268  10.082  -4.607
  476   1HD2  LEU  57          1HD2      LEU  57 -12.602  13.039  -3.526
  477   2HD2  LEU  57          2HD2      LEU  57 -12.544  11.467  -2.692
  478   3HD2  LEU  57          3HD2      LEU  57 -11.674  12.866  -2.017
  479    H    ASN  58           H        ASN  58  -5.808  11.883  -2.537
  480    HA   ASN  58           HA       ASN  58  -6.138  14.374  -1.432
  481   1HB   ASN  58          1HB       ASN  58  -3.924  12.586  -2.154
  482   2HB   ASN  58          2HB       ASN  58  -3.472  14.254  -2.453
  483   1HD2  ASN  58          1HD2      ASN  58  -4.915  15.589  -0.532
  484   2HD2  ASN  58          2HD2      ASN  58  -4.343  15.186   1.052
  485    H    ASP  59           H        ASP  59  -5.552  13.262  -4.775
  486    HA   ASP  59           HA       ASP  59  -4.472  15.291  -6.043
  487   1HB   ASP  59          1HB       ASP  59  -5.191  13.543  -7.429
  488   2HB   ASP  59          2HB       ASP  59  -6.793  13.497  -6.719
  489    HD2  ASP  59           HD       ASP  59  -6.068  16.175  -9.621
  490    H    LYS  60           H        LYS  60  -7.831  15.125  -4.744
  491    HA   LYS  60           HA       LYS  60  -9.088  17.194  -5.867
  492   1HB   LYS  60          1HB       LYS  60  -9.124  15.923  -3.207
  493   2HB   LYS  60          2HB       LYS  60  -9.772  17.550  -3.229
  494   1HG   LYS  60          1HG       LYS  60 -11.307  16.949  -5.085
  495   2HG   LYS  60          2HG       LYS  60 -10.619  15.340  -5.161
  496   1HD   LYS  60          1HD       LYS  60 -12.620  15.104  -3.870
  497   2HD   LYS  60          2HD       LYS  60 -11.313  15.042  -2.704
  498   1HE   LYS  60          1HE       LYS  60 -12.613  16.614  -1.623
  499   2HE   LYS  60          2HE       LYS  60 -11.732  17.716  -2.662
  500   1HZ   LYS  60          1HZ       LYS  60 -14.498  17.170  -2.683
  501   2HZ   LYS  60          2HZ       LYS  60 -13.694  18.280  -3.563
  502    H    ASP  61           H        ASP  61  -6.522  17.421  -3.341
  503    HA   ASP  61           HA       ASP  61  -6.349  20.241  -4.056
  504   1HB   ASP  61          1HB       ASP  61  -5.463  19.300  -1.335
  505   2HB   ASP  61          2HB       ASP  61  -6.067  20.873  -1.814
  506    HD2  ASP  61           HD       ASP  61  -7.746  17.565  -1.418
  507    H    GLU  62           H        GLU  62  -4.327  20.656  -4.957
  508    HA   GLU  62           HA       GLU  62  -2.368  18.670  -5.004
  509   1HB   GLU  62          1HB       GLU  62  -2.801  20.550  -6.707
  510   2HB   GLU  62          2HB       GLU  62  -1.946  21.623  -5.616
  511   1HG   GLU  62          1HG       GLU  62  -0.108  19.648  -5.701
  512   2HG   GLU  62          2HG       GLU  62  -0.883  19.314  -7.237
  513    HE2  GLU  62           HE       GLU  62   0.314  21.887  -8.893
  514    H    ASP  63           H        ASP  63  -3.149  21.202  -2.724
  515    HA   ASP  63           HA       ASP  63  -0.565  21.547  -1.697
  516   1HB   ASP  63          1HB       ASP  63  -3.148  22.640  -1.290
  517   2HB   ASP  63          2HB       ASP  63  -2.727  21.931   0.257
  518    HD2  ASP  63           HD       ASP  63   0.047  23.711   0.778
  519    H    ALA  64           H        ALA  64  -3.451  19.526  -0.857
  520    HA   ALA  64           HA       ALA  64  -2.163  18.356   1.421
  521   1HB   ALA  64          1HB       ALA  64  -4.662  17.428  -0.040
  522   2HB   ALA  64          2HB       ALA  64  -4.217  17.144   1.661
  523   3HB   ALA  64          3HB       ALA  64  -4.657  18.781   1.118
  524    H    VAL  65           H        VAL  65  -2.185  17.872  -2.029
  525    HA   VAL  65           HA       VAL  65  -1.641  15.072  -1.943
  526    HB   VAL  65           HB       VAL  65  -2.431  16.930  -3.832
  527   1HG1  VAL  65          1HG1      VAL  65  -0.063  17.586  -4.168
  528   2HG1  VAL  65          2HG1      VAL  65   0.320  15.905  -4.610
  529   3HG1  VAL  65          3HG1      VAL  65  -0.786  16.861  -5.624
  530   1HG2  VAL  65          1HG2      VAL  65  -3.291  14.907  -4.329
  531   2HG2  VAL  65          2HG2      VAL  65  -1.841  14.722  -5.344
  532   3HG2  VAL  65          3HG2      VAL  65  -1.871  14.038  -3.702
  533    H    LYS  66           H        LYS  66   0.277  18.116  -2.194
  534    HA   LYS  66           HA       LYS  66   2.740  16.717  -2.479
  535   1HB   LYS  66          1HB       LYS  66   1.800  19.379  -2.741
  536   2HB   LYS  66          2HB       LYS  66   3.049  19.416  -1.514
  537   1HG   LYS  66          1HG       LYS  66   4.444  19.542  -3.342
  538   2HG   LYS  66          2HG       LYS  66   4.294  17.797  -3.302
  539   1HD   LYS  66          1HD       LYS  66   2.039  18.523  -4.759
  540   2HD   LYS  66          2HD       LYS  66   3.192  19.744  -5.258
  541   1HE   LYS  66          1HE       LYS  66   4.138  16.880  -5.171
  542   2HE   LYS  66          2HE       LYS  66   3.054  17.338  -6.469
  543   1HZ   LYS  66          1HZ       LYS  66   5.430  18.993  -5.887
  544   2HZ   LYS  66          2HZ       LYS  66   5.570  17.666  -6.821
  545    H    ALA  67           H        ALA  67   1.086  18.470   0.233
  546    HA   ALA  67           HA       ALA  67   3.091  17.857   2.111
  547   1HB   ALA  67          1HB       ALA  67   0.328  18.983   2.082
  548   2HB   ALA  67          2HB       ALA  67   0.892  18.304   3.627
  549   3HB   ALA  67          3HB       ALA  67   1.811  19.610   2.841
  550    H    GLY  68           H        GLY  68  -0.166  16.399   1.429
  551   1HA   GLY  68          1HA       GLY  68  -0.150  14.409   3.330
  552   2HA   GLY  68          2HA       GLY  68  -0.943  14.317   1.771
  553    H    ILE  69           H        ILE  69   0.812  14.011  -0.162
  554    HA   ILE  69           HA       ILE  69   1.786  11.457   0.091
  555    HB   ILE  69           HB       ILE  69   1.322  12.919  -1.969
  556   1HG1  ILE  69          1HG1      ILE  69   3.788  11.427  -2.556
  557   2HG1  ILE  69          2HG1      ILE  69   2.639  10.526  -1.588
  558   1HG2  ILE  69          1HG2      ILE  69   2.853  14.373  -2.765
  559   2HG2  ILE  69          2HG2      ILE  69   3.314  14.486  -1.050
  560   3HG2  ILE  69          3HG2      ILE  69   4.234  13.435  -2.153
  561   1HD1  ILE  69          1HD1      ILE  69   2.243  10.203  -4.025
  562   2HD1  ILE  69          2HD1      ILE  69   0.846  10.973  -3.235
  563   3HD1  ILE  69          3HD1      ILE  69   1.973  11.953  -4.205
  564    H    LYS  70           H        LYS  70   3.302  14.592   0.887
  565    HA   LYS  70           HA       LYS  70   5.918  13.638   1.149
  566   1HB   LYS  70          1HB       LYS  70   4.395  16.063   1.846
  567   2HB   LYS  70          2HB       LYS  70   5.745  15.738   2.913
  568   1HG   LYS  70          1HG       LYS  70   7.332  15.781   1.123
  569   2HG   LYS  70          2HG       LYS  70   6.094  15.570  -0.101
  570   1HD   LYS  70          1HD       LYS  70   6.902  17.915  -0.052
  571   2HD   LYS  70          2HD       LYS  70   5.201  17.833   0.357
  572   1HE   LYS  70          1HE       LYS  70   5.645  18.913   2.300
  573   2HE   LYS  70          2HE       LYS  70   6.588  17.533   2.828
  574   1HZ   LYS  70          1HZ       LYS  70   8.544  18.548   2.197
  575   2HZ   LYS  70          2HZ       LYS  70   7.878  19.423   0.996
  576    H    ALA  71           H        ALA  71   3.071  13.601   3.310
  577    HA   ALA  71           HA       ALA  71   4.603  12.743   5.572
  578   1HB   ALA  71          1HB       ALA  71   2.585  12.893   6.719
  579   2HB   ALA  71          2HB       ALA  71   2.309  14.046   5.393
  580   3HB   ALA  71          3HB       ALA  71   1.622  12.408   5.305
  581    H    LEU  72           H        LEU  72   2.577  11.246   3.004
  582    HA   LEU  72           HA       LEU  72   2.629   8.665   4.153
  583   1HB   LEU  72          1HB       LEU  72   1.124   9.822   2.302
  584   2HB   LEU  72          2HB       LEU  72   2.297   9.095   1.222
  585    HG   LEU  72           HG       LEU  72   1.092   7.336   3.310
  586   1HD1  LEU  72          1HD1      LEU  72  -0.976   8.092   2.759
  587   2HD1  LEU  72          2HD1      LEU  72  -0.460   8.692   1.164
  588   3HD1  LEU  72          3HD1      LEU  72  -0.749   6.953   1.410
  589   1HD2  LEU  72          1HD2      LEU  72   1.807   6.927   0.392
  590   2HD2  LEU  72          2HD2      LEU  72   2.795   6.465   1.798
  591   3HD2  LEU  72          3HD2      LEU  72   1.226   5.673   1.513
  592    H    GLN  73           H        GLN  73   4.972  10.611   2.478
  593    HA   GLN  73           HA       GLN  73   6.416   8.338   1.508
  594   1HB   GLN  73          1HB       GLN  73   6.253  10.800   0.526
  595   2HB   GLN  73          2HB       GLN  73   7.560  11.132   1.643
  596   1HG   GLN  73          1HG       GLN  73   7.958   8.634   0.098
  597   2HG   GLN  73          2HG       GLN  73   7.850  10.060  -0.915
  598   1HE2  GLN  73          1HE2      GLN  73   9.329  11.739  -0.693
  599   2HE2  GLN  73          2HE2      GLN  73  10.862  11.544   0.090
  600    H    GLU  74           H        GLU  74   6.878  10.942   3.998
  601    HA   GLU  74           HA       GLU  74   9.285  10.015   4.944
  602   1HB   GLU  74          1HB       GLU  74   9.011  11.571   6.672
  603   2HB   GLU  74          2HB       GLU  74   7.944  12.214   5.441
  604   1HG   GLU  74          1HG       GLU  74   6.000  11.073   6.525
  605   2HG   GLU  74          2HG       GLU  74   7.067  10.419   7.752
  606    HE2  GLU  74           HE       GLU  74   5.701  11.500   9.050
  607    H    ALA  75           H        ALA  75   5.943   8.951   5.578
  608    HA   ALA  75           HA       ALA  75   6.798   7.255   7.764
  609   1HB   ALA  75          1HB       ALA  75   4.525   6.992   8.200
  610   2HB   ALA  75          2HB       ALA  75   4.557   8.613   7.464
  611   3HB   ALA  75          3HB       ALA  75   4.067   7.204   6.493
  612    H    SER  76           H        SER  76   7.569   7.074   4.693
  613    HA   SER  76           HA       SER  76   6.417   4.816   3.660
  614   1HB   SER  76          1HB       SER  76   8.557   4.634   2.313
  615   2HB   SER  76          2HB       SER  76   7.799   6.212   2.268
  616    HG   SER  76           HG       SER  76   9.344   7.033   3.709
  617    H    GLY  77           H        GLY  77   9.817   4.893   4.950
  618   1HA   GLY  77          1HA       GLY  77  10.159   2.197   5.286
  619   2HA   GLY  77          2HA       GLY  77  10.958   3.438   6.232
  620    H    PHE  78           H        PHE  78   8.094   4.378   7.118
  621    HA   PHE  78           HA       PHE  78   8.096   2.841   9.509
  622   1HB   PHE  78          1HB       PHE  78   6.960   5.283   8.337
  623   2HB   PHE  78          2HB       PHE  78   5.680   4.386   9.128
  624    HD1  PHE  78           HD1      PHE  78   8.876   6.124   9.644
  625    HD2  PHE  78           HD2      PHE  78   5.603   4.180  11.521
  626    HE1  PHE  78           HE1      PHE  78   9.602   7.044  11.864
  627    HE2  PHE  78           HE2      PHE  78   6.329   5.101  13.739
  628    HZ   PHE  78           HZ       PHE  78   8.320   6.521  13.884
  629    H    ILE  79           H        ILE  79   5.964   3.101   6.602
  630    HA   ILE  79           HA       ILE  79   4.048   1.280   7.640
  631    HB   ILE  79           HB       ILE  79   3.258   1.296   5.243
  632   1HG1  ILE  79          1HG1      ILE  79   5.271   3.518   4.860
  633   2HG1  ILE  79          2HG1      ILE  79   5.599   1.869   4.366
  634   1HG2  ILE  79          1HG2      ILE  79   2.868   3.953   5.470
  635   2HG2  ILE  79          2HG2      ILE  79   1.994   2.738   6.436
  636   3HG2  ILE  79          3HG2      ILE  79   3.401   3.580   7.127
  637   1HD1  ILE  79          1HD1      ILE  79   3.046   3.277   3.507
  638   2HD1  ILE  79          2HD1      ILE  79   4.565   3.464   2.598
  639   3HD1  ILE  79          3HD1      ILE  79   3.825   1.855   2.773
  640    H    ARG  80           H        ARG  80   6.976   1.050   5.582
  641    HA   ARG  80           HA       ARG  80   6.511  -1.581   4.808
  642   1HB   ARG  80          1HB       ARG  80   8.098  -0.179   3.586
  643   2HB   ARG  80          2HB       ARG  80   9.067   0.079   5.024
  644   1HG   ARG  80          1HG       ARG  80  10.089  -1.989   4.884
  645   2HG   ARG  80          2HG       ARG  80   8.646  -2.785   4.284
  646   1HD   ARG  80          1HD       ARG  80  10.028  -2.824   2.381
  647   2HD   ARG  80          2HD       ARG  80   9.074  -1.385   2.084
  648    HE   ARG  80           HE       ARG  80  10.984  -0.059   2.415
  649   1HH1  ARG  80          2HH2      ARG  80  11.629  -3.341   3.580
  650   2HH1  ARG  80          1HH2      ARG  80  13.322  -3.060   3.815
  651   1HH2  ARG  80          1HH       ARG  80  14.234  -0.903   3.305
  652    H    SER  81           H        SER  81   8.487  -0.084   7.455
  653    HA   SER  81           HA       SER  81   9.413  -2.552   8.409
  654   1HB   SER  81          1HB       SER  81   9.324   0.268   9.518
  655   2HB   SER  81          2HB       SER  81   9.868  -1.055  10.529
  656    HG   SER  81           HG       SER  81  11.032  -1.024   7.970
  657    H    LEU  82           H        LEU  82   6.611  -0.430   9.135
  658    HA   LEU  82           HA       LEU  82   5.815  -1.719  11.490
  659   1HB   LEU  82          1HB       LEU  82   5.076   0.498  10.890
  660   2HB   LEU  82          2HB       LEU  82   4.280  -0.106   9.450
  661    HG   LEU  82           HG       LEU  82   3.299  -1.463  11.830
  662   1HD1  LEU  82          1HD1      LEU  82   4.041   1.002  12.557
  663   2HD1  LEU  82          2HD1      LEU  82   2.449   1.388  11.863
  664   3HD1  LEU  82          3HD1      LEU  82   2.580   0.206  13.187
  665   1HD2  LEU  82          1HD2      LEU  82   1.866   0.317   9.840
  666   2HD2  LEU  82          2HD2      LEU  82   2.231  -1.405   9.582
  667   3HD2  LEU  82          3HD2      LEU  82   1.149  -0.913  10.908
  668    H    LEU  83           H        LEU  83   5.353  -2.428   8.026
  669    HA   LEU  83           HA       LEU  83   3.298  -4.326   8.419
  670   1HB   LEU  83          1HB       LEU  83   5.210  -3.735   6.171
  671   2HB   LEU  83          2HB       LEU  83   4.052  -5.048   6.088
  672    HG   LEU  83           HG       LEU  83   3.010  -2.335   6.782
  673   1HD1  LEU  83          1HD1      LEU  83   3.028  -2.683   3.911
  674   2HD1  LEU  83          2HD1      LEU  83   3.567  -1.302   4.896
  675   3HD1  LEU  83          3HD1      LEU  83   4.687  -2.642   4.557
  676   1HD2  LEU  83          1HD2      LEU  83   2.018  -4.805   5.394
  677   2HD2  LEU  83          2HD2      LEU  83   1.315  -3.902   6.759
  678   3HD2  LEU  83          3HD2      LEU  83   1.225  -3.237   5.109
  679    H    GLY  84           H        GLY  84   6.842  -4.707   7.695
  680   1HA   GLY  84          1HA       GLY  84   7.087  -7.402   7.862
  681   2HA   GLY  84          2HA       GLY  84   8.303  -6.269   8.418
  682    H    LYS  85           H        LYS  85   7.206  -5.075  10.659
  683    HA   LYS  85           HA       LYS  85   7.457  -7.160  12.558
  684   1HB   LYS  85          1HB       LYS  85   7.333  -4.230  12.527
  685   2HB   LYS  85          2HB       LYS  85   6.536  -4.931  13.921
  686   1HG   LYS  85          1HG       LYS  85   8.830  -6.470  13.799
  687   2HG   LYS  85          2HG       LYS  85   9.423  -4.938  13.188
  688   1HD   LYS  85          1HD       LYS  85   7.749  -5.059  15.724
  689   2HD   LYS  85          2HD       LYS  85   9.477  -5.355  15.774
  690   1HE   LYS  85          1HE       LYS  85   9.104  -2.993  14.190
  691   2HE   LYS  85          2HE       LYS  85   8.072  -2.815  15.595
  692   1HZ   LYS  85          1HZ       LYS  85   9.875  -2.785  16.994
  693   2HZ   LYS  85          2HZ       LYS  85  10.783  -3.789  16.089
  694    H    ALA  86           H        ALA  86   4.725  -5.254  11.201
  695    HA   ALA  86           HA       ALA  86   2.778  -6.149  12.980
  696   1HB   ALA  86          1HB       ALA  86   2.341  -4.264  11.577
  697   2HB   ALA  86          2HB       ALA  86   2.713  -5.186  10.100
  698   3HB   ALA  86          3HB       ALA  86   1.238  -5.549  11.028
  699    H    MET  87           H        MET  87   4.338  -7.651  10.157
  700    HA   MET  87           HA       MET  87   2.517  -9.905  10.494
  701   1HB   MET  87          1HB       MET  87   4.355  -9.338   8.112
  702   2HB   MET  87          2HB       MET  87   3.007 -10.457   8.157
  703   1HG   MET  87          1HG       MET  87   1.415  -8.780   7.919
  704   2HG   MET  87          2HG       MET  87   2.359  -7.602   8.810
  705   1HE   MET  87          1HE       MET  87   1.523  -9.173   5.395
  706   2HE   MET  87          2HE       MET  87   0.731  -7.645   5.849
  707   3HE   MET  87          3HE       MET  87   1.832  -7.696   4.450
  708    H    ARG  88           H        ARG  88   5.239  -8.991  11.843
  709    HA   ARG  88           HA       ARG  88   7.304  -9.848  12.093
  710   1HB   ARG  88          1HB       ARG  88   5.227 -11.770  13.189
  711   2HB   ARG  88          2HB       ARG  88   6.926 -12.132  13.416
  712   1HG   ARG  88          1HG       ARG  88   7.187  -9.760  14.380
  713   2HG   ARG  88          2HG       ARG  88   5.439  -9.636  14.350
  714   1HD   ARG  88          1HD       ARG  88   5.865 -10.405  16.546
  715   2HD   ARG  88          2HD       ARG  88   5.450 -11.883  15.701
  716    HE   ARG  88           HE       ARG  88   8.319 -11.270  15.643
  717   1HH1  ARG  88          2HH2      ARG  88   5.732 -12.871  17.458
  718   2HH1  ARG  88          1HH2      ARG  88   6.811 -13.940  18.293
  719   1HH2  ARG  88          1HH       ARG  88   9.164 -13.809  17.857
  720    H    LEU  89           H        LEU  89   7.845 -10.177   9.735
  721    HA   LEU  89           HA       LEU  89   7.819 -13.028   9.031
  722   1HB   LEU  89          1HB       LEU  89   6.727 -10.949   7.640
  723   2HB   LEU  89          2HB       LEU  89   8.317 -11.049   6.911
  724    HG   LEU  89           HG       LEU  89   7.959 -13.353   6.272
  725   1HD1  LEU  89          1HD1      LEU  89   5.515 -13.121   8.001
  726   2HD1  LEU  89          2HD1      LEU  89   5.546 -14.272   6.643
  727   3HD1  LEU  89          3HD1      LEU  89   6.755 -14.396   7.944
  728   1HD2  LEU  89          1HD2      LEU  89   6.494 -11.151   5.282
  729   2HD2  LEU  89          2HD2      LEU  89   6.956 -12.643   4.428
  730   3HD2  LEU  89          3HD2      LEU  89   5.390 -12.547   5.267
  731    H    ARG  90           H        ARG  90   9.773 -12.351   6.811
  732    HA   ARG  90           HA       ARG  90  12.075 -11.536   8.303
  733   1HB   ARG  90          1HB       ARG  90  13.364 -13.614   7.702
  734   2HB   ARG  90          2HB       ARG  90  12.044 -13.939   8.809
  735   1HG   ARG  90          1HG       ARG  90  10.616 -14.493   6.720
  736   2HG   ARG  90          2HG       ARG  90  12.111 -14.459   5.806
  737   1HD   ARG  90          1HD       ARG  90  12.696 -16.532   6.538
  738   2HD   ARG  90          2HD       ARG  90  12.471 -16.071   8.214
  739    HE   ARG  90           HE       ARG  90   9.876 -16.369   7.170
  740   1HH1  ARG  90          2HH2      ARG  90  12.716 -18.443   7.599
  741   2HH1  ARG  90          1HH2      ARG  90  11.786 -19.897   7.755
  742   1HH2  ARG  90          1HH       ARG  90   9.395 -19.779   7.621
  743    H    ILE  91           H        ILE  91  10.675 -12.917   5.270
  744    HA   ILE  91           HA       ILE  91  12.633 -12.437   3.480
  745    HB   ILE  91           HB       ILE  91  10.674 -11.892   1.897
  746   1HG1  ILE  91          1HG1      ILE  91   8.889 -12.985   4.027
  747   2HG1  ILE  91          2HG1      ILE  91   9.287 -11.279   4.105
  748   1HG2  ILE  91          1HG2      ILE  91  11.093 -14.035   1.491
  749   2HG2  ILE  91          2HG2      ILE  91  11.558 -14.333   3.183
  750   3HG2  ILE  91          3HG2      ILE  91   9.849 -14.441   2.697
  751   1HD1  ILE  91          1HD1      ILE  91   8.675 -12.002   1.353
  752   2HD1  ILE  91          2HD1      ILE  91   7.356 -12.518   2.431
  753   3HD1  ILE  91          3HD1      ILE  91   7.868 -10.814   2.404
  754    H    VAL  92           H        VAL  92  10.763 -10.073   5.311
  755    HA   VAL  92           HA       VAL  92  10.517  -7.827   4.917
  756    HB   VAL  92           HB       VAL  92  13.496  -8.150   5.317
  757   1HG1  VAL  92          1HG1      VAL  92  11.637  -5.996   6.368
  758   2HG1  VAL  92          2HG1      VAL  92  13.414  -6.039   6.449
  759   3HG1  VAL  92          3HG1      VAL  92  12.600  -5.836   4.879
  760   1HG2  VAL  92          1HG2      VAL  92  12.093  -7.800   7.785
  761   2HG2  VAL  92          2HG2      VAL  92  11.360  -9.168   6.913
  762   3HG2  VAL  92          3HG2      VAL  92  13.106  -9.165   7.261
  763    HA   PRO  93           HA       PRO  93  12.047  -7.760   0.608
  764   1HB   PRO  93          1HB       PRO  93   9.654  -7.873  -0.707
  765   2HB   PRO  93          2HB       PRO  93  10.657  -9.281  -0.419
  766   1HG   PRO  93          1HG       PRO  93   8.154  -8.477   0.936
  767   2HG   PRO  93          2HG       PRO  93   8.928 -10.050   0.900
  768   1HD   PRO  93          1HD       PRO  93   8.952  -8.172   3.069
  769   2HD   PRO  93          2HD       PRO  93   9.820  -9.693   2.989
  770    H    GLU  94           H        GLU  94  11.948  -6.066  -1.015
  771    HA   GLU  94           HA       GLU  94  11.534  -3.633   0.295
  772   1HB   GLU  94          1HB       GLU  94  12.840  -4.526  -2.031
  773   2HB   GLU  94          2HB       GLU  94  11.602  -3.444  -2.636
  774   1HG   GLU  94          1HG       GLU  94  12.443  -1.582  -1.432
  775   2HG   GLU  94          2HG       GLU  94  13.287  -2.586  -0.270
  776    HE2  GLU  94           HE       GLU  94  15.583  -1.123  -2.704
  777    H    LEU  95           H        LEU  95   9.179  -4.400   0.912
  778    HA   LEU  95           HA       LEU  95   7.201  -4.291  -1.091
  779   1HB   LEU  95          1HB       LEU  95   5.696  -4.625   0.604
  780   2HB   LEU  95          2HB       LEU  95   7.156  -5.359   1.240
  781    HG   LEU  95           HG       LEU  95   7.441  -2.898   2.293
  782   1HD1  LEU  95          1HD1      LEU  95   4.482  -3.196   2.607
  783   2HD1  LEU  95          2HD1      LEU  95   5.513  -1.752   2.746
  784   3HD1  LEU  95          3HD1      LEU  95   5.117  -2.410   1.141
  785   1HD2  LEU  95          1HD2      LEU  95   6.427  -3.812   4.371
  786   2HD2  LEU  95          2HD2      LEU  95   5.801  -5.182   3.421
  787   3HD2  LEU  95          3HD2      LEU  95   7.557  -4.931   3.572
  788    H    THR  96           H        THR  96   7.485  -2.442  -2.387
  789    HA   THR  96           HA       THR  96   7.469   0.144  -1.056
  790    HB   THR  96           HB       THR  96   8.833  -0.787  -3.212
  791    HG1  THR  96           HG1      THR  96   9.085   1.500  -3.562
  792   1HG2  THR  96          1HG2      THR  96   6.325  -0.799  -4.331
  793   2HG2  THR  96          2HG2      THR  96   6.788   0.895  -4.619
  794   3HG2  THR  96          3HG2      THR  96   7.798  -0.424  -5.257
  795    H    PHE  97           H        PHE  97   5.956   1.857  -1.734
  796    HA   PHE  97           HA       PHE  97   3.352   0.697  -2.434
  797   1HB   PHE  97          1HB       PHE  97   2.408   2.318  -0.791
  798   2HB   PHE  97          2HB       PHE  97   3.617   1.331   0.007
  799    HD1  PHE  97           HD1      PHE  97   6.021   2.328   0.118
  800    HD2  PHE  97           HD2      PHE  97   2.541   4.633  -0.653
  801    HE1  PHE  97           HE1      PHE  97   7.234   4.403   0.842
  802    HE2  PHE  97           HE2      PHE  97   3.756   6.707   0.072
  803    HZ   PHE  97           HZ       PHE  97   6.088   6.567   0.811
  804    H    PHE  98           H        PHE  98   2.729   1.452  -4.400
  805    HA   PHE  98           HA       PHE  98   3.818   3.973  -5.314
  806   1HB   PHE  98          1HB       PHE  98   2.693   1.450  -6.367
  807   2HB   PHE  98          2HB       PHE  98   1.918   2.821  -7.136
  808    HD1  PHE  98           HD1      PHE  98   3.211   4.358  -8.534
  809    HD2  PHE  98           HD2      PHE  98   5.030   0.962  -6.756
  810    HE1  PHE  98           HE1      PHE  98   5.169   4.593 -10.088
  811    HE2  PHE  98           HE2      PHE  98   6.988   1.198  -8.308
  812    HZ   PHE  98           HZ       PHE  98   7.034   3.009  -9.956
  813    H    TYR  99           H        TYR  99   2.778   5.852  -4.864
  814    HA   TYR  99           HA       TYR  99  -0.027   5.765  -4.163
  815   1HB   TYR  99          1HB       TYR  99   0.977   8.427  -4.323
  816   2HB   TYR  99          2HB       TYR  99   0.888   7.462  -2.863
  817    HD1  TYR  99           HD1      TYR  99   2.854   6.686  -1.783
  818    HD2  TYR  99           HD2      TYR  99   3.108   8.342  -5.720
  819    HE1  TYR  99           HE1      TYR  99   5.392   6.720  -1.614
  820    HE2  TYR  99           HE2      TYR  99   5.644   8.370  -5.537
  821    HH   TYR  99           HH       TYR  99   7.251   8.190  -2.752
  822    H    ASP 100           H        ASP 100  -1.369   5.527  -5.927
  823    HA   ASP 100           HA       ASP 100  -0.788   7.259  -8.189
  824   1HB   ASP 100          1HB       ASP 100  -1.305   4.589  -8.193
  825   2HB   ASP 100          2HB       ASP 100  -2.955   5.173  -8.285
  826    HD2  ASP 100           HD       ASP 100  -0.353   6.776 -10.435
  827    H    ASN 101           H        ASN 101  -1.756   9.205  -7.264
  828    HA   ASN 101           HA       ASN 101  -4.454   9.003  -6.316
  829   1HB   ASN 101          1HB       ASN 101  -4.160  11.520  -5.970
  830   2HB   ASN 101          2HB       ASN 101  -3.001  10.531  -5.105
  831   1HD2  ASN 101          1HD2      ASN 101  -1.275  11.801  -5.006
  832   2HD2  ASN 101          2HD2      ASN 101  -0.414  12.463  -6.355
  833    H    SER 102           H        SER 102  -5.612  11.408  -7.194
  834    HA   SER 102           HA       SER 102  -5.995  10.799  -9.978
  835   1HB   SER 102          1HB       SER 102  -7.587  13.039  -9.117
  836   2HB   SER 102          2HB       SER 102  -8.118  11.421  -9.538
  837    HG   SER 102           HG       SER 102  -7.505  10.791  -7.291
  838    H    LEU 103           H        LEU 103  -3.583  12.316  -8.610
  839    HA   LEU 103           HA       LEU 103  -3.804  14.843 -10.050
  840   1HB   LEU 103          1HB       LEU 103  -3.099  14.666  -7.617
  841   2HB   LEU 103          2HB       LEU 103  -1.609  13.943  -8.189
  842    HG   LEU 103           HG       LEU 103  -1.698  16.213  -9.714
  843   1HD1  LEU 103          1HD1      LEU 103  -2.207  17.683  -7.329
  844   2HD1  LEU 103          2HD1      LEU 103  -3.048  17.767  -8.896
  845   3HD1  LEU 103          3HD1      LEU 103  -3.612  16.635  -7.645
  846   1HD2  LEU 103          1HD2      LEU 103  -0.296  15.318  -7.280
  847   2HD2  LEU 103          2HD2      LEU 103   0.343  15.964  -8.812
  848   3HD2  LEU 103          3HD2      LEU 103  -0.267  17.076  -7.562
  849    H    VAL 104           H        VAL 104  -3.112  11.745 -10.840
  850    HA   VAL 104           HA       VAL 104  -1.156  12.626 -12.825
  851    HB   VAL 104           HB       VAL 104  -0.913  10.363 -10.870
  852   1HG1  VAL 104          1HG1      VAL 104   0.110  10.436 -13.705
  853   2HG1  VAL 104          2HG1      VAL 104   1.020   9.590 -12.430
  854   3HG1  VAL 104          3HG1      VAL 104  -0.648   9.096 -12.810
  855   1HG2  VAL 104          1HG2      VAL 104   0.312  12.269 -10.212
  856   2HG2  VAL 104          2HG2      VAL 104   1.513  11.188 -10.960
  857   3HG2  VAL 104          3HG2      VAL 104   0.882  12.583 -11.869
  858    H    GLU 105           H        GLU 105  -4.204  11.801 -12.357
  859    HA   GLU 105           HA       GLU 105  -4.379  10.568 -14.913
  860   1HB   GLU 105          1HB       GLU 105  -4.678   8.962 -12.439
  861   2HB   GLU 105          2HB       GLU 105  -6.034   8.811 -13.540
  862   1HG   GLU 105          1HG       GLU 105  -4.717   7.227 -14.550
  863   2HG   GLU 105          2HG       GLU 105  -3.984   8.611 -15.334
  864    HE2  GLU 105           HE       GLU 105  -2.677   8.832 -12.136
  865    H    GLY 106           H        GLY 106  -5.913  11.678 -11.864
  866   1HA   GLY 106          1HA       GLY 106  -7.600  13.220 -11.686
  867   2HA   GLY 106          2HA       GLY 106  -7.917  13.105 -13.405
  868    H    MET 107           H        MET 107  -7.795   9.962 -12.934
  869    HA   MET 107           HA       MET 107 -10.561   9.830 -12.010
  870   1HB   MET 107          1HB       MET 107 -10.936   8.133 -13.645
  871   2HB   MET 107          2HB       MET 107  -9.851   9.225 -14.483
  872   1HG   MET 107          1HG       MET 107  -8.058   7.553 -13.168
  873   2HG   MET 107          2HG       MET 107  -9.369   6.449 -13.531
  874   1HE   MET 107          1HE       MET 107  -7.485   9.379 -14.729
  875   2HE   MET 107          2HE       MET 107  -6.233   8.351 -15.469
  876   3HE   MET 107          3HE       MET 107  -7.376   9.245 -16.501
  877    H    ARG 108           H        ARG 108  -7.997   9.695 -10.399
  878    HA   ARG 108           HA       ARG 108  -8.241   6.936  -9.515
  879   1HB   ARG 108          1HB       ARG 108  -5.964   8.809  -9.784
  880   2HB   ARG 108          2HB       ARG 108  -6.006   8.036  -8.211
  881   1HG   ARG 108          1HG       ARG 108  -4.804   6.441  -9.411
  882   2HG   ARG 108          2HG       ARG 108  -6.428   5.821  -9.630
  883   1HD   ARG 108          1HD       ARG 108  -6.074   7.735 -11.709
  884   2HD   ARG 108          2HD       ARG 108  -4.565   6.844 -11.640
  885    HE   ARG 108           HE       ARG 108  -7.023   5.848 -12.680
  886   1HH1  ARG 108          2HH2      ARG 108  -4.399   4.772 -10.556
  887   2HH1  ARG 108          1HH2      ARG 108  -4.617   3.095 -10.930
  888   1HH2  ARG 108          1HH       ARG 108  -6.334   2.450 -12.472
  Start of MODEL   13
    1    H    MET   1           H        MET   1 -10.538  -8.172  -3.933
    2    HA   MET   1           HA       MET   1 -10.447  -7.578  -1.141
    3   1HB   MET   1          1HB       MET   1 -12.349  -8.893  -3.094
    4   2HB   MET   1          2HB       MET   1 -12.551  -9.293  -1.400
    5   1HG   MET   1          1HG       MET   1 -12.274  -6.532  -1.282
    6   2HG   MET   1          2HG       MET   1 -13.100  -6.732  -2.814
    7   1HE   MET   1          1HE       MET   1 -16.091  -5.820  -0.720
    8   2HE   MET   1          2HE       MET   1 -14.577  -5.408   0.121
    9   3HE   MET   1          3HE       MET   1 -14.690  -5.233  -1.648
   10    H    ALA   2           H        ALA   2 -11.427 -10.764  -2.480
   11    HA   ALA   2           HA       ALA   2  -9.132 -12.028  -1.220
   12   1HB   ALA   2          1HB       ALA   2 -10.353 -12.406   0.655
   13   2HB   ALA   2          2HB       ALA   2 -11.892 -12.023  -0.154
   14   3HB   ALA   2          3HB       ALA   2 -11.173 -13.642  -0.329
   15    H    LYS   3           H        LYS   3  -8.742 -14.174  -2.042
   16    HA   LYS   3           HA       LYS   3 -10.539 -15.103  -4.117
   17   1HB   LYS   3          1HB       LYS   3  -8.658 -13.438  -4.989
   18   2HB   LYS   3          2HB       LYS   3  -7.657 -14.874  -4.892
   19   1HG   LYS   3          1HG       LYS   3 -10.317 -15.342  -6.140
   20   2HG   LYS   3          2HG       LYS   3  -9.303 -14.222  -7.029
   21   1HD   LYS   3          1HD       LYS   3  -7.594 -15.833  -7.377
   22   2HD   LYS   3          2HD       LYS   3  -8.119 -16.828  -6.032
   23   1HE   LYS   3          1HE       LYS   3  -8.891 -18.050  -7.899
   24   2HE   LYS   3          2HE       LYS   3 -10.325 -17.173  -7.406
   25   1HZ   LYS   3          1HZ       LYS   3  -9.733 -17.051  -9.853
   26   2HZ   LYS   3          2HZ       LYS   3 -10.006 -15.608  -9.147
   27    H    GLU   4           H        GLU   4 -10.970 -16.827  -2.651
   28    HA   GLU   4           HA       GLU   4  -8.852 -18.293  -1.529
   29   1HB   GLU   4          1HB       GLU   4 -11.409 -18.075  -0.853
   30   2HB   GLU   4          2HB       GLU   4 -11.620 -19.441  -1.929
   31   1HG   GLU   4          1HG       GLU   4 -10.370 -20.888  -0.579
   32   2HG   GLU   4          2HG       GLU   4  -9.381 -19.601   0.079
   33    HE2  GLU   4           HE       GLU   4 -11.448 -18.281   2.138
   34    H    PHE   5           H        PHE   5  -7.437 -18.849  -3.290
   35    HA   PHE   5           HA       PHE   5  -8.423 -21.144  -4.790
   36   1HB   PHE   5          1HB       PHE   5  -8.595 -18.974  -6.155
   37   2HB   PHE   5          2HB       PHE   5  -6.874 -18.731  -5.914
   38    HD1  PHE   5           HD1      PHE   5  -7.019 -18.601  -8.490
   39    HD2  PHE   5           HD2      PHE   5  -7.635 -22.177  -6.292
   40    HE1  PHE   5           HE1      PHE   5  -6.540 -19.950 -10.551
   41    HE2  PHE   5           HE2      PHE   5  -7.156 -23.528  -8.353
   42    HZ   PHE   5           HZ       PHE   5  -6.613 -22.396 -10.459
   43    H    GLY   6           H        GLY   6  -7.012 -22.814  -4.574
   44   1HA   GLY   6          1HA       GLY   6  -4.810 -22.919  -3.062
   45   2HA   GLY   6          2HA       GLY   6  -5.020 -23.900  -4.499
   46    H    ARG   7           H        ARG   7  -5.057 -21.393  -6.265
   47    HA   ARG   7           HA       ARG   7  -2.414 -21.459  -6.968
   48   1HB   ARG   7          1HB       ARG   7  -4.830 -20.051  -7.779
   49   2HB   ARG   7          2HB       ARG   7  -3.487 -18.927  -7.797
   50   1HG   ARG   7          1HG       ARG   7  -3.556 -19.958  -9.980
   51   2HG   ARG   7          2HG       ARG   7  -2.164 -20.630  -9.152
   52   1HD   ARG   7          1HD       ARG   7  -4.645 -22.171  -8.655
   53   2HD   ARG   7          2HD       ARG   7  -4.216 -22.106 -10.353
   54    HE   ARG   7           HE       ARG   7  -2.686 -23.416  -8.205
   55   1HH1  ARG   7          2HH2      ARG   7  -2.619 -22.208 -11.535
   56   2HH1  ARG   7          1HH2      ARG   7  -1.274 -23.197 -11.998
   57   1HH2  ARG   7          1HH       ARG   7  -0.287 -24.667 -10.383
   58    HA   PRO   8           HA       PRO   8  -0.521 -18.271  -4.643
   59   1HB   PRO   8          1HB       PRO   8   0.764 -16.621  -6.402
   60   2HB   PRO   8          2HB       PRO   8   1.385 -18.191  -5.931
   61   1HG   PRO   8          1HG       PRO   8   0.093 -17.393  -8.467
   62   2HG   PRO   8          2HG       PRO   8   1.085 -18.800  -8.135
   63   1HD   PRO   8          1HD       PRO   8  -1.772 -18.734  -8.389
   64   2HD   PRO   8          2HD       PRO   8  -0.790 -20.116  -7.943
   65    H    GLN   9           H        GLN   9  -3.217 -17.605  -6.217
   66    HA   GLN   9           HA       GLN   9  -3.173 -14.781  -5.923
   67   1HB   GLN   9          1HB       GLN   9  -4.751 -16.675  -7.306
   68   2HB   GLN   9          2HB       GLN   9  -5.844 -15.963  -6.135
   69   1HG   GLN   9          1HG       GLN   9  -5.917 -14.622  -8.172
   70   2HG   GLN   9          2HG       GLN   9  -5.155 -13.670  -6.912
   71   1HE2  GLN   9          1HE2      GLN   9  -3.069 -13.055  -7.071
   72   2HE2  GLN   9          2HE2      GLN   9  -2.051 -13.336  -8.443
   73    H    ARG  10           H        ARG  10  -4.391 -17.613  -4.086
   74    HA   ARG  10           HA       ARG  10  -5.996 -16.275  -2.328
   75   1HB   ARG  10          1HB       ARG  10  -5.680 -18.806  -2.602
   76   2HB   ARG  10          2HB       ARG  10  -4.219 -18.668  -1.645
   77   1HG   ARG  10          1HG       ARG  10  -6.733 -17.455  -0.511
   78   2HG   ARG  10          2HG       ARG  10  -6.621 -19.204  -0.529
   79   1HD   ARG  10          1HD       ARG  10  -4.092 -18.113   0.403
   80   2HD   ARG  10          2HD       ARG  10  -5.397 -17.387   1.322
   81    HE   ARG  10           HE       ARG  10  -5.722 -20.274   1.034
   82   1HH1  ARG  10          2HH2      ARG  10  -4.121 -17.754   2.941
   83   2HH1  ARG  10          1HH2      ARG  10  -3.946 -18.753   4.345
   84   1HH2  ARG  10          1HH       ARG  10  -4.759 -21.007   4.290
   85    H    VAL  11           H        VAL  11  -2.513 -17.267  -1.909
   86    HA   VAL  11           HA       VAL  11  -2.162 -15.978   0.536
   87    HB   VAL  11           HB       VAL  11  -0.747 -17.690  -0.996
   88   1HG1  VAL  11          1HG1      VAL  11   0.682 -15.020  -1.234
   89   2HG1  VAL  11          2HG1      VAL  11   1.386 -16.606  -1.627
   90   3HG1  VAL  11          3HG1      VAL  11   0.009 -15.986  -2.569
   91   1HG2  VAL  11          1HG2      VAL  11  -0.154 -17.855   1.181
   92   2HG2  VAL  11          2HG2      VAL  11   1.225 -16.850   0.670
   93   3HG2  VAL  11          3HG2      VAL  11  -0.192 -16.094   1.440
   94    H    ALA  12           H        ALA  12  -1.789 -14.869  -2.866
   95    HA   ALA  12           HA       ALA  12  -0.566 -12.435  -2.305
   96   1HB   ALA  12          1HB       ALA  12  -0.737 -13.483  -4.543
   97   2HB   ALA  12          2HB       ALA  12  -2.492 -13.184  -4.544
   98   3HB   ALA  12          3HB       ALA  12  -1.354 -11.813  -4.552
   99    H    GLN  13           H        GLN  13  -3.991 -13.493  -2.230
  100    HA   GLN  13           HA       GLN  13  -4.984 -10.875  -1.939
  101   1HB   GLN  13          1HB       GLN  13  -6.138 -13.651  -1.551
  102   2HB   GLN  13          2HB       GLN  13  -7.066 -12.238  -1.092
  103   1HG   GLN  13          1HG       GLN  13  -6.004 -12.937  -3.860
  104   2HG   GLN  13          2HG       GLN  13  -7.679 -12.780  -3.370
  105   1HE2  GLN  13          1HE2      GLN  13  -4.739 -11.143  -4.212
  106   2HE2  GLN  13          2HE2      GLN  13  -5.373  -9.540  -4.375
  107    H    GLU  14           H        GLU  14  -4.903 -13.658   0.413
  108    HA   GLU  14           HA       GLU  14  -5.660 -12.431   2.623
  109   1HB   GLU  14          1HB       GLU  14  -3.890 -14.688   1.994
  110   2HB   GLU  14          2HB       GLU  14  -3.455 -13.938   3.517
  111   1HG   GLU  14          1HG       GLU  14  -6.352 -14.607   2.878
  112   2HG   GLU  14          2HG       GLU  14  -5.272 -15.821   3.536
  113    HE2  GLU  14           HE       GLU  14  -6.933 -13.365   6.026
  114    H    MET  15           H        MET  15  -2.392 -12.180   1.123
  115    HA   MET  15           HA       MET  15  -1.377 -10.608   3.241
  116   1HB   MET  15          1HB       MET  15  -0.458 -11.843   0.756
  117   2HB   MET  15          2HB       MET  15   0.107 -10.186   0.806
  118   1HG   MET  15          1HG       MET  15   0.440 -11.474   3.422
  119   2HG   MET  15          2HG       MET  15   1.231 -12.406   2.166
  120   1HE   MET  15          1HE       MET  15   2.923 -11.860   3.935
  121   2HE   MET  15          2HE       MET  15   4.126 -11.571   2.652
  122   3HE   MET  15          3HE       MET  15   3.934 -10.396   3.976
  123    H    GLN  16           H        GLN  16  -2.851  -9.972   0.025
  124    HA   GLN  16           HA       GLN  16  -2.196  -7.275  -0.064
  125   1HB   GLN  16          1HB       GLN  16  -2.989  -8.681  -1.998
  126   2HB   GLN  16          2HB       GLN  16  -4.600  -8.679  -1.311
  127   1HG   GLN  16          1HG       GLN  16  -3.570  -5.949  -1.440
  128   2HG   GLN  16          2HG       GLN  16  -3.446  -6.709  -3.014
  129   1HE2  GLN  16          1HE2      GLN  16  -5.032  -5.177  -3.684
  130   2HE2  GLN  16          2HE2      GLN  16  -6.720  -5.456  -3.414
  131    H    LYS  17           H        LYS  17  -4.814  -9.095   1.529
  132    HA   LYS  17           HA       LYS  17  -6.366  -6.761   2.089
  133   1HB   LYS  17          1HB       LYS  17  -7.061  -9.294   1.855
  134   2HB   LYS  17          2HB       LYS  17  -6.663  -9.361   3.561
  135   1HG   LYS  17          1HG       LYS  17  -8.369  -7.059   2.636
  136   2HG   LYS  17          2HG       LYS  17  -9.117  -8.643   2.676
  137   1HD   LYS  17          1HD       LYS  17  -7.612  -7.445   5.047
  138   2HD   LYS  17          2HD       LYS  17  -9.342  -7.276   4.825
  139   1HE   LYS  17          1HE       LYS  17  -8.367 -10.075   4.572
  140   2HE   LYS  17          2HE       LYS  17  -8.107  -9.376   6.157
  141   1HZ   LYS  17          1HZ       LYS  17 -10.689  -8.666   5.386
  142   2HZ   LYS  17          2HZ       LYS  17 -10.545 -10.248   5.031
  143    H    GLU  18           H        GLU  18  -3.909  -8.768   3.776
  144    HA   GLU  18           HA       GLU  18  -4.239  -7.471   6.234
  145   1HB   GLU  18          1HB       GLU  18  -3.173  -9.731   5.882
  146   2HB   GLU  18          2HB       GLU  18  -1.785  -8.936   5.165
  147   1HG   GLU  18          1HG       GLU  18  -1.161  -9.257   7.440
  148   2HG   GLU  18          2HG       GLU  18  -1.615  -7.565   7.356
  149    HE2  GLU  18           HE       GLU  18  -2.110 -10.075   9.392
  150    H    ILE  19           H        ILE  19  -1.986  -7.013   3.445
  151    HA   ILE  19           HA       ILE  19  -0.533  -4.937   4.705
  152    HB   ILE  19           HB       ILE  19   0.600  -4.721   2.669
  153   1HG1  ILE  19          1HG1      ILE  19  -1.824  -5.976   1.360
  154   2HG1  ILE  19          2HG1      ILE  19  -1.213  -4.348   1.142
  155   1HG2  ILE  19          1HG2      ILE  19   0.360  -7.430   1.976
  156   2HG2  ILE  19          2HG2      ILE  19   1.532  -6.690   3.094
  157   3HG2  ILE  19          3HG2      ILE  19  -0.002  -7.347   3.718
  158   1HD1  ILE  19          1HD1      ILE  19  -0.170  -5.246  -0.688
  159   2HD1  ILE  19          2HD1      ILE  19   1.031  -5.804   0.503
  160   3HD1  ILE  19          3HD1      ILE  19  -0.258  -6.904  -0.045
  161    H    ALA  20           H        ALA  20  -3.253  -5.044   2.323
  162    HA   ALA  20           HA       ALA  20  -3.437  -2.317   1.897
  163   1HB   ALA  20          1HB       ALA  20  -5.809  -2.876   1.267
  164   2HB   ALA  20          2HB       ALA  20  -4.593  -3.934   0.513
  165   3HB   ALA  20          3HB       ALA  20  -5.539  -4.516   1.905
  166    H    LEU  21           H        LEU  21  -4.573  -4.381   4.586
  167    HA   LEU  21           HA       LEU  21  -6.271  -2.439   5.725
  168   1HB   LEU  21          1HB       LEU  21  -6.625  -4.704   6.257
  169   2HB   LEU  21          2HB       LEU  21  -4.956  -4.951   6.729
  170    HG   LEU  21           HG       LEU  21  -5.959  -2.922   8.432
  171   1HD1  LEU  21          1HD1      LEU  21  -7.928  -3.816   9.419
  172   2HD1  LEU  21          2HD1      LEU  21  -8.220  -3.724   7.664
  173   3HD1  LEU  21          3HD1      LEU  21  -7.842  -5.290   8.422
  174   1HD2  LEU  21          1HD2      LEU  21  -5.079  -4.227  10.063
  175   2HD2  LEU  21          2HD2      LEU  21  -5.797  -5.722   9.419
  176   3HD2  LEU  21          3HD2      LEU  21  -4.335  -5.041   8.665
  177    H    ILE  22           H        ILE  22  -2.936  -3.560   6.657
  178    HA   ILE  22           HA       ILE  22  -2.555  -1.571   8.563
  179    HB   ILE  22           HB       ILE  22  -0.536  -3.088   6.906
  180   1HG1  ILE  22          1HG1      ILE  22  -1.663  -3.730   9.646
  181   2HG1  ILE  22          2HG1      ILE  22  -2.174  -4.499   8.156
  182   1HG2  ILE  22          1HG2      ILE  22  -0.182  -1.642   9.545
  183   2HG2  ILE  22          2HG2      ILE  22   1.048  -2.603   8.690
  184   3HG2  ILE  22          3HG2      ILE  22   0.433  -1.097   7.966
  185   1HD1  ILE  22          1HD1      ILE  22   0.645  -4.531   9.326
  186   2HD1  ILE  22          2HD1      ILE  22  -0.486  -5.902   9.239
  187   3HD1  ILE  22          3HD1      ILE  22   0.206  -5.223   7.746
  188    H    LEU  23           H        LEU  23  -2.516  -1.489   5.057
  189    HA   LEU  23           HA       LEU  23  -1.001   0.974   5.000
  190   1HB   LEU  23          1HB       LEU  23  -0.970  -1.003   3.308
  191   2HB   LEU  23          2HB       LEU  23  -2.425  -0.264   2.667
  192    HG   LEU  23           HG       LEU  23  -1.097   1.884   2.406
  193   1HD1  LEU  23          1HD1      LEU  23   1.352   0.143   2.639
  194   2HD1  LEU  23          2HD1      LEU  23   1.237   1.918   2.552
  195   3HD1  LEU  23          3HD1      LEU  23   0.716   1.062   4.024
  196   1HD2  LEU  23          1HD2      LEU  23  -0.121   1.211   0.301
  197   2HD2  LEU  23          2HD2      LEU  23  -0.126  -0.497   0.804
  198   3HD2  LEU  23          3HD2      LEU  23  -1.664   0.358   0.542
  199    H    GLN  24           H        GLN  24  -4.249  -0.069   5.497
  200    HA   GLN  24           HA       GLN  24  -5.193   2.569   4.689
  201   1HB   GLN  24          1HB       GLN  24  -6.446  -0.157   4.683
  202   2HB   GLN  24          2HB       GLN  24  -7.500   1.194   5.050
  203   1HG   GLN  24          1HG       GLN  24  -7.392   2.040   2.913
  204   2HG   GLN  24          2HG       GLN  24  -5.688   1.670   2.740
  205   1HE2  GLN  24          1HE2      GLN  24  -8.907   0.201   2.884
  206   2HE2  GLN  24          2HE2      GLN  24  -8.603  -1.123   1.808
  207    H    ARG  25           H        ARG  25  -4.252   0.685   7.347
  208    HA   ARG  25           HA       ARG  25  -6.081   2.139   9.082
  209   1HB   ARG  25          1HB       ARG  25  -4.938  -0.601   9.141
  210   2HB   ARG  25          2HB       ARG  25  -4.805   0.226  10.681
  211   1HG   ARG  25          1HG       ARG  25  -6.952  -1.068  10.432
  212   2HG   ARG  25          2HG       ARG  25  -7.206   0.635  10.763
  213   1HD   ARG  25          1HD       ARG  25  -7.693   1.099   8.413
  214   2HD   ARG  25          2HD       ARG  25  -7.197  -0.511   7.933
  215    HE   ARG  25           HE       ARG  25  -9.264  -0.774   9.886
  216   1HH1  ARG  25          2HH2      ARG  25  -8.853   0.338   6.547
  217   2HH1  ARG  25          1HH2      ARG  25 -10.483  -0.030   6.092
  218   1HH2  ARG  25          1HH       ARG  25 -11.972  -0.969   7.719
  219    H    GLU  26           H        GLU  26  -2.695   0.781   9.015
  220    HA   GLU  26           HA       GLU  26  -1.805   2.504  11.027
  221   1HB   GLU  26          1HB       GLU  26   0.079   1.238  10.912
  222   2HB   GLU  26          2HB       GLU  26  -0.830   0.241   9.793
  223   1HG   GLU  26          1HG       GLU  26   1.084   0.688   8.525
  224   2HG   GLU  26          2HG       GLU  26   0.017   1.963   7.968
  225    HE2  GLU  26           HE       GLU  26   2.405   3.266  10.874
  226    H    ILE  27           H        ILE  27  -2.635   3.077   7.768
  227    HA   ILE  27           HA       ILE  27  -0.664   5.174   7.399
  228    HB   ILE  27           HB       ILE  27  -1.734   3.417   5.680
  229   1HG1  ILE  27          1HG1      ILE  27  -0.614   6.181   5.258
  230   2HG1  ILE  27          2HG1      ILE  27   0.178   4.629   5.073
  231   1HG2  ILE  27          1HG2      ILE  27  -3.992   4.217   5.790
  232   2HG2  ILE  27          2HG2      ILE  27  -3.471   5.888   5.472
  233   3HG2  ILE  27          3HG2      ILE  27  -3.316   4.650   4.201
  234   1HD1  ILE  27          1HD1      ILE  27  -0.239   5.214   2.840
  235   2HD1  ILE  27          2HD1      ILE  27  -1.657   4.206   3.211
  236   3HD1  ILE  27          3HD1      ILE  27  -1.799   5.981   3.228
  237    H    LYS  28           H        LYS  28  -1.850   7.251   6.254
  238    HA   LYS  28           HA       LYS  28  -3.730   8.133   8.318
  239   1HB   LYS  28          1HB       LYS  28  -3.045  10.429   7.524
  240   2HB   LYS  28          2HB       LYS  28  -1.800   9.494   8.324
  241   1HG   LYS  28          1HG       LYS  28  -1.788   8.918   5.461
  242   2HG   LYS  28          2HG       LYS  28  -1.691  10.648   5.720
  243   1HD   LYS  28          1HD       LYS  28   0.570   9.611   5.670
  244   2HD   LYS  28          2HD       LYS  28   0.247  10.365   7.219
  245   1HE   LYS  28          1HE       LYS  28  -0.606   7.979   7.947
  246   2HE   LYS  28          2HE       LYS  28   0.262   7.405   6.535
  247   1HZ   LYS  28          1HZ       LYS  28   2.265   7.887   7.495
  248   2HZ   LYS  28          2HZ       LYS  28   1.740   9.215   8.279
  249    H    ASP  29           H        ASP  29  -5.413   6.815   7.153
  250    HA   ASP  29           HA       ASP  29  -6.166   7.910   4.605
  251   1HB   ASP  29          1HB       ASP  29  -6.850   5.759   4.369
  252   2HB   ASP  29          2HB       ASP  29  -6.593   5.443   6.073
  253    HD2  ASP  29           HD       ASP  29  -9.876   4.649   6.006
  254    HA   PRO  30           HA       PRO  30  -9.841   8.999   7.451
  255   1HB   PRO  30          1HB       PRO  30  -9.724   8.442  10.124
  256   2HB   PRO  30          2HB       PRO  30 -10.487   7.381   8.956
  257   1HG   PRO  30          1HG       PRO  30  -7.881   7.069  10.317
  258   2HG   PRO  30          2HG       PRO  30  -8.843   5.855   9.496
  259   1HD   PRO  30          1HD       PRO  30  -6.483   7.142   8.494
  260   2HD   PRO  30          2HD       PRO  30  -7.510   6.016   7.630
  261    H    ARG  31           H        ARG  31  -6.641   9.623   8.094
  262    HA   ARG  31           HA       ARG  31  -7.197  11.852   9.783
  263   1HB   ARG  31          1HB       ARG  31  -5.102  10.834  10.250
  264   2HB   ARG  31          2HB       ARG  31  -4.710  10.625   8.556
  265   1HG   ARG  31          1HG       ARG  31  -4.559  13.167   8.358
  266   2HG   ARG  31          2HG       ARG  31  -4.755  13.260  10.098
  267   1HD   ARG  31          1HD       ARG  31  -2.732  11.490  10.084
  268   2HD   ARG  31          2HD       ARG  31  -2.423  12.186   8.506
  269    HE   ARG  31           HE       ARG  31  -2.838  14.330  10.347
  270   1HH1  ARG  31          2HH2      ARG  31  -0.461  11.787   9.679
  271   2HH1  ARG  31          1HH2      ARG  31   0.867  12.685  10.332
  272   1HH2  ARG  31          1HH       ARG  31   0.478  14.874  11.227
  273    H    LEU  32           H        LEU  32  -6.179  11.208   6.374
  274    HA   LEU  32           HA       LEU  32  -5.970  13.972   5.725
  275   1HB   LEU  32          1HB       LEU  32  -5.702  11.366   4.346
  276   2HB   LEU  32          2HB       LEU  32  -6.161  12.726   3.340
  277    HG   LEU  32           HG       LEU  32  -4.160  13.970   4.164
  278   1HD1  LEU  32          1HD1      LEU  32  -2.346  12.457   5.192
  279   2HD1  LEU  32          2HD1      LEU  32  -3.641  13.068   6.250
  280   3HD1  LEU  32          3HD1      LEU  32  -3.695  11.391   5.652
  281   1HD2  LEU  32          1HD2      LEU  32  -2.979  13.194   2.429
  282   2HD2  LEU  32          2HD2      LEU  32  -2.918  11.538   3.083
  283   3HD2  LEU  32          3HD2      LEU  32  -4.352  12.087   2.181
  284    H    GLY  33           H        GLY  33  -8.561  11.630   5.996
  285   1HA   GLY  33          1HA       GLY  33 -10.798  12.262   6.078
  286   2HA   GLY  33          2HA       GLY  33 -10.449  13.690   5.123
  287    H    MET  34           H        MET  34  -8.880  10.806   3.966
  288    HA   MET  34           HA       MET  34 -11.081  10.337   2.121
  289   1HB   MET  34          1HB       MET  34  -8.106  10.569   1.398
  290   2HB   MET  34          2HB       MET  34  -9.382  10.172   0.266
  291   1HG   MET  34          1HG       MET  34  -9.257  12.461  -0.117
  292   2HG   MET  34          2HG       MET  34 -10.449  12.465   1.168
  293   1HE   MET  34          1HE       MET  34  -6.952  14.898   0.990
  294   2HE   MET  34          2HE       MET  34  -6.389  13.269   0.553
  295   3HE   MET  34          3HE       MET  34  -7.818  13.960  -0.251
  296    H    MET  35           H        MET  35 -11.204   8.162   1.269
  297    HA   MET  35           HA       MET  35  -9.799   6.297   2.980
  298   1HB   MET  35          1HB       MET  35 -12.448   6.499   2.039
  299   2HB   MET  35          2HB       MET  35 -11.777   5.239   1.024
  300   1HG   MET  35          1HG       MET  35 -10.872   4.187   3.242
  301   2HG   MET  35          2HG       MET  35 -11.966   5.283   4.062
  302   1HE   MET  35          1HE       MET  35 -13.196   2.406   4.837
  303   2HE   MET  35          2HE       MET  35 -13.024   1.344   3.419
  304   3HE   MET  35          3HE       MET  35 -11.624   2.273   4.011
  305    H    THR  36           H        THR  36  -7.816   5.698   2.182
  306    HA   THR  36           HA       THR  36  -7.185   5.746  -0.564
  307    HB   THR  36           HB       THR  36  -5.089   4.647   0.266
  308    HG1  THR  36           HG1      THR  36  -5.164   3.921   2.487
  309   1HG2  THR  36          1HG2      THR  36  -5.725   7.166   0.870
  310   2HG2  THR  36          2HG2      THR  36  -5.925   6.507   2.512
  311   3HG2  THR  36          3HG2      THR  36  -4.351   6.385   1.688
  312    H    THR  37           H        THR  37  -6.731   4.020  -2.031
  313    HA   THR  37           HA       THR  37  -8.105   1.515  -1.336
  314    HB   THR  37           HB       THR  37  -8.476   3.388  -3.696
  315    HG1  THR  37           HG1      THR  37  -9.875   3.136  -1.687
  316   1HG2  THR  37          1HG2      THR  37  -7.934   1.080  -4.628
  317   2HG2  THR  37          2HG2      THR  37  -9.248   0.425  -3.622
  318   3HG2  THR  37          3HG2      THR  37  -9.614   1.586  -4.920
  319    H    VAL  38           H        VAL  38  -7.439  -0.345  -2.710
  320    HA   VAL  38           HA       VAL  38  -4.658   0.016  -3.589
  321    HB   VAL  38           HB       VAL  38  -5.917  -2.217  -1.994
  322   1HG1  VAL  38          1HG1      VAL  38  -4.387  -2.988  -3.888
  323   2HG1  VAL  38          2HG1      VAL  38  -3.065  -2.185  -3.007
  324   3HG1  VAL  38          3HG1      VAL  38  -3.959  -3.523  -2.245
  325   1HG2  VAL  38          1HG2      VAL  38  -5.252  -0.466  -0.543
  326   2HG2  VAL  38          2HG2      VAL  38  -3.946  -1.673  -0.466
  327   3HG2  VAL  38          3HG2      VAL  38  -3.736  -0.194  -1.434
  328    H    SER  39           H        SER  39  -5.363   0.342  -5.771
  329    HA   SER  39           HA       SER  39  -6.903  -1.813  -6.910
  330   1HB   SER  39          1HB       SER  39  -6.730   0.959  -7.397
  331   2HB   SER  39          2HB       SER  39  -5.950   0.232  -8.788
  332    HG   SER  39           HG       SER  39  -8.342  -1.033  -8.015
  333    H    GLY  40           H        GLY  40  -4.122  -2.253  -5.917
  334   1HA   GLY  40          1HA       GLY  40  -3.110  -3.752  -8.072
  335   2HA   GLY  40          2HA       GLY  40  -2.230  -2.238  -7.979
  336    H    VAL  41           H        VAL  41  -1.653  -5.246  -7.267
  337    HA   VAL  41           HA       VAL  41  -0.143  -4.584  -4.894
  338    HB   VAL  41           HB       VAL  41  -2.287  -5.321  -3.993
  339   1HG1  VAL  41          1HG1      VAL  41  -2.312  -8.094  -4.540
  340   2HG1  VAL  41          2HG1      VAL  41  -3.491  -6.866  -5.060
  341   3HG1  VAL  41          3HG1      VAL  41  -2.112  -7.277  -6.109
  342   1HG2  VAL  41          1HG2      VAL  41   0.244  -6.282  -3.318
  343   2HG2  VAL  41          2HG2      VAL  41  -1.214  -6.313  -2.299
  344   3HG2  VAL  41          3HG2      VAL  41  -0.796  -7.727  -3.297
  345    H    GLU  42           H        GLU  42   1.836  -5.590  -4.934
  346    HA   GLU  42           HA       GLU  42   2.076  -7.914  -6.647
  347   1HB   GLU  42          1HB       GLU  42   3.791  -5.404  -6.883
  348   2HB   GLU  42          2HB       GLU  42   4.205  -6.937  -7.625
  349   1HG   GLU  42          1HG       GLU  42   2.579  -6.751  -9.253
  350   2HG   GLU  42          2HG       GLU  42   1.423  -6.006  -8.167
  351    HE2  GLU  42           HE       GLU  42   1.888  -3.948 -10.563
  352    H    MET  43           H        MET  43   3.117  -9.508  -5.535
  353    HA   MET  43           HA       MET  43   4.966  -8.618  -3.457
  354   1HB   MET  43          1HB       MET  43   3.710 -11.309  -3.143
  355   2HB   MET  43          2HB       MET  43   3.950 -10.057  -1.939
  356   1HG   MET  43          1HG       MET  43   2.040  -8.759  -3.159
  357   2HG   MET  43          2HG       MET  43   1.700 -10.268  -3.982
  358   1HE   MET  43          1HE       MET  43   0.765  -8.588  -0.190
  359   2HE   MET  43          2HE       MET  43   0.618  -8.128  -1.904
  360   3HE   MET  43          3HE       MET  43  -0.671  -9.073  -1.125
  361    H    SER  44           H        SER  44   6.991  -9.002  -4.285
  362    HA   SER  44           HA       SER  44   7.338 -11.544  -5.666
  363   1HB   SER  44          1HB       SER  44   8.546  -8.820  -5.998
  364   2HB   SER  44          2HB       SER  44   9.615 -10.183  -6.272
  365    HG   SER  44           HG       SER  44   7.526  -9.227  -7.841
  366    H    ARG  45           H        ARG  45   8.067 -13.062  -4.205
  367    HA   ARG  45           HA       ARG  45   9.912 -12.123  -2.178
  368   1HB   ARG  45          1HB       ARG  45   7.840 -14.230  -2.329
  369   2HB   ARG  45          2HB       ARG  45   9.340 -14.827  -1.645
  370   1HG   ARG  45          1HG       ARG  45   8.872 -13.802   0.319
  371   2HG   ARG  45          2HG       ARG  45   8.856 -12.242  -0.482
  372   1HD   ARG  45          1HD       ARG  45   6.678 -12.399   0.450
  373   2HD   ARG  45          2HD       ARG  45   6.428 -12.844  -1.226
  374    HE   ARG  45           HE       ARG  45   7.033 -15.166   0.423
  375   1HH1  ARG  45          2HH2      ARG  45   4.422 -12.974  -0.543
  376   2HH1  ARG  45          1HH2      ARG  45   3.169 -14.127  -0.224
  377   1HH2  ARG  45          1HH       ARG  45   3.756 -16.303   0.591
  378    H    ASP  46           H        ASP  46   9.915 -13.491  -5.258
  379    HA   ASP  46           HA       ASP  46  11.535 -15.629  -5.197
  380   1HB   ASP  46          1HB       ASP  46  11.053 -13.377  -7.094
  381   2HB   ASP  46          2HB       ASP  46  12.550 -14.247  -7.365
  382    HD2  ASP  46           HD       ASP  46  11.210 -14.617  -9.351
  383    H    LEU  47           H        LEU  47  12.243 -12.284  -4.358
  384    HA   LEU  47           HA       LEU  47  14.975 -13.042  -3.727
  385   1HB   LEU  47          1HB       LEU  47  14.198 -11.189  -5.870
  386   2HB   LEU  47          2HB       LEU  47  15.346 -10.518  -4.728
  387    HG   LEU  47           HG       LEU  47  15.911 -13.238  -5.831
  388   1HD1  LEU  47          1HD1      LEU  47  16.709 -10.830  -7.443
  389   2HD1  LEU  47          2HD1      LEU  47  16.642 -12.543  -7.916
  390   3HD1  LEU  47          3HD1      LEU  47  15.136 -11.618  -7.710
  391   1HD2  LEU  47          1HD2      LEU  47  17.966 -12.870  -5.044
  392   2HD2  LEU  47          2HD2      LEU  47  18.045 -11.241  -5.758
  393   3HD2  LEU  47          3HD2      LEU  47  17.258 -11.484  -4.180
  394    H    ALA  48           H        ALA  48  13.028  -9.978  -3.891
  395    HA   ALA  48           HA       ALA  48  12.224  -9.863  -1.295
  396   1HB   ALA  48          1HB       ALA  48  14.077  -8.236  -0.427
  397   2HB   ALA  48          2HB       ALA  48  14.373  -9.990  -0.363
  398   3HB   ALA  48          3HB       ALA  48  15.100  -9.010  -1.660
  399    H    TYR  49           H        TYR  49  10.656  -9.014  -2.962
  400    HA   TYR  49           HA       TYR  49  10.856  -6.131  -2.995
  401   1HB   TYR  49          1HB       TYR  49  10.349  -7.790  -5.532
  402   2HB   TYR  49          2HB       TYR  49  10.606  -6.057  -5.457
  403    HD1  TYR  49           HD1      TYR  49  12.973  -5.379  -4.336
  404    HD2  TYR  49           HD2      TYR  49  12.115  -9.099  -6.269
  405    HE1  TYR  49           HE1      TYR  49  15.453  -5.736  -4.770
  406    HE2  TYR  49           HE2      TYR  49  14.598  -9.442  -6.695
  407    HH   TYR  49           HH       TYR  49  16.926  -6.915  -5.918
  408    H    ALA  50           H        ALA  50   8.832  -5.141  -2.970
  409    HA   ALA  50           HA       ALA  50   6.509  -6.699  -3.676
  410   1HB   ALA  50          1HB       ALA  50   7.342  -6.138  -0.856
  411   2HB   ALA  50          2HB       ALA  50   5.618  -5.947  -1.256
  412   3HB   ALA  50          3HB       ALA  50   6.428  -7.510  -1.525
  413    H    LYS  51           H        LYS  51   5.425  -5.296  -4.957
  414    HA   LYS  51           HA       LYS  51   5.525  -2.464  -4.184
  415   1HB   LYS  51          1HB       LYS  51   4.643  -2.795  -6.878
  416   2HB   LYS  51          2HB       LYS  51   6.086  -2.001  -6.282
  417   1HG   LYS  51          1HG       LYS  51   7.191  -4.301  -6.132
  418   2HG   LYS  51          2HG       LYS  51   5.782  -4.968  -6.932
  419   1HD   LYS  51          1HD       LYS  51   7.283  -4.573  -8.720
  420   2HD   LYS  51          2HD       LYS  51   6.206  -3.193  -8.791
  421   1HE   LYS  51          1HE       LYS  51   8.035  -2.127  -7.122
  422   2HE   LYS  51          2HE       LYS  51   9.078  -3.318  -7.873
  423   1HZ   LYS  51          1HZ       LYS  51   8.993  -1.128  -9.052
  424   2HZ   LYS  51          2HZ       LYS  51   8.609  -2.379 -10.022
  425    H    VAL  52           H        VAL  52   3.693  -1.664  -3.320
  426    HA   VAL  52           HA       VAL  52   1.190  -3.005  -4.084
  427    HB   VAL  52           HB       VAL  52   2.184  -3.234  -1.683
  428   1HG1  VAL  52          1HG1      VAL  52   0.833  -0.523  -1.460
  429   2HG1  VAL  52          2HG1      VAL  52   1.521  -1.484  -0.130
  430   3HG1  VAL  52          3HG1      VAL  52   2.589  -0.805  -1.382
  431   1HG2  VAL  52          1HG2      VAL  52  -0.702  -2.471  -2.237
  432   2HG2  VAL  52          2HG2      VAL  52   0.013  -4.101  -2.302
  433   3HG2  VAL  52          3HG2      VAL  52  -0.128  -3.251  -0.743
  434    H    TYR  53           H        TYR  53  -0.372  -1.729  -4.980
  435    HA   TYR  53           HA       TYR  53   0.311   1.037  -5.430
  436   1HB   TYR  53          1HB       TYR  53  -1.100  -1.097  -6.686
  437   2HB   TYR  53          2HB       TYR  53  -2.380  -0.017  -6.172
  438    HD1  TYR  53           HD1      TYR  53  -3.142   1.355  -7.868
  439    HD2  TYR  53           HD2      TYR  53   1.034   0.443  -7.685
  440    HE1  TYR  53           HE1      TYR  53  -2.726   2.811  -9.911
  441    HE2  TYR  53           HE2      TYR  53   1.436   1.900  -9.728
  442    HH   TYR  53           HH       TYR  53  -1.262   3.297 -11.502
  443    H    VAL  54           H        VAL  54  -1.054   2.849  -4.896
  444    HA   VAL  54           HA       VAL  54  -3.226   2.369  -3.053
  445    HB   VAL  54           HB       VAL  54  -1.942   4.250  -1.613
  446   1HG1  VAL  54          1HG1      VAL  54  -1.415   1.295  -1.198
  447   2HG1  VAL  54          2HG1      VAL  54  -1.573   2.569   0.033
  448   3HG1  VAL  54          3HG1      VAL  54  -2.997   2.054  -0.902
  449   1HG2  VAL  54          1HG2      VAL  54   0.232   2.463  -2.752
  450   2HG2  VAL  54          2HG2      VAL  54   0.101   4.232  -2.900
  451   3HG2  VAL  54          3HG2      VAL  54   0.420   3.493  -1.312
  452    H    THR  55           H        THR  55  -4.838   3.630  -3.810
  453    HA   THR  55           HA       THR  55  -4.057   6.121  -5.170
  454    HB   THR  55           HB       THR  55  -5.251   4.974  -6.801
  455    HG1  THR  55           HG1      THR  55  -7.317   5.921  -6.691
  456   1HG2  THR  55          1HG2      THR  55  -5.619   2.843  -5.712
  457   2HG2  THR  55          2HG2      THR  55  -6.655   3.585  -4.469
  458   3HG2  THR  55          3HG2      THR  55  -7.237   3.447  -6.146
  459    H    PHE  56           H        PHE  56  -4.539   8.032  -4.285
  460    HA   PHE  56           HA       PHE  56  -6.481   7.972  -2.084
  461   1HB   PHE  56          1HB       PHE  56  -4.193   9.953  -2.596
  462   2HB   PHE  56          2HB       PHE  56  -5.080   9.749  -1.098
  463    HD1  PHE  56           HD1      PHE  56  -4.175   8.433   0.581
  464    HD2  PHE  56           HD2      PHE  56  -2.845   7.859  -3.406
  465    HE1  PHE  56           HE1      PHE  56  -2.427   6.824   1.395
  466    HE2  PHE  56           HE2      PHE  56  -1.097   6.250  -2.593
  467    HZ   PHE  56           HZ       PHE  56  -0.910   5.752  -0.202
  468    H    LEU  57           H        LEU  57  -7.538  10.188  -1.691
  469    HA   LEU  57           HA       LEU  57  -8.234  11.295  -4.315
  470   1HB   LEU  57          1HB       LEU  57 -10.016  10.194  -2.994
  471   2HB   LEU  57          2HB       LEU  57  -9.770  11.366  -1.715
  472    HG   LEU  57           HG       LEU  57 -10.206  13.061  -3.773
  473   1HD1  LEU  57          1HD1      LEU  57 -11.358  12.258  -5.515
  474   2HD1  LEU  57          2HD1      LEU  57 -10.705  10.677  -5.021
  475   3HD1  LEU  57          3HD1      LEU  57 -12.334  11.169  -4.498
  476   1HD2  LEU  57          1HD2      LEU  57 -11.981  13.661  -2.553
  477   2HD2  LEU  57          2HD2      LEU  57 -12.736  12.054  -2.682
  478   3HD2  LEU  57          3HD2      LEU  57 -11.486  12.353  -1.450
  479    H    ASN  58           H        ASN  58  -5.777  11.932  -2.716
  480    HA   ASN  58           HA       ASN  58  -6.212  14.380  -1.442
  481   1HB   ASN  58          1HB       ASN  58  -3.931  12.661  -2.189
  482   2HB   ASN  58          2HB       ASN  58  -3.529  14.359  -2.353
  483   1HD2  ASN  58          1HD2      ASN  58  -5.041  15.530  -0.404
  484   2HD2  ASN  58          2HD2      ASN  58  -4.523  15.026   1.170
  485    H    ASP  59           H        ASP  59  -5.572  13.307  -4.782
  486    HA   ASP  59           HA       ASP  59  -4.479  15.329  -6.032
  487   1HB   ASP  59          1HB       ASP  59  -5.243  13.579  -7.409
  488   2HB   ASP  59          2HB       ASP  59  -6.858  13.609  -6.729
  489    HD2  ASP  59           HD       ASP  59  -5.029  16.172  -8.519
  490    H    LYS  60           H        LYS  60  -7.900  15.181  -4.859
  491    HA   LYS  60           HA       LYS  60  -9.056  17.324  -5.935
  492   1HB   LYS  60          1HB       LYS  60  -9.196  16.047  -3.249
  493   2HB   LYS  60          2HB       LYS  60  -9.952  17.620  -3.412
  494   1HG   LYS  60          1HG       LYS  60 -10.663  16.107  -5.748
  495   2HG   LYS  60          2HG       LYS  60 -10.899  15.053  -4.369
  496   1HD   LYS  60          1HD       LYS  60 -11.923  17.904  -4.255
  497   2HD   LYS  60          2HD       LYS  60 -12.839  16.696  -5.135
  498   1HE   LYS  60          1HE       LYS  60 -13.079  15.307  -3.145
  499   2HE   LYS  60          2HE       LYS  60 -11.930  16.284  -2.251
  500   1HZ   LYS  60          1HZ       LYS  60 -13.462  18.085  -2.193
  501   2HZ   LYS  60          2HZ       LYS  60 -14.443  17.436  -3.320
  502    H    ASP  61           H        ASP  61  -6.567  17.378  -3.333
  503    HA   ASP  61           HA       ASP  61  -6.334  20.229  -3.888
  504   1HB   ASP  61          1HB       ASP  61  -5.457  19.222  -1.212
  505   2HB   ASP  61          2HB       ASP  61  -6.206  20.750  -1.631
  506    HD2  ASP  61           HD       ASP  61  -8.289  20.717  -0.427
  507    H    GLU  62           H        GLU  62  -4.308  20.597  -4.799
  508    HA   GLU  62           HA       GLU  62  -2.367  18.589  -4.822
  509   1HB   GLU  62          1HB       GLU  62  -2.816  20.562  -6.489
  510   2HB   GLU  62          2HB       GLU  62  -1.800  21.508  -5.422
  511   1HG   GLU  62          1HG       GLU  62   0.077  19.961  -5.725
  512   2HG   GLU  62          2HG       GLU  62  -0.931  18.835  -6.612
  513    HE2  GLU  62           HE       GLU  62   1.304  20.074  -8.203
  514    H    ASP  63           H        ASP  63  -3.189  21.061  -2.520
  515    HA   ASP  63           HA       ASP  63  -0.614  21.457  -1.484
  516   1HB   ASP  63          1HB       ASP  63  -3.162  22.550  -1.107
  517   2HB   ASP  63          2HB       ASP  63  -2.870  21.734   0.417
  518    HD2  ASP  63           HD       ASP  63  -1.797  23.240   1.889
  519    H    ALA  64           H        ALA  64  -3.451  19.350  -0.689
  520    HA   ALA  64           HA       ALA  64  -2.113  18.164   1.559
  521   1HB   ALA  64          1HB       ALA  64  -4.581  18.556   1.436
  522   2HB   ALA  64          2HB       ALA  64  -4.673  17.365   0.117
  523   3HB   ALA  64          3HB       ALA  64  -4.161  16.853   1.743
  524    H    VAL  65           H        VAL  65  -2.211  17.746  -1.897
  525    HA   VAL  65           HA       VAL  65  -1.665  14.946  -1.881
  526    HB   VAL  65           HB       VAL  65  -2.507  16.823  -3.711
  527   1HG1  VAL  65          1HG1      VAL  65  -0.148  17.545  -4.043
  528   2HG1  VAL  65          2HG1      VAL  65   0.251  15.895  -4.579
  529   3HG1  VAL  65          3HG1      VAL  65  -0.894  16.884  -5.518
  530   1HG2  VAL  65          1HG2      VAL  65  -3.307  14.850  -4.395
  531   2HG2  VAL  65          2HG2      VAL  65  -1.759  14.609  -5.242
  532   3HG2  VAL  65          3HG2      VAL  65  -1.984  13.960  -3.600
  533    H    LYS  66           H        LYS  66   0.255  17.992  -2.119
  534    HA   LYS  66           HA       LYS  66   2.708  16.569  -2.438
  535   1HB   LYS  66          1HB       LYS  66   1.838  19.145  -2.922
  536   2HB   LYS  66          2HB       LYS  66   2.851  19.355  -1.508
  537   1HG   LYS  66          1HG       LYS  66   4.655  19.271  -2.879
  538   2HG   LYS  66          2HG       LYS  66   4.316  17.569  -3.127
  539   1HD   LYS  66          1HD       LYS  66   2.612  19.375  -4.761
  540   2HD   LYS  66          2HD       LYS  66   4.321  19.506  -5.120
  541   1HE   LYS  66          1HE       LYS  66   3.873  16.722  -4.894
  542   2HE   LYS  66          2HE       LYS  66   2.458  17.321  -5.740
  543   1HZ   LYS  66          1HZ       LYS  66   5.196  18.090  -6.574
  544   2HZ   LYS  66          2HZ       LYS  66   4.461  16.763  -7.166
  545    H    ALA  67           H        ALA  67   1.133  18.417   0.260
  546    HA   ALA  67           HA       ALA  67   3.142  17.840   2.125
  547   1HB   ALA  67          1HB       ALA  67   1.826  19.071   3.529
  548   2HB   ALA  67          2HB       ALA  67   0.984  19.488   2.017
  549   3HB   ALA  67          3HB       ALA  67   0.341  18.204   3.069
  550    H    GLY  68           H        GLY  68  -0.091  16.307   1.499
  551   1HA   GLY  68          1HA       GLY  68   0.012  14.342   3.438
  552   2HA   GLY  68          2HA       GLY  68  -0.838  14.227   1.910
  553    H    ILE  69           H        ILE  69   0.856  13.939  -0.084
  554    HA   ILE  69           HA       ILE  69   1.900  11.395   0.199
  555    HB   ILE  69           HB       ILE  69   1.233  12.766  -1.878
  556   1HG1  ILE  69          1HG1      ILE  69   3.699  11.015  -2.052
  557   2HG1  ILE  69          2HG1      ILE  69   2.083  10.396  -1.783
  558   1HG2  ILE  69          1HG2      ILE  69   3.075  14.504  -1.283
  559   2HG2  ILE  69          2HG2      ILE  69   4.171  13.354  -2.085
  560   3HG2  ILE  69          3HG2      ILE  69   2.804  14.053  -2.984
  561   1HD1  ILE  69          1HD1      ILE  69   1.932  10.323  -4.057
  562   2HD1  ILE  69          2HD1      ILE  69   1.687  12.083  -3.956
  563   3HD1  ILE  69          3HD1      ILE  69   3.312  11.427  -4.268
  564    H    LYS  70           H        LYS  70   3.271  14.578   0.928
  565    HA   LYS  70           HA       LYS  70   5.967  13.731   0.979
  566   1HB   LYS  70          1HB       LYS  70   5.559  16.038   0.687
  567   2HB   LYS  70          2HB       LYS  70   4.472  16.120   2.058
  568   1HG   LYS  70          1HG       LYS  70   6.432  15.525   3.568
  569   2HG   LYS  70          2HG       LYS  70   7.484  15.626   2.170
  570   1HD   LYS  70          1HD       LYS  70   5.681  17.978   2.638
  571   2HD   LYS  70          2HD       LYS  70   6.964  17.745   3.810
  572   1HE   LYS  70          1HE       LYS  70   7.953  19.127   2.142
  573   2HE   LYS  70          2HE       LYS  70   8.573  17.526   1.787
  574   1HZ   LYS  70          1HZ       LYS  70   6.737  19.135   0.235
  575   2HZ   LYS  70          2HZ       LYS  70   7.760  17.973  -0.269
  576    H    ALA  71           H        ALA  71   3.243  13.621   3.264
  577    HA   ALA  71           HA       ALA  71   4.960  12.938   5.474
  578   1HB   ALA  71          1HB       ALA  71   2.718  12.620   6.614
  579   2HB   ALA  71          2HB       ALA  71   2.987  14.242   5.932
  580   3HB   ALA  71          3HB       ALA  71   1.948  13.077   5.075
  581    H    LEU  72           H        LEU  72   2.602  11.310   3.265
  582    HA   LEU  72           HA       LEU  72   2.674   8.815   4.445
  583   1HB   LEU  72          1HB       LEU  72   1.049   9.465   2.788
  584   2HB   LEU  72          2HB       LEU  72   2.293   9.634   1.565
  585    HG   LEU  72           HG       LEU  72   2.694   7.253   1.534
  586   1HD1  LEU  72          1HD1      LEU  72   2.273   6.956   4.016
  587   2HD1  LEU  72          2HD1      LEU  72   0.541   6.872   3.619
  588   3HD1  LEU  72          3HD1      LEU  72   1.667   5.666   2.951
  589   1HD2  LEU  72          1HD2      LEU  72  -0.176   6.934   1.435
  590   2HD2  LEU  72          2HD2      LEU  72   0.310   8.492   0.728
  591   3HD2  LEU  72          3HD2      LEU  72   1.013   6.979   0.112
  592    H    GLN  73           H        GLN  73   4.976  10.437   2.243
  593    HA   GLN  73           HA       GLN  73   6.456   8.054   1.824
  594   1HB   GLN  73          1HB       GLN  73   8.064   9.547   0.672
  595   2HB   GLN  73          2HB       GLN  73   6.421   9.844   0.135
  596   1HG   GLN  73          1HG       GLN  73   6.271  11.770   1.760
  597   2HG   GLN  73          2HG       GLN  73   7.941  11.490   2.213
  598   1HE2  GLN  73          1HE2      GLN  73   9.307  12.802   1.301
  599   2HE2  GLN  73          2HE2      GLN  73   9.221  13.484  -0.289
  600    H    GLU  74           H        GLU  74   6.847  11.054   3.815
  601    HA   GLU  74           HA       GLU  74   9.312  10.489   4.838
  602   1HB   GLU  74          1HB       GLU  74   8.938  12.333   6.135
  603   2HB   GLU  74          2HB       GLU  74   7.502  12.502   5.146
  604   1HG   GLU  74          1HG       GLU  74   6.196  11.181   6.837
  605   2HG   GLU  74          2HG       GLU  74   7.632  11.052   7.833
  606    HE2  GLU  74           HE       GLU  74   7.999  13.704   9.038
  607    H    ALA  75           H        ALA  75   6.269   8.878   5.384
  608    HA   ALA  75           HA       ALA  75   7.394   7.546   7.749
  609   1HB   ALA  75          1HB       ALA  75   5.141   8.858   7.809
  610   2HB   ALA  75          2HB       ALA  75   4.491   7.469   6.906
  611   3HB   ALA  75          3HB       ALA  75   5.198   7.228   8.522
  612    H    SER  76           H        SER  76   7.790   7.166   4.671
  613    HA   SER  76           HA       SER  76   6.492   4.906   3.861
  614   1HB   SER  76          1HB       SER  76   7.863   6.295   2.366
  615   2HB   SER  76          2HB       SER  76   9.320   5.857   3.233
  616    HG   SER  76           HG       SER  76   9.252   3.786   2.412
  617    H    GLY  77           H        GLY  77   9.967   4.972   4.950
  618   1HA   GLY  77          1HA       GLY  77  10.353   2.302   5.319
  619   2HA   GLY  77          2HA       GLY  77  11.137   3.556   6.257
  620    H    PHE  78           H        PHE  78   8.282   4.451   7.188
  621    HA   PHE  78           HA       PHE  78   8.327   2.888   9.564
  622   1HB   PHE  78          1HB       PHE  78   7.248   5.368   8.489
  623   2HB   PHE  78          2HB       PHE  78   5.898   4.460   9.142
  624    HD1  PHE  78           HD1      PHE  78   9.255   5.783  10.026
  625    HD2  PHE  78           HD2      PHE  78   5.490   4.437  11.448
  626    HE1  PHE  78           HE1      PHE  78   9.847   6.566  12.336
  627    HE2  PHE  78           HE2      PHE  78   6.083   5.219  13.758
  628    HZ   PHE  78           HZ       PHE  78   8.254   6.275  14.174
  629    H    ILE  79           H        ILE  79   6.133   3.194   6.705
  630    HA   ILE  79           HA       ILE  79   4.240   1.356   7.742
  631    HB   ILE  79           HB       ILE  79   3.447   1.383   5.332
  632   1HG1  ILE  79          1HG1      ILE  79   5.426   3.649   5.019
  633   2HG1  ILE  79          2HG1      ILE  79   5.762   2.022   4.460
  634   1HG2  ILE  79          1HG2      ILE  79   2.161   2.755   6.599
  635   2HG2  ILE  79          2HG2      ILE  79   3.553   3.653   7.251
  636   3HG2  ILE  79          3HG2      ILE  79   2.959   4.001   5.609
  637   1HD1  ILE  79          1HD1      ILE  79   4.820   2.996   2.544
  638   2HD1  ILE  79          2HD1      ILE  79   3.397   2.220   3.280
  639   3HD1  ILE  79          3HD1      ILE  79   3.663   3.968   3.486
  640    H    ARG  80           H        ARG  80   7.106   1.142   5.584
  641    HA   ARG  80           HA       ARG  80   6.635  -1.492   4.838
  642   1HB   ARG  80          1HB       ARG  80   8.178  -0.280   3.488
  643   2HB   ARG  80          2HB       ARG  80   9.067   0.323   4.872
  644   1HG   ARG  80          1HG       ARG  80  10.155  -1.768   5.247
  645   2HG   ARG  80          2HG       ARG  80   8.980  -2.659   4.299
  646   1HD   ARG  80          1HD       ARG  80  10.697  -2.548   2.736
  647   2HD   ARG  80          2HD       ARG  80   9.862  -1.064   2.324
  648    HE   ARG  80           HE       ARG  80  12.462  -1.295   3.685
  649   1HH1  ARG  80          2HH2      ARG  80   9.736   0.838   2.927
  650   2HH1  ARG  80          1HH2      ARG  80  10.644   2.292   3.177
  651   1HH2  ARG  80          1HH       ARG  80  12.948   2.142   3.819
  652    H    SER  81           H        SER  81   8.653   0.023   7.440
  653    HA   SER  81           HA       SER  81   9.633  -2.441   8.359
  654   1HB   SER  81          1HB       SER  81   9.487   0.316   9.650
  655   2HB   SER  81          2HB       SER  81  10.304  -1.045  10.392
  656    HG   SER  81           HG       SER  81  11.411  -1.116   8.093
  657    H    LEU  82           H        LEU  82   6.766  -0.431   9.027
  658    HA   LEU  82           HA       LEU  82   6.062  -1.669  11.459
  659   1HB   LEU  82          1HB       LEU  82   5.244   0.505  10.892
  660   2HB   LEU  82          2HB       LEU  82   4.507  -0.087   9.417
  661    HG   LEU  82           HG       LEU  82   3.525  -1.452  11.827
  662   1HD1  LEU  82          1HD1      LEU  82   3.454   0.385  13.125
  663   2HD1  LEU  82          2HD1      LEU  82   3.616   1.503  11.749
  664   3HD1  LEU  82          3HD1      LEU  82   2.033   0.788  12.133
  665   1HD2  LEU  82          1HD2      LEU  82   1.967  -1.891  10.306
  666   2HD2  LEU  82          2HD2      LEU  82   1.430  -0.201  10.451
  667   3HD2  LEU  82          3HD2      LEU  82   2.611  -0.654   9.200
  668    H    LEU  83           H        LEU  83   5.543  -2.437   8.013
  669    HA   LEU  83           HA       LEU  83   3.555  -4.395   8.499
  670   1HB   LEU  83          1HB       LEU  83   5.372  -3.822   6.159
  671   2HB   LEU  83          2HB       LEU  83   4.160  -5.088   6.148
  672    HG   LEU  83           HG       LEU  83   3.331  -2.283   6.817
  673   1HD1  LEU  83          1HD1      LEU  83   2.879  -1.977   4.332
  674   2HD1  LEU  83          2HD1      LEU  83   4.569  -1.824   4.866
  675   3HD1  LEU  83          3HD1      LEU  83   4.022  -3.316   4.066
  676   1HD2  LEU  83          1HD2      LEU  83   1.313  -3.161   5.423
  677   2HD2  LEU  83          2HD2      LEU  83   2.030  -4.762   5.733
  678   3HD2  LEU  83          3HD2      LEU  83   1.548  -3.723   7.096
  679    H    GLY  84           H        GLY  84   7.098  -4.616   7.707
  680   1HA   GLY  84          1HA       GLY  84   7.440  -7.314   7.847
  681   2HA   GLY  84          2HA       GLY  84   8.636  -6.134   8.345
  682    H    LYS  85           H        LYS  85   7.563  -4.960  10.618
  683    HA   LYS  85           HA       LYS  85   7.980  -7.012  12.524
  684   1HB   LYS  85          1HB       LYS  85   7.735  -4.092  12.471
  685   2HB   LYS  85          2HB       LYS  85   7.006  -4.805  13.895
  686   1HG   LYS  85          1HG       LYS  85   9.265  -6.249  13.930
  687   2HG   LYS  85          2HG       LYS  85   9.883  -4.915  12.977
  688   1HD   LYS  85          1HD       LYS  85   8.455  -4.543  15.651
  689   2HD   LYS  85          2HD       LYS  85  10.196  -4.684  15.504
  690   1HE   LYS  85          1HE       LYS  85   8.712  -2.630  13.835
  691   2HE   LYS  85          2HE       LYS  85   9.068  -2.286  15.517
  692   1HZ   LYS  85          1HZ       LYS  85  11.433  -2.725  15.025
  693   2HZ   LYS  85          2HZ       LYS  85  11.089  -2.999  13.456
  694    H    ALA  86           H        ALA  86   5.117  -5.225  11.275
  695    HA   ALA  86           HA       ALA  86   3.287  -6.217  13.131
  696   1HB   ALA  86          1HB       ALA  86   2.715  -4.331  11.778
  697   2HB   ALA  86          2HB       ALA  86   3.052  -5.218  10.272
  698   3HB   ALA  86          3HB       ALA  86   1.637  -5.651  11.262
  699    H    MET  87           H        MET  87   4.793  -7.620  10.234
  700    HA   MET  87           HA       MET  87   3.063  -9.941  10.587
  701   1HB   MET  87          1HB       MET  87   3.705  -8.446   8.287
  702   2HB   MET  87          2HB       MET  87   4.779  -9.825   8.160
  703   1HG   MET  87          1HG       MET  87   2.655 -11.276   8.676
  704   2HG   MET  87          2HG       MET  87   1.740  -9.828   8.306
  705   1HE   MET  87          1HE       MET  87   1.374  -9.343   5.076
  706   2HE   MET  87          2HE       MET  87   1.954  -8.475   6.517
  707   3HE   MET  87          3HE       MET  87   3.020  -8.664   5.104
  708    H    ARG  88           H        ARG  88   5.797  -8.942  11.872
  709    HA   ARG  88           HA       ARG  88   7.889  -9.736  12.074
  710   1HB   ARG  88          1HB       ARG  88   5.866 -11.667  13.218
  711   2HB   ARG  88          2HB       ARG  88   7.559 -12.109  13.324
  712   1HG   ARG  88          1HG       ARG  88   7.951  -9.733  14.307
  713   2HG   ARG  88          2HG       ARG  88   6.209  -9.633  14.474
  714   1HD   ARG  88          1HD       ARG  88   7.140 -12.192  15.521
  715   2HD   ARG  88          2HD       ARG  88   8.055 -10.890  16.257
  716    HE   ARG  88           HE       ARG  88   5.148 -10.426  16.160
  717   1HH1  ARG  88          2HH2      ARG  88   7.848 -11.708  18.063
  718   2HH1  ARG  88          1HH2      ARG  88   7.004 -11.588  19.571
  719   1HH2  ARG  88          1HH       ARG  88   4.764 -10.739  19.598
  720    H    LEU  89           H        LEU  89   8.444 -10.015   9.731
  721    HA   LEU  89           HA       LEU  89   8.635 -12.867   9.054
  722   1HB   LEU  89          1HB       LEU  89   7.398 -10.689   7.599
  723   2HB   LEU  89          2HB       LEU  89   8.691 -11.415   6.666
  724    HG   LEU  89           HG       LEU  89   6.760 -13.282   7.952
  725   1HD1  LEU  89          1HD1      LEU  89   5.487 -12.791   5.578
  726   2HD1  LEU  89          2HD1      LEU  89   4.967 -12.194   7.172
  727   3HD1  LEU  89          3HD1      LEU  89   5.937 -11.152   6.104
  728   1HD2  LEU  89          1HD2      LEU  89   8.799 -13.409   6.000
  729   2HD2  LEU  89          2HD2      LEU  89   7.731 -14.714   6.569
  730   3HD2  LEU  89          3HD2      LEU  89   7.261 -13.729   5.162
  731    H    ARG  90           H        ARG  90  10.379 -12.877   7.008
  732    HA   ARG  90           HA       ARG  90  12.638 -11.387   8.082
  733   1HB   ARG  90          1HB       ARG  90  14.085 -13.278   7.623
  734   2HB   ARG  90          2HB       ARG  90  12.694 -13.911   8.479
  735   1HG   ARG  90          1HG       ARG  90  11.655 -14.451   6.199
  736   2HG   ARG  90          2HG       ARG  90  13.188 -14.013   5.469
  737   1HD   ARG  90          1HD       ARG  90  13.287 -15.977   7.746
  738   2HD   ARG  90          2HD       ARG  90  12.608 -16.553   6.237
  739    HE   ARG  90           HE       ARG  90  14.723 -16.326   5.192
  740   1HH1  ARG  90          2HH2      ARG  90  14.808 -14.954   8.458
  741   2HH1  ARG  90          1HH2      ARG  90  16.534 -14.825   8.494
  742   1HH2  ARG  90          1HH       ARG  90  17.804 -15.539   6.590
  743    H    ILE  91           H        ILE  91  11.017 -12.840   5.213
  744    HA   ILE  91           HA       ILE  91  12.674 -12.321   3.190
  745    HB   ILE  91           HB       ILE  91  10.534 -11.660   1.911
  746   1HG1  ILE  91          1HG1      ILE  91   8.934 -12.814   4.107
  747   2HG1  ILE  91          2HG1      ILE  91   9.534 -11.199   4.424
  748   1HG2  ILE  91          1HG2      ILE  91  11.269 -14.235   3.205
  749   2HG2  ILE  91          2HG2      ILE  91   9.665 -14.134   2.442
  750   3HG2  ILE  91          3HG2      ILE  91  11.127 -13.806   1.484
  751   1HD1  ILE  91          1HD1      ILE  91   7.261 -11.761   2.970
  752   2HD1  ILE  91          2HD1      ILE  91   8.186 -10.245   2.843
  753   3HD1  ILE  91          3HD1      ILE  91   8.466 -11.560   1.676
  754    H    VAL  92           H        VAL  92  10.969  -9.912   5.187
  755    HA   VAL  92           HA       VAL  92  10.780  -7.658   4.809
  756    HB   VAL  92           HB       VAL  92  13.754  -8.102   5.139
  757   1HG1  VAL  92          1HG1      VAL  92  12.137  -5.854   6.341
  758   2HG1  VAL  92          2HG1      VAL  92  13.892  -5.957   6.059
  759   3HG1  VAL  92          3HG1      VAL  92  12.782  -5.739   4.686
  760   1HG2  VAL  92          1HG2      VAL  92  13.374  -9.016   7.136
  761   2HG2  VAL  92          2HG2      VAL  92  12.369  -7.627   7.618
  762   3HG2  VAL  92          3HG2      VAL  92  11.629  -9.016   6.783
  763    HA   PRO  93           HA       PRO  93  12.212  -7.629   0.461
  764   1HB   PRO  93          1HB       PRO  93   9.795  -7.736  -0.807
  765   2HB   PRO  93          2HB       PRO  93  10.798  -9.147  -0.537
  766   1HG   PRO  93          1HG       PRO  93   8.325  -8.335   0.864
  767   2HG   PRO  93          2HG       PRO  93   9.094  -9.909   0.819
  768   1HD   PRO  93          1HD       PRO  93   9.164  -8.028   2.982
  769   2HD   PRO  93          2HD       PRO  93  10.028  -9.550   2.889
  770    H    GLU  94           H        GLU  94  11.731  -6.013  -1.336
  771    HA   GLU  94           HA       GLU  94  11.634  -3.531  -0.048
  772   1HB   GLU  94          1HB       GLU  94  12.723  -4.333  -2.345
  773   2HB   GLU  94          2HB       GLU  94  11.192  -3.816  -3.021
  774   1HG   GLU  94          1HG       GLU  94  11.480  -1.554  -2.173
  775   2HG   GLU  94          2HG       GLU  94  12.856  -2.028  -1.196
  776    HE2  GLU  94           HE       GLU  94  11.823  -1.751  -4.491
  777    H    LEU  95           H        LEU  95   9.429  -4.243   1.037
  778    HA   LEU  95           HA       LEU  95   7.106  -4.110  -0.565
  779   1HB   LEU  95          1HB       LEU  95   7.801  -4.732   2.099
  780   2HB   LEU  95          2HB       LEU  95   6.636  -3.427   2.188
  781    HG   LEU  95           HG       LEU  95   6.253  -6.090   0.794
  782   1HD1  LEU  95          1HD1      LEU  95   5.807  -5.201   3.503
  783   2HD1  LEU  95          2HD1      LEU  95   4.269  -5.662   2.737
  784   3HD1  LEU  95          3HD1      LEU  95   5.618  -6.820   2.790
  785   1HD2  LEU  95          1HD2      LEU  95   5.166  -3.980  -0.255
  786   2HD2  LEU  95          2HD2      LEU  95   4.166  -5.424   0.034
  787   3HD2  LEU  95          3HD2      LEU  95   4.080  -4.044   1.154
  788    H    THR  96           H        THR  96   7.296  -2.237  -1.889
  789    HA   THR  96           HA       THR  96   7.310   0.314  -0.443
  790    HB   THR  96           HB       THR  96   8.717  -0.580  -2.665
  791    HG1  THR  96           HG1      THR  96   7.699   2.126  -2.188
  792   1HG2  THR  96          1HG2      THR  96   6.405  -0.353  -3.923
  793   2HG2  THR  96          2HG2      THR  96   6.659   1.396  -3.715
  794   3HG2  THR  96          3HG2      THR  96   7.838   0.430  -4.635
  795    H    PHE  97           H        PHE  97   5.872   2.060  -1.551
  796    HA   PHE  97           HA       PHE  97   3.301   0.837  -2.236
  797   1HB   PHE  97          1HB       PHE  97   2.225   2.328  -0.631
  798   2HB   PHE  97          2HB       PHE  97   3.575   1.613   0.228
  799    HD1  PHE  97           HD1      PHE  97   5.698   2.956   0.488
  800    HD2  PHE  97           HD2      PHE  97   2.084   4.666  -0.937
  801    HE1  PHE  97           HE1      PHE  97   6.567   5.247   1.030
  802    HE2  PHE  97           HE2      PHE  97   2.954   6.957  -0.395
  803    HZ   PHE  97           HZ       PHE  97   5.186   7.220   0.583
  804    H    PHE  98           H        PHE  98   2.668   1.572  -4.202
  805    HA   PHE  98           HA       PHE  98   3.834   4.042  -5.170
  806   1HB   PHE  98          1HB       PHE  98   2.786   1.499  -6.177
  807   2HB   PHE  98          2HB       PHE  98   1.905   2.802  -6.952
  808    HD1  PHE  98           HD1      PHE  98   2.754   3.599  -8.935
  809    HD2  PHE  98           HD2      PHE  98   5.444   1.933  -6.108
  810    HE1  PHE  98           HE1      PHE  98   4.649   3.922 -10.548
  811    HE2  PHE  98           HE2      PHE  98   7.339   2.255  -7.719
  812    HZ   PHE  98           HZ       PHE  98   6.920   3.246  -9.921
  813    H    TYR  99           H        TYR  99   2.808   5.966  -4.934
  814    HA   TYR  99           HA       TYR  99   0.009   5.959  -4.198
  815   1HB   TYR  99          1HB       TYR  99   1.202   8.573  -4.671
  816   2HB   TYR  99          2HB       TYR  99   0.812   7.855  -3.120
  817    HD1  TYR  99           HD1      TYR  99   2.605   5.878  -2.451
  818    HD2  TYR  99           HD2      TYR  99   3.389   9.276  -4.930
  819    HE1  TYR  99           HE1      TYR  99   5.084   5.706  -1.914
  820    HE2  TYR  99           HE2      TYR  99   5.866   9.092  -4.385
  821    HH   TYR  99           HH       TYR  99   7.016   7.131  -1.864
  822    H    ASP 100           H        ASP 100  -1.489   5.818  -5.803
  823    HA   ASP 100           HA       ASP 100  -0.872   7.304  -8.235
  824   1HB   ASP 100          1HB       ASP 100  -1.459   4.626  -8.006
  825   2HB   ASP 100          2HB       ASP 100  -3.070   5.274  -8.238
  826    HD2  ASP 100           HD       ASP 100  -0.674   6.374 -11.191
  827    H    ASN 101           H        ASN 101  -1.811   9.303  -7.368
  828    HA   ASN 101           HA       ASN 101  -4.542   9.138  -6.473
  829   1HB   ASN 101          1HB       ASN 101  -4.194  11.664  -6.114
  830   2HB   ASN 101          2HB       ASN 101  -3.152  10.624  -5.164
  831   1HD2  ASN 101          1HD2      ASN 101  -1.247  11.513  -4.981
  832   2HD2  ASN 101          2HD2      ASN 101  -0.300  12.238  -6.237
  833    H    SER 102           H        SER 102  -5.622  11.570  -7.360
  834    HA   SER 102           HA       SER 102  -5.866  11.025 -10.176
  835   1HB   SER 102          1HB       SER 102  -7.516  13.230  -9.364
  836   2HB   SER 102          2HB       SER 102  -8.014  11.614  -9.816
  837    HG   SER 102           HG       SER 102  -8.705  12.154  -7.656
  838    H    LEU 103           H        LEU 103  -3.566  12.545  -8.587
  839    HA   LEU 103           HA       LEU 103  -3.701  15.078 -10.030
  840   1HB   LEU 103          1HB       LEU 103  -3.262  15.093  -7.609
  841   2HB   LEU 103          2HB       LEU 103  -1.820  14.131  -7.864
  842    HG   LEU 103           HG       LEU 103  -1.480  16.325  -9.562
  843   1HD1  LEU 103          1HD1      LEU 103  -3.415  17.374  -8.350
  844   2HD1  LEU 103          2HD1      LEU 103  -2.419  17.352  -6.876
  845   3HD1  LEU 103          3HD1      LEU 103  -1.892  18.297  -8.289
  846   1HD2  LEU 103          1HD2      LEU 103   0.485  15.824  -8.626
  847   2HD2  LEU 103          2HD2      LEU 103   0.000  16.950  -7.336
  848   3HD2  LEU 103          3HD2      LEU 103  -0.271  15.201  -7.140
  849    H    VAL 104           H        VAL 104  -2.780  11.947 -10.628
  850    HA   VAL 104           HA       VAL 104  -0.685  12.878 -12.455
  851    HB   VAL 104           HB       VAL 104  -0.570  10.796 -10.352
  852   1HG1  VAL 104          1HG1      VAL 104   1.011   9.394 -11.606
  853   2HG1  VAL 104          2HG1      VAL 104  -0.597   9.397 -12.371
  854   3HG1  VAL 104          3HG1      VAL 104   0.722  10.367 -13.068
  855   1HG2  VAL 104          1HG2      VAL 104   0.904  13.074 -11.148
  856   2HG2  VAL 104          2HG2      VAL 104   1.254  11.956  -9.808
  857   3HG2  VAL 104          3HG2      VAL 104   1.964  11.670 -11.415
  858    H    GLU 105           H        GLU 105  -3.754  11.673 -12.062
  859    HA   GLU 105           HA       GLU 105  -3.613  10.476 -14.692
  860   1HB   GLU 105          1HB       GLU 105  -5.079   9.159 -12.363
  861   2HB   GLU 105          2HB       GLU 105  -5.035   8.575 -14.015
  862   1HG   GLU 105          1HG       GLU 105  -2.316   8.918 -13.348
  863   2HG   GLU 105          2HG       GLU 105  -3.032   8.276 -11.883
  864    HE2  GLU 105           HE       GLU 105  -3.902   5.939 -14.996
  865    H    GLY 106           H        GLY 106  -5.530  11.820 -11.967
  866   1HA   GLY 106          1HA       GLY 106  -7.180  13.398 -12.108
  867   2HA   GLY 106          2HA       GLY 106  -7.219  13.227 -13.852
  868    H    MET 107           H        MET 107  -7.245  10.079 -13.004
  869    HA   MET 107           HA       MET 107 -10.133  10.069 -12.572
  870   1HB   MET 107          1HB       MET 107 -10.371   8.361 -14.224
  871   2HB   MET 107          2HB       MET 107  -9.164   9.413 -14.937
  872   1HG   MET 107          1HG       MET 107  -7.601   7.690 -13.395
  873   2HG   MET 107          2HG       MET 107  -8.885   6.632 -13.946
  874   1HE   MET 107          1HE       MET 107  -6.935   9.661 -16.462
  875   2HE   MET 107          2HE       MET 107  -6.659   9.400 -14.724
  876   3HE   MET 107          3HE       MET 107  -5.553   8.681 -15.919
  877    H    ARG 108           H        ARG 108  -7.834   9.885 -10.636
  878    HA   ARG 108           HA       ARG 108  -8.284   7.145  -9.767
  879   1HB   ARG 108          1HB       ARG 108  -5.887   8.851  -9.869
  880   2HB   ARG 108          2HB       ARG 108  -6.142   8.221  -8.254
  881   1HG   ARG 108          1HG       ARG 108  -4.903   6.481  -9.209
  882   2HG   ARG 108          2HG       ARG 108  -6.537   5.912  -9.491
  883   1HD   ARG 108          1HD       ARG 108  -6.441   7.026 -11.794
  884   2HD   ARG 108          2HD       ARG 108  -4.747   7.364 -11.497
  885    HE   ARG 108           HE       ARG 108  -4.877   4.668 -10.997
  886   1HH1  ARG 108          2HH2      ARG 108  -6.006   6.632 -13.720
  887   2HH1  ARG 108          1HH2      ARG 108  -5.821   5.358 -14.878
  888   1HH2  ARG 108          1HH       ARG 108  -5.012   3.221 -14.152
  Start of MODEL   14
    1    H    MET   1           H        MET   1 -11.651 -13.525   4.084
    2    HA   MET   1           HA       MET   1 -12.507 -11.276   2.430
    3   1HB   MET   1          1HB       MET   1 -10.966 -11.525   5.031
    4   2HB   MET   1          2HB       MET   1 -10.569 -10.181   3.980
    5   1HG   MET   1          1HG       MET   1 -12.277  -9.163   5.162
    6   2HG   MET   1          2HG       MET   1 -13.263  -9.917   3.925
    7   1HE   MET   1          1HE       MET   1 -14.408  -8.932   6.251
    8   2HE   MET   1          2HE       MET   1 -15.611 -10.171   5.817
    9   3HE   MET   1          3HE       MET   1 -14.990 -10.077   7.482
   10    H    ALA   2           H        ALA   2 -11.129 -13.771   1.522
   11    HA   ALA   2           HA       ALA   2  -9.049 -12.481   0.050
   12   1HB   ALA   2          1HB       ALA   2  -7.169 -13.545   0.926
   13   2HB   ALA   2          2HB       ALA   2  -8.104 -13.210   2.402
   14   3HB   ALA   2          3HB       ALA   2  -8.125 -14.839   1.686
   15    H    LYS   3           H        LYS   3  -7.888 -14.361  -1.329
   16    HA   LYS   3           HA       LYS   3 -10.113 -15.935  -2.358
   17   1HB   LYS   3          1HB       LYS   3  -9.011 -14.507  -3.961
   18   2HB   LYS   3          2HB       LYS   3  -7.436 -15.149  -3.536
   19   1HG   LYS   3          1HG       LYS   3  -7.710 -16.738  -5.128
   20   2HG   LYS   3          2HG       LYS   3  -8.994 -17.433  -4.159
   21   1HD   LYS   3          1HD       LYS   3 -10.505 -15.563  -5.262
   22   2HD   LYS   3          2HD       LYS   3  -9.223 -15.460  -6.452
   23   1HE   LYS   3          1HE       LYS   3  -9.468 -17.831  -7.024
   24   2HE   LYS   3          2HE       LYS   3 -10.580 -18.090  -5.696
   25   1HZ   LYS   3          1HZ       LYS   3 -12.052 -16.386  -6.831
   26   2HZ   LYS   3          2HZ       LYS   3 -11.078 -16.479  -8.132
   27    H    GLU   4           H        GLU   4 -10.210 -17.585  -0.756
   28    HA   GLU   4           HA       GLU   4  -7.979 -18.949   0.134
   29   1HB   GLU   4          1HB       GLU   4 -10.576 -18.922   0.852
   30   2HB   GLU   4          2HB       GLU   4 -10.609 -20.389  -0.108
   31   1HG   GLU   4          1HG       GLU   4  -8.955 -21.464   1.270
   32   2HG   GLU   4          2HG       GLU   4  -8.476 -19.954   2.018
   33    HE2  GLU   4           HE       GLU   4 -10.628 -20.638   4.604
   34    H    PHE   5           H        PHE   5  -6.615 -19.410  -1.698
   35    HA   PHE   5           HA       PHE   5  -7.466 -21.809  -3.101
   36   1HB   PHE   5          1HB       PHE   5  -7.893 -19.541  -4.391
   37   2HB   PHE   5          2HB       PHE   5  -6.148 -19.405  -4.477
   38    HD1  PHE   5           HD1      PHE   5  -6.523 -22.770  -4.619
   39    HD2  PHE   5           HD2      PHE   5  -7.407 -19.349  -6.967
   40    HE1  PHE   5           HE1      PHE   5  -6.514 -24.190  -6.690
   41    HE2  PHE   5           HE2      PHE   5  -7.399 -20.767  -9.038
   42    HZ   PHE   5           HZ       PHE   5  -6.952 -23.171  -8.873
   43    H    GLY   6           H        GLY   6  -5.889 -23.301  -2.779
   44   1HA   GLY   6          1HA       GLY   6  -3.560 -23.071  -1.511
   45   2HA   GLY   6          2HA       GLY   6  -3.793 -24.183  -2.846
   46    H    ARG   7           H        ARG   7  -4.235 -21.888  -4.804
   47    HA   ARG   7           HA       ARG   7  -1.650 -21.733  -5.707
   48   1HB   ARG   7          1HB       ARG   7  -4.271 -20.717  -6.467
   49   2HB   ARG   7          2HB       ARG   7  -3.083 -19.451  -6.703
   50   1HG   ARG   7          1HG       ARG   7  -3.234 -20.776  -8.752
   51   2HG   ARG   7          2HG       ARG   7  -1.662 -21.042  -8.025
   52   1HD   ARG   7          1HD       ARG   7  -3.675 -22.949  -7.015
   53   2HD   ARG   7          2HD       ARG   7  -3.510 -23.034  -8.757
   54    HE   ARG   7           HE       ARG   7  -0.892 -23.014  -7.980
   55   1HH1  ARG   7          2HH2      ARG   7  -3.648 -24.923  -6.837
   56   2HH1  ARG   7          1HH2      ARG   7  -2.677 -26.284  -6.384
   57   1HH2  ARG   7          1HH       ARG   7  -0.305 -26.195  -6.714
   58    HA   PRO   8           HA       PRO   8  -0.019 -18.114  -3.866
   59   1HB   PRO   8          1HB       PRO   8   0.949 -16.536  -5.877
   60   2HB   PRO   8          2HB       PRO   8   1.781 -17.963  -5.293
   61   1HG   PRO   8          1HG       PRO   8   0.252 -17.607  -7.796
   62   2HG   PRO   8          2HG       PRO   8   1.424 -18.845  -7.394
   63   1HD   PRO   8          1HD       PRO   8  -1.431 -19.133  -7.442
   64   2HD   PRO   8          2HD       PRO   8  -0.264 -20.336  -6.929
   65    H    GLN   9           H        GLN   9  -2.864 -17.936  -5.311
   66    HA   GLN   9           HA       GLN   9  -3.144 -15.110  -5.308
   67   1HB   GLN   9          1HB       GLN   9  -4.549 -17.294  -6.397
   68   2HB   GLN   9          2HB       GLN   9  -5.653 -16.630  -5.210
   69   1HG   GLN   9          1HG       GLN   9  -6.184 -14.999  -6.692
   70   2HG   GLN   9          2HG       GLN   9  -4.560 -14.365  -6.516
   71   1HE2  GLN   9          1HE2      GLN   9  -5.256 -13.744  -8.786
   72   2HE2  GLN   9          2HE2      GLN   9  -4.790 -14.804 -10.076
   73    H    ARG  10           H        ARG  10  -3.811 -17.829  -3.084
   74    HA   ARG  10           HA       ARG  10  -5.503 -16.525  -1.370
   75   1HB   ARG  10          1HB       ARG  10  -4.786 -19.015  -1.416
   76   2HB   ARG  10          2HB       ARG  10  -3.366 -18.531  -0.511
   77   1HG   ARG  10          1HG       ARG  10  -6.103 -17.699   0.485
   78   2HG   ARG  10          2HG       ARG  10  -5.556 -19.343   0.761
   79   1HD   ARG  10          1HD       ARG  10  -3.338 -17.715   1.465
   80   2HD   ARG  10          2HD       ARG  10  -4.732 -16.869   2.107
   81    HE   ARG  10           HE       ARG  10  -5.235 -19.456   2.883
   82   1HH1  ARG  10          2HH2      ARG  10  -2.370 -17.395   3.203
   83   2HH1  ARG  10          1HH2      ARG  10  -1.832 -18.157   4.662
   84   1HH2  ARG  10          1HH       ARG  10  -3.113 -19.960   5.587
   85    H    VAL  11           H        VAL  11  -1.885 -16.907  -1.213
   86    HA   VAL  11           HA       VAL  11  -1.595 -15.294   1.072
   87    HB   VAL  11           HB       VAL  11   0.096 -16.641  -0.921
   88   1HG1  VAL  11          1HG1      VAL  11   1.005 -14.416  -1.222
   89   2HG1  VAL  11          2HG1      VAL  11   1.118 -14.183   0.540
   90   3HG1  VAL  11          3HG1      VAL  11   2.146 -15.391  -0.267
   91   1HG2  VAL  11          1HG2      VAL  11   0.804 -17.772   0.888
   92   2HG2  VAL  11          2HG2      VAL  11   1.077 -16.286   1.829
   93   3HG2  VAL  11          3HG2      VAL  11  -0.556 -16.990   1.731
   94    H    ALA  12           H        ALA  12  -1.526 -14.657  -2.469
   95    HA   ALA  12           HA       ALA  12  -0.581 -12.053  -2.355
   96   1HB   ALA  12          1HB       ALA  12  -2.095 -13.778  -4.253
   97   2HB   ALA  12          2HB       ALA  12  -2.233 -12.023  -4.514
   98   3HB   ALA  12          3HB       ALA  12  -0.632 -12.799  -4.513
   99    H    GLN  13           H        GLN  13  -3.880 -13.423  -1.928
  100    HA   GLN  13           HA       GLN  13  -5.108 -10.895  -1.857
  101   1HB   GLN  13          1HB       GLN  13  -5.962 -13.695  -1.058
  102   2HB   GLN  13          2HB       GLN  13  -7.003 -12.320  -0.747
  103   1HG   GLN  13          1HG       GLN  13  -5.985 -13.298  -3.447
  104   2HG   GLN  13          2HG       GLN  13  -7.647 -13.233  -2.896
  105   1HE2  GLN  13          1HE2      GLN  13  -4.914 -11.452  -4.084
  106   2HE2  GLN  13          2HE2      GLN  13  -5.714  -9.956  -4.434
  107    H    GLU  14           H        GLU  14  -4.838 -13.355   0.814
  108    HA   GLU  14           HA       GLU  14  -5.502 -11.844   2.876
  109   1HB   GLU  14          1HB       GLU  14  -3.715 -14.161   2.482
  110   2HB   GLU  14          2HB       GLU  14  -3.312 -13.237   3.915
  111   1HG   GLU  14          1HG       GLU  14  -6.232 -13.710   3.522
  112   2HG   GLU  14          2HG       GLU  14  -5.289 -15.161   3.802
  113    HE2  GLU  14           HE       GLU  14  -5.236 -14.609   7.120
  114    H    MET  15           H        MET  15  -2.477 -11.611   1.014
  115    HA   MET  15           HA       MET  15  -1.244  -9.914   2.936
  116   1HB   MET  15          1HB       MET  15  -0.629 -10.874   0.110
  117   2HB   MET  15          2HB       MET  15   0.334  -9.586   0.807
  118   1HG   MET  15          1HG       MET  15   0.729 -11.130   2.832
  119   2HG   MET  15          2HG       MET  15  -0.015 -12.414   1.903
  120   1HE   MET  15          1HE       MET  15   2.814  -9.618   1.705
  121   2HE   MET  15          2HE       MET  15   3.089 -10.869   2.941
  122   3HE   MET  15          3HE       MET  15   4.172 -10.757   1.534
  123    H    GLN  16           H        GLN  16  -2.927  -9.543  -0.235
  124    HA   GLN  16           HA       GLN  16  -2.382  -6.835  -0.510
  125   1HB   GLN  16          1HB       GLN  16  -3.287  -8.532  -2.244
  126   2HB   GLN  16          2HB       GLN  16  -4.872  -8.231  -1.560
  127   1HG   GLN  16          1HG       GLN  16  -3.532  -5.691  -2.044
  128   2HG   GLN  16          2HG       GLN  16  -3.485  -6.660  -3.503
  129   1HE2  GLN  16          1HE2      GLN  16  -4.865  -4.764  -4.129
  130   2HE2  GLN  16          2HE2      GLN  16  -6.580  -4.916  -3.953
  131    H    LYS  17           H        LYS  17  -4.911  -8.646   1.249
  132    HA   LYS  17           HA       LYS  17  -6.473  -6.308   1.770
  133   1HB   LYS  17          1HB       LYS  17  -7.260  -8.757   1.584
  134   2HB   LYS  17          2HB       LYS  17  -6.659  -8.950   3.219
  135   1HG   LYS  17          1HG       LYS  17  -8.425  -6.573   2.664
  136   2HG   LYS  17          2HG       LYS  17  -9.187  -8.150   2.703
  137   1HD   LYS  17          1HD       LYS  17  -7.527  -6.879   4.929
  138   2HD   LYS  17          2HD       LYS  17  -9.257  -7.159   4.948
  139   1HE   LYS  17          1HE       LYS  17  -8.182  -9.698   4.370
  140   2HE   LYS  17          2HE       LYS  17  -7.058  -9.031   5.536
  141   1HZ   LYS  17          1HZ       LYS  17  -8.833  -8.697   7.082
  142   2HZ   LYS  17          2HZ       LYS  17  -9.992  -9.004   5.979
  143    H    GLU  18           H        GLU  18  -3.980  -8.263   3.469
  144    HA   GLU  18           HA       GLU  18  -4.258  -6.894   5.890
  145   1HB   GLU  18          1HB       GLU  18  -3.177  -9.163   5.542
  146   2HB   GLU  18          2HB       GLU  18  -1.797  -8.351   4.831
  147   1HG   GLU  18          1HG       GLU  18  -2.658  -7.271   7.477
  148   2HG   GLU  18          2HG       GLU  18  -2.049  -8.914   7.515
  149    HE2  GLU  18           HE       GLU  18  -0.491  -7.565   8.736
  150    H    ILE  19           H        ILE  19  -2.214  -6.424   2.969
  151    HA   ILE  19           HA       ILE  19  -0.705  -4.316   4.166
  152    HB   ILE  19           HB       ILE  19   0.357  -4.127   2.064
  153   1HG1  ILE  19          1HG1      ILE  19  -2.022  -5.620   0.940
  154   2HG1  ILE  19          2HG1      ILE  19  -1.493  -3.995   0.555
  155   1HG2  ILE  19          1HG2      ILE  19  -0.065  -6.713   3.310
  156   2HG2  ILE  19          2HG2      ILE  19   0.321  -6.874   1.580
  157   3HG2  ILE  19          3HG2      ILE  19   1.422  -5.985   2.657
  158   1HD1  ILE  19          1HD1      ILE  19  -0.545  -5.108  -1.239
  159   2HD1  ILE  19          2HD1      ILE  19   0.791  -5.289  -0.078
  160   3HD1  ILE  19          3HD1      ILE  19  -0.355  -6.626  -0.332
  161    H    ALA  20           H        ALA  20  -3.409  -4.545   1.767
  162    HA   ALA  20           HA       ALA  20  -3.659  -1.849   1.256
  163   1HB   ALA  20          1HB       ALA  20  -6.020  -2.463   0.661
  164   2HB   ALA  20          2HB       ALA  20  -4.804  -3.560  -0.037
  165   3HB   ALA  20          3HB       ALA  20  -5.743  -4.062   1.389
  166    H    LEU  21           H        LEU  21  -4.697  -3.805   4.055
  167    HA   LEU  21           HA       LEU  21  -6.394  -1.801   5.126
  168   1HB   LEU  21          1HB       LEU  21  -6.851  -4.006   5.744
  169   2HB   LEU  21          2HB       LEU  21  -5.179  -4.350   6.142
  170    HG   LEU  21           HG       LEU  21  -6.101  -2.225   7.840
  171   1HD1  LEU  21          1HD1      LEU  21  -8.082  -4.359   7.312
  172   2HD1  LEU  21          2HD1      LEU  21  -7.753  -4.011   9.028
  173   3HD1  LEU  21          3HD1      LEU  21  -8.299  -2.709   7.944
  174   1HD2  LEU  21          1HD2      LEU  21  -5.765  -4.314   9.503
  175   2HD2  LEU  21          2HD2      LEU  21  -4.902  -4.929   8.072
  176   3HD2  LEU  21          3HD2      LEU  21  -4.419  -3.381   8.808
  177    H    ILE  22           H        ILE  22  -3.097  -2.997   6.094
  178    HA   ILE  22           HA       ILE  22  -2.658  -0.980   7.954
  179    HB   ILE  22           HB       ILE  22  -0.688  -2.589   6.324
  180   1HG1  ILE  22          1HG1      ILE  22  -1.624  -3.160   9.139
  181   2HG1  ILE  22          2HG1      ILE  22  -2.463  -3.804   7.740
  182   1HG2  ILE  22          1HG2      ILE  22  -0.344  -0.855   8.774
  183   2HG2  ILE  22          2HG2      ILE  22   0.801  -2.146   8.337
  184   3HG2  ILE  22          3HG2      ILE  22   0.530  -0.782   7.226
  185   1HD1  ILE  22          1HD1      ILE  22  -0.253  -4.768   6.935
  186   2HD1  ILE  22          2HD1      ILE  22   0.460  -4.254   8.484
  187   3HD1  ILE  22          3HD1      ILE  22  -0.846  -5.464   8.462
  188    H    LEU  23           H        LEU  23  -2.587  -0.983   4.439
  189    HA   LEU  23           HA       LEU  23  -1.051   1.472   4.362
  190   1HB   LEU  23          1HB       LEU  23  -1.011  -0.584   2.726
  191   2HB   LEU  23          2HB       LEU  23  -2.383   0.224   1.993
  192    HG   LEU  23           HG       LEU  23  -1.047   2.208   1.550
  193   1HD1  LEU  23          1HD1      LEU  23   1.563   1.755   1.937
  194   2HD1  LEU  23          2HD1      LEU  23   0.531   2.570   3.137
  195   3HD1  LEU  23          3HD1      LEU  23   0.912   0.842   3.320
  196   1HD2  LEU  23          1HD2      LEU  23  -1.070   0.248  -0.034
  197   2HD2  LEU  23          2HD2      LEU  23   0.317   1.354  -0.198
  198   3HD2  LEU  23          3HD2      LEU  23   0.519  -0.210   0.628
  199    H    GLN  24           H        GLN  24  -4.313   0.435   4.769
  200    HA   GLN  24           HA       GLN  24  -5.238   3.033   3.827
  201   1HB   GLN  24          1HB       GLN  24  -6.622   0.349   4.122
  202   2HB   GLN  24          2HB       GLN  24  -7.556   1.829   4.032
  203   1HG   GLN  24          1HG       GLN  24  -6.702   2.361   1.838
  204   2HG   GLN  24          2HG       GLN  24  -5.423   1.170   1.961
  205   1HE2  GLN  24          1HE2      GLN  24  -8.910   1.077   2.677
  206   2HE2  GLN  24          2HE2      GLN  24  -9.312  -0.257   1.647
  207    H    ARG  25           H        ARG  25  -4.278   1.382   6.594
  208    HA   ARG  25           HA       ARG  25  -6.164   2.902   8.211
  209   1HB   ARG  25          1HB       ARG  25  -4.879   0.197   8.564
  210   2HB   ARG  25          2HB       ARG  25  -5.152   1.140  10.015
  211   1HG   ARG  25          1HG       ARG  25  -7.586   1.477   9.078
  212   2HG   ARG  25          2HG       ARG  25  -7.207   0.138   8.014
  213   1HD   ARG  25          1HD       ARG  25  -8.199  -0.920   9.895
  214   2HD   ARG  25          2HD       ARG  25  -6.482  -1.147  10.163
  215    HE   ARG  25           HE       ARG  25  -6.547   0.409  11.952
  216   1HH1  ARG  25          2HH2      ARG  25  -9.659   0.337  10.259
  217   2HH1  ARG  25          1HH2      ARG  25 -10.490   1.227  11.491
  218   1HH2  ARG  25          1HH       ARG  25  -9.285   1.948  13.433
  219    H    GLU  26           H        GLU  26  -2.774   1.571   8.140
  220    HA   GLU  26           HA       GLU  26  -1.893   3.337  10.139
  221   1HB   GLU  26          1HB       GLU  26   0.005   2.082  10.063
  222   2HB   GLU  26          2HB       GLU  26  -0.922   1.028   9.016
  223   1HG   GLU  26          1HG       GLU  26   0.982   1.402   7.704
  224   2HG   GLU  26          2HG       GLU  26  -0.102   2.629   7.080
  225    HE2  GLU  26           HE       GLU  26   1.091   4.195   6.685
  226    H    ILE  27           H        ILE  27  -2.612   3.726   6.794
  227    HA   ILE  27           HA       ILE  27  -0.664   5.818   6.375
  228    HB   ILE  27           HB       ILE  27  -1.719   4.022   4.718
  229   1HG1  ILE  27          1HG1      ILE  27  -0.357   6.591   4.433
  230   2HG1  ILE  27          2HG1      ILE  27  -0.030   5.049   3.666
  231   1HG2  ILE  27          1HG2      ILE  27  -3.381   5.108   3.243
  232   2HG2  ILE  27          2HG2      ILE  27  -4.005   4.793   4.881
  233   3HG2  ILE  27          3HG2      ILE  27  -3.518   6.442   4.414
  234   1HD1  ILE  27          1HD1      ILE  27  -2.262   6.959   2.832
  235   2HD1  ILE  27          2HD1      ILE  27  -0.689   6.805   2.014
  236   3HD1  ILE  27          3HD1      ILE  27  -1.828   5.437   2.019
  237    H    LYS  28           H        LYS  28  -1.869   7.849   5.123
  238    HA   LYS  28           HA       LYS  28  -3.429   9.009   7.261
  239   1HB   LYS  28          1HB       LYS  28  -1.973  10.043   4.846
  240   2HB   LYS  28          2HB       LYS  28  -3.210  11.035   5.591
  241   1HG   LYS  28          1HG       LYS  28  -1.075  11.597   6.619
  242   2HG   LYS  28          2HG       LYS  28  -2.049  10.765   7.815
  243   1HD   LYS  28          1HD       LYS  28  -0.364   8.965   6.144
  244   2HD   LYS  28          2HD       LYS  28   0.547  10.082   7.140
  245   1HE   LYS  28          1HE       LYS  28  -1.591   9.032   8.763
  246   2HE   LYS  28          2HE       LYS  28  -0.838   7.676   7.950
  247   1HZ   LYS  28          1HZ       LYS  28   0.157   8.767  10.171
  248   2HZ   LYS  28          2HZ       LYS  28   1.098   7.996   9.087
  249    H    ASP  29           H        ASP  29  -5.267   7.477   6.924
  250    HA   ASP  29           HA       ASP  29  -6.735   7.979   4.494
  251   1HB   ASP  29          1HB       ASP  29  -7.103   5.757   4.883
  252   2HB   ASP  29          2HB       ASP  29  -6.633   5.884   6.566
  253    HD2  ASP  29           HD       ASP  29  -9.873   6.857   7.547
  254    HA   PRO  30           HA       PRO  30  -9.590   9.478   8.019
  255   1HB   PRO  30          1HB       PRO  30  -8.663   9.551  10.590
  256   2HB   PRO  30          2HB       PRO  30  -9.597   8.215   9.946
  257   1HG   PRO  30          1HG       PRO  30  -6.695   8.352  10.496
  258   2HG   PRO  30          2HG       PRO  30  -7.703   6.937  10.266
  259   1HD   PRO  30          1HD       PRO  30  -5.885   8.076   8.363
  260   2HD   PRO  30          2HD       PRO  30  -6.977   6.732   8.094
  261    H    ARG  31           H        ARG  31  -6.236  10.307   8.276
  262    HA   ARG  31           HA       ARG  31  -6.728  12.881   9.247
  263   1HB   ARG  31          1HB       ARG  31  -4.300  12.238   7.555
  264   2HB   ARG  31          2HB       ARG  31  -4.394  13.214   9.008
  265   1HG   ARG  31          1HG       ARG  31  -5.124  10.907  10.144
  266   2HG   ARG  31          2HG       ARG  31  -4.334  10.200   8.749
  267   1HD   ARG  31          1HD       ARG  31  -2.407  10.396   9.964
  268   2HD   ARG  31          2HD       ARG  31  -2.461  12.092   9.524
  269    HE   ARG  31           HE       ARG  31  -3.217  12.640  11.700
  270   1HH1  ARG  31          2HH2      ARG  31  -3.164   9.123  11.268
  271   2HH1  ARG  31          1HH2      ARG  31  -3.378   8.789  12.954
  272   1HH2  ARG  31          1HH       ARG  31  -3.575  10.611  14.498
  273    H    LEU  32           H        LEU  32  -5.683  11.692   5.959
  274    HA   LEU  32           HA       LEU  32  -5.987  14.150   4.688
  275   1HB   LEU  32          1HB       LEU  32  -5.761  11.300   3.851
  276   2HB   LEU  32          2HB       LEU  32  -6.302  12.463   2.658
  277    HG   LEU  32           HG       LEU  32  -4.272  13.494   2.508
  278   1HD1  LEU  32          1HD1      LEU  32  -3.980  12.859   5.424
  279   2HD1  LEU  32          2HD1      LEU  32  -2.542  13.262   4.457
  280   3HD1  LEU  32          3HD1      LEU  32  -3.886  14.423   4.580
  281   1HD2  LEU  32          1HD2      LEU  32  -4.059  11.034   1.996
  282   2HD2  LEU  32          2HD2      LEU  32  -2.536  11.881   2.360
  283   3HD2  LEU  32          3HD2      LEU  32  -3.296  10.846   3.593
  284    H    GLY  33           H        GLY  33  -8.318  11.705   5.706
  285   1HA   GLY  33          1HA       GLY  33 -10.577  11.977   5.885
  286   2HA   GLY  33          2HA       GLY  33 -10.487  13.474   4.979
  287    H    MET  34           H        MET  34  -9.206  10.224   4.039
  288    HA   MET  34           HA       MET  34 -11.337   9.987   2.111
  289   1HB   MET  34          1HB       MET  34  -8.356  10.026   1.374
  290   2HB   MET  34          2HB       MET  34  -9.642   9.598   0.261
  291   1HG   MET  34          1HG       MET  34 -10.604  11.841   0.387
  292   2HG   MET  34          2HG       MET  34  -9.540  12.287   1.706
  293   1HE   MET  34          1HE       MET  34  -7.878  14.504   0.087
  294   2HE   MET  34          2HE       MET  34  -7.984  13.531   1.574
  295   3HE   MET  34          3HE       MET  34  -6.537  13.427   0.543
  296    H    MET  35           H        MET  35 -10.491   7.824   0.632
  297    HA   MET  35           HA       MET  35  -9.618   5.901   2.638
  298   1HB   MET  35          1HB       MET  35 -12.245   6.136   1.717
  299   2HB   MET  35          2HB       MET  35 -11.599   4.938   0.613
  300   1HG   MET  35          1HG       MET  35 -10.654   3.791   2.808
  301   2HG   MET  35          2HG       MET  35 -11.842   4.780   3.635
  302   1HE   MET  35          1HE       MET  35 -12.548   0.839   1.793
  303   2HE   MET  35          2HE       MET  35 -11.278   1.844   1.053
  304   3HE   MET  35          3HE       MET  35 -11.251   1.520   2.804
  305    H    THR  36           H        THR  36  -7.499   6.031   1.605
  306    HA   THR  36           HA       THR  36  -6.939   5.817  -1.051
  307    HB   THR  36           HB       THR  36  -4.759   4.962  -0.264
  308    HG1  THR  36           HG1      THR  36  -6.324   4.545   2.187
  309   1HG2  THR  36          1HG2      THR  36  -5.732   7.330   0.602
  310   2HG2  THR  36          2HG2      THR  36  -5.673   6.495   2.172
  311   3HG2  THR  36          3HG2      THR  36  -4.186   6.690   1.212
  312    H    THR  37           H        THR  37  -6.564   4.177  -2.566
  313    HA   THR  37           HA       THR  37  -7.683   1.562  -1.801
  314    HB   THR  37           HB       THR  37  -8.278   3.401  -4.146
  315    HG1  THR  37           HG1      THR  37 -10.302   3.076  -3.219
  316   1HG2  THR  37          1HG2      THR  37  -9.488   1.428  -5.173
  317   2HG2  THR  37          2HG2      THR  37  -7.718   1.251  -5.234
  318   3HG2  THR  37          3HG2      THR  37  -8.659   0.363  -4.012
  319    H    VAL  38           H        VAL  38  -6.962  -0.242  -3.235
  320    HA   VAL  38           HA       VAL  38  -4.218   0.295  -4.146
  321    HB   VAL  38           HB       VAL  38  -4.136  -0.953  -2.120
  322   1HG1  VAL  38          1HG1      VAL  38  -5.319  -3.379  -2.365
  323   2HG1  VAL  38          2HG1      VAL  38  -6.089  -1.976  -1.587
  324   3HG1  VAL  38          3HG1      VAL  38  -6.469  -2.375  -3.279
  325   1HG2  VAL  38          1HG2      VAL  38  -3.279  -2.046  -4.647
  326   2HG2  VAL  38          2HG2      VAL  38  -2.478  -2.112  -3.059
  327   3HG2  VAL  38          3HG2      VAL  38  -3.652  -3.369  -3.515
  328    H    SER  39           H        SER  39  -4.802   0.677  -6.321
  329    HA   SER  39           HA       SER  39  -6.360  -1.388  -7.598
  330   1HB   SER  39          1HB       SER  39  -6.069   1.408  -7.966
  331   2HB   SER  39          2HB       SER  39  -5.331   0.687  -9.382
  332    HG   SER  39           HG       SER  39  -8.008   0.194  -8.392
  333    H    GLY  40           H        GLY  40  -3.641  -1.974  -6.555
  334   1HA   GLY  40          1HA       GLY  40  -2.587  -3.312  -8.822
  335   2HA   GLY  40          2HA       GLY  40  -1.636  -1.882  -8.469
  336    H    VAL  41           H        VAL  41  -1.329  -5.007  -8.101
  337    HA   VAL  41           HA       VAL  41  -0.020  -4.740  -5.521
  338    HB   VAL  41           HB       VAL  41  -1.451  -7.279  -5.809
  339   1HG1  VAL  41          1HG1      VAL  41  -1.770  -5.455  -3.467
  340   2HG1  VAL  41          2HG1      VAL  41  -1.493  -7.212  -3.523
  341   3HG1  VAL  41          3HG1      VAL  41  -0.143  -6.087  -3.810
  342   1HG2  VAL  41          1HG2      VAL  41  -3.139  -4.858  -5.143
  343   2HG2  VAL  41          2HG2      VAL  41  -3.083  -5.566  -6.775
  344   3HG2  VAL  41          3HG2      VAL  41  -3.661  -6.540  -5.402
  345    H    GLU  42           H        GLU  42   2.038  -5.432  -5.769
  346    HA   GLU  42           HA       GLU  42   2.448  -7.621  -7.638
  347   1HB   GLU  42          1HB       GLU  42   4.216  -5.139  -7.490
  348   2HB   GLU  42          2HB       GLU  42   4.457  -6.515  -8.549
  349   1HG   GLU  42          1HG       GLU  42   2.066  -6.020  -9.457
  350   2HG   GLU  42          2HG       GLU  42   2.191  -4.483  -8.626
  351    HE2  GLU  42           HE       GLU  42   4.636  -3.176 -10.540
  352    H    MET  43           H        MET  43   2.829  -9.168  -6.032
  353    HA   MET  43           HA       MET  43   4.865  -8.466  -4.075
  354   1HB   MET  43          1HB       MET  43   3.255 -11.034  -3.981
  355   2HB   MET  43          2HB       MET  43   3.837 -10.060  -2.646
  356   1HG   MET  43          1HG       MET  43   1.682  -9.294  -2.521
  357   2HG   MET  43          2HG       MET  43   2.123  -8.273  -3.875
  358   1HE   MET  43          1HE       MET  43  -1.179  -8.903  -4.514
  359   2HE   MET  43          2HE       MET  43  -1.325 -10.446  -3.638
  360   3HE   MET  43          3HE       MET  43  -0.452  -9.082  -2.900
  361    H    SER  44           H        SER  44   6.877  -8.931  -4.913
  362    HA   SER  44           HA       SER  44   7.127 -11.540  -6.193
  363   1HB   SER  44          1HB       SER  44   8.432  -8.876  -6.702
  364   2HB   SER  44          2HB       SER  44   9.390 -10.314  -6.994
  365    HG   SER  44           HG       SER  44   7.361 -11.049  -8.257
  366    H    ARG  45           H        ARG  45   7.860 -12.969  -4.644
  367    HA   ARG  45           HA       ARG  45   9.783 -11.941  -2.740
  368   1HB   ARG  45          1HB       ARG  45   8.618 -14.730  -2.578
  369   2HB   ARG  45          2HB       ARG  45   9.100 -13.666  -1.271
  370   1HG   ARG  45          1HG       ARG  45   7.086 -12.184  -2.486
  371   2HG   ARG  45          2HG       ARG  45   6.510 -13.822  -2.722
  372   1HD   ARG  45          1HD       ARG  45   6.911 -12.299  -0.165
  373   2HD   ARG  45          2HD       ARG  45   5.628 -13.408  -0.606
  374    HE   ARG  45           HE       ARG  45   8.113 -14.094   0.723
  375   1HH1  ARG  45          2HH2      ARG  45   5.681 -15.370  -1.515
  376   2HH1  ARG  45          1HH2      ARG  45   6.009 -17.024  -1.125
  377   1HH2  ARG  45          1HH       ARG  45   7.697 -17.535   0.499
  378    H    ASP  46           H        ASP  46   9.788 -13.330  -5.749
  379    HA   ASP  46           HA       ASP  46  11.291 -15.561  -5.651
  380   1HB   ASP  46          1HB       ASP  46  10.919 -13.312  -7.568
  381   2HB   ASP  46          2HB       ASP  46  12.400 -14.219  -7.812
  382    HD2  ASP  46           HD       ASP  46  11.948 -16.607  -7.764
  383    H    LEU  47           H        LEU  47  12.139 -12.265  -4.783
  384    HA   LEU  47           HA       LEU  47  14.828 -13.141  -4.131
  385   1HB   LEU  47          1HB       LEU  47  14.205 -11.420  -6.366
  386   2HB   LEU  47          2HB       LEU  47  15.166 -10.561  -5.180
  387    HG   LEU  47           HG       LEU  47  16.094 -13.291  -5.924
  388   1HD1  LEU  47          1HD1      LEU  47  16.591 -12.934  -8.078
  389   2HD1  LEU  47          2HD1      LEU  47  15.333 -11.677  -8.000
  390   3HD1  LEU  47          3HD1      LEU  47  17.045 -11.235  -7.797
  391   1HD2  LEU  47          1HD2      LEU  47  17.108 -11.204  -4.434
  392   2HD2  LEU  47          2HD2      LEU  47  18.033 -12.586  -5.071
  393   3HD2  LEU  47          3HD2      LEU  47  17.982 -11.055  -5.976
  394    H    ALA  48           H        ALA  48  12.754 -10.152  -4.269
  395    HA   ALA  48           HA       ALA  48  12.028  -9.962  -1.702
  396   1HB   ALA  48          1HB       ALA  48  13.954  -9.902  -0.514
  397   2HB   ALA  48          2HB       ALA  48  14.940  -9.562  -1.956
  398   3HB   ALA  48          3HB       ALA  48  14.105  -8.233  -1.116
  399    H    TYR  49           H        TYR  49  10.449  -9.036  -3.253
  400    HA   TYR  49           HA       TYR  49  10.727  -6.174  -3.310
  401   1HB   TYR  49          1HB       TYR  49  10.247  -7.809  -5.871
  402   2HB   TYR  49          2HB       TYR  49  10.489  -6.076  -5.783
  403    HD1  TYR  49           HD1      TYR  49  12.816  -5.291  -4.818
  404    HD2  TYR  49           HD2      TYR  49  12.052  -9.194  -6.394
  405    HE1  TYR  49           HE1      TYR  49  15.305  -5.624  -5.217
  406    HE2  TYR  49           HE2      TYR  49  14.543  -9.515  -6.788
  407    HH   TYR  49           HH       TYR  49  16.854  -6.969  -5.880
  408    H    ALA  50           H        ALA  50   8.730  -5.169  -3.212
  409    HA   ALA  50           HA       ALA  50   6.387  -6.725  -3.943
  410   1HB   ALA  50          1HB       ALA  50   6.012  -7.327  -1.802
  411   2HB   ALA  50          2HB       ALA  50   7.297  -6.256  -1.197
  412   3HB   ALA  50          3HB       ALA  50   5.664  -5.611  -1.488
  413    H    LYS  51           H        LYS  51   5.918  -5.270  -5.605
  414    HA   LYS  51           HA       LYS  51   5.879  -2.443  -4.941
  415   1HB   LYS  51          1HB       LYS  51   4.959  -3.119  -7.608
  416   2HB   LYS  51          2HB       LYS  51   6.307  -2.120  -7.105
  417   1HG   LYS  51          1HG       LYS  51   7.535  -4.367  -6.577
  418   2HG   LYS  51          2HG       LYS  51   6.267  -5.134  -7.512
  419   1HD   LYS  51          1HD       LYS  51   7.816  -4.743  -9.204
  420   2HD   LYS  51          2HD       LYS  51   6.878  -3.267  -9.319
  421   1HE   LYS  51          1HE       LYS  51   8.523  -2.078  -7.884
  422   2HE   LYS  51          2HE       LYS  51   9.441  -3.555  -7.678
  423   1HZ   LYS  51          1HZ       LYS  51  10.028  -3.546  -9.968
  424   2HZ   LYS  51          2HZ       LYS  51   8.922  -2.419 -10.366
  425    H    VAL  52           H        VAL  52   4.135  -1.846  -3.739
  426    HA   VAL  52           HA       VAL  52   1.554  -3.011  -4.490
  427    HB   VAL  52           HB       VAL  52   2.651  -2.990  -2.094
  428   1HG1  VAL  52          1HG1      VAL  52   2.060  -0.184  -2.553
  429   2HG1  VAL  52          2HG1      VAL  52   1.164  -0.807  -1.146
  430   3HG1  VAL  52          3HG1      VAL  52   2.937  -0.957  -1.210
  431   1HG2  VAL  52          1HG2      VAL  52  -0.269  -2.371  -2.654
  432   2HG2  VAL  52          2HG2      VAL  52   0.495  -3.977  -2.582
  433   3HG2  VAL  52          3HG2      VAL  52   0.365  -2.989  -1.108
  434    H    TYR  53           H        TYR  53  -0.310  -1.583  -4.728
  435    HA   TYR  53           HA       TYR  53   0.528   1.062  -5.692
  436   1HB   TYR  53          1HB       TYR  53  -0.652  -0.882  -7.091
  437   2HB   TYR  53          2HB       TYR  53  -2.088  -0.469  -6.175
  438    HD1  TYR  53           HD1      TYR  53   0.104   0.485  -8.913
  439    HD2  TYR  53           HD2      TYR  53  -3.117   1.806  -6.426
  440    HE1  TYR  53           HE1      TYR  53  -0.435   2.328 -10.579
  441    HE2  TYR  53           HE2      TYR  53  -3.644   3.645  -8.101
  442    HH   TYR  53           HH       TYR  53  -2.684   3.639 -11.146
  443    H    VAL  54           H        VAL  54  -0.880   2.904  -5.271
  444    HA   VAL  54           HA       VAL  54  -2.976   2.572  -3.337
  445    HB   VAL  54           HB       VAL  54  -1.663   4.432  -1.949
  446   1HG1  VAL  54          1HG1      VAL  54  -1.128   2.730  -0.327
  447   2HG1  VAL  54          2HG1      VAL  54  -2.648   2.279  -1.138
  448   3HG1  VAL  54          3HG1      VAL  54  -1.127   1.467  -1.583
  449   1HG2  VAL  54          1HG2      VAL  54   0.737   3.599  -1.706
  450   2HG2  VAL  54          2HG2      VAL  54   0.494   2.759  -3.258
  451   3HG2  VAL  54          3HG2      VAL  54   0.362   4.534  -3.175
  452    H    THR  55           H        THR  55  -4.562   3.929  -3.984
  453    HA   THR  55           HA       THR  55  -3.718   6.387  -5.374
  454    HB   THR  55           HB       THR  55  -4.757   5.318  -7.141
  455    HG1  THR  55           HG1      THR  55  -7.060   5.853  -7.010
  456   1HG2  THR  55          1HG2      THR  55  -6.373   3.735  -5.074
  457   2HG2  THR  55          2HG2      THR  55  -6.514   3.542  -6.838
  458   3HG2  THR  55          3HG2      THR  55  -4.996   3.114  -6.015
  459    H    PHE  56           H        PHE  56  -4.223   8.225  -4.374
  460    HA   PHE  56           HA       PHE  56  -6.388   8.073  -2.399
  461   1HB   PHE  56          1HB       PHE  56  -4.222  10.215  -2.571
  462   2HB   PHE  56          2HB       PHE  56  -5.088   9.675  -1.145
  463    HD1  PHE  56           HD1      PHE  56  -4.724   6.798  -1.147
  464    HD2  PHE  56           HD2      PHE  56  -1.972   9.849  -2.209
  465    HE1  PHE  56           HE1      PHE  56  -2.814   5.279  -0.562
  466    HE2  PHE  56           HE2      PHE  56  -0.062   8.328  -1.624
  467    HZ   PHE  56           HZ       PHE  56  -0.506   6.063  -0.809
  468    H    LEU  57           H        LEU  57  -7.802   9.951  -2.185
  469    HA   LEU  57           HA       LEU  57  -8.211  11.215  -4.765
  470   1HB   LEU  57          1HB       LEU  57 -10.037  10.056  -3.529
  471   2HB   LEU  57          2HB       LEU  57  -9.916  11.274  -2.274
  472    HG   LEU  57           HG       LEU  57 -10.377  12.995  -4.138
  473   1HD1  LEU  57          1HD1      LEU  57 -10.764  12.343  -6.226
  474   2HD1  LEU  57          2HD1      LEU  57 -10.213  10.719  -5.752
  475   3HD1  LEU  57          3HD1      LEU  57 -11.946  11.121  -5.694
  476   1HD2  LEU  57          1HD2      LEU  57 -12.932  11.996  -4.095
  477   2HD2  LEU  57          2HD2      LEU  57 -12.197  11.217  -2.673
  478   3HD2  LEU  57          3HD2      LEU  57 -12.185  12.991  -2.821
  479    H    ASN  58           H        ASN  58  -5.988  11.830  -2.651
  480    HA   ASN  58           HA       ASN  58  -6.469  14.212  -1.452
  481   1HB   ASN  58          1HB       ASN  58  -4.125  12.650  -2.289
  482   2HB   ASN  58          2HB       ASN  58  -3.795  14.366  -2.422
  483   1HD2  ASN  58          1HD2      ASN  58  -4.628  15.698  -0.521
  484   2HD2  ASN  58          2HD2      ASN  58  -4.300  15.089   1.067
  485    H    ASP  59           H        ASP  59  -5.909  13.401  -4.863
  486    HA   ASP  59           HA       ASP  59  -4.901  15.538  -6.003
  487   1HB   ASP  59          1HB       ASP  59  -6.076  14.955  -7.972
  488   2HB   ASP  59          2HB       ASP  59  -6.058  13.464  -7.052
  489    HD2  ASP  59           HD       ASP  59  -7.942  15.548  -8.662
  490    H    LYS  60           H        LYS  60  -8.157  15.247  -4.514
  491    HA   LYS  60           HA       LYS  60  -9.518  17.352  -5.453
  492   1HB   LYS  60          1HB       LYS  60  -9.356  15.963  -2.843
  493   2HB   LYS  60          2HB       LYS  60 -10.089  17.554  -2.794
  494   1HG   LYS  60          1HG       LYS  60 -11.681  16.918  -4.580
  495   2HG   LYS  60          2HG       LYS  60 -10.904  15.357  -4.756
  496   1HD   LYS  60          1HD       LYS  60 -12.736  14.851  -3.362
  497   2HD   LYS  60          2HD       LYS  60 -11.431  15.034  -2.208
  498   1HE   LYS  60          1HE       LYS  60 -12.983  16.419  -1.186
  499   2HE   LYS  60          2HE       LYS  60 -12.231  17.605  -2.234
  500   1HZ   LYS  60          1HZ       LYS  60 -14.858  17.104  -2.237
  501   2HZ   LYS  60          2HZ       LYS  60 -14.081  17.707  -3.535
  502    H    ASP  61           H        ASP  61  -6.886  17.493  -2.974
  503    HA   ASP  61           HA       ASP  61  -6.725  20.333  -3.607
  504   1HB   ASP  61          1HB       ASP  61  -5.855  19.277  -0.916
  505   2HB   ASP  61          2HB       ASP  61  -6.383  20.892  -1.341
  506    HD2  ASP  61           HD       ASP  61  -9.483  20.218  -0.064
  507    H    GLU  62           H        GLU  62  -4.684  20.840  -4.426
  508    HA   GLU  62           HA       GLU  62  -2.730  18.849  -4.599
  509   1HB   GLU  62          1HB       GLU  62  -3.194  20.895  -6.147
  510   2HB   GLU  62          2HB       GLU  62  -2.223  21.815  -5.014
  511   1HG   GLU  62          1HG       GLU  62  -0.888  19.300  -5.696
  512   2HG   GLU  62          2HG       GLU  62  -1.287  20.193  -7.150
  513    HE2  GLU  62           HE       GLU  62   0.976  21.653  -7.411
  514    H    ASP  63           H        ASP  63  -3.509  21.259  -2.182
  515    HA   ASP  63           HA       ASP  63  -0.934  21.542  -1.127
  516   1HB   ASP  63          1HB       ASP  63  -3.521  22.593  -0.657
  517   2HB   ASP  63          2HB       ASP  63  -3.100  21.789   0.843
  518    HD2  ASP  63           HD       ASP  63  -2.652  24.542  -0.953
  519    H    ALA  64           H        ALA  64  -3.792  19.430  -0.453
  520    HA   ALA  64           HA       ALA  64  -2.489  18.129   1.753
  521   1HB   ALA  64          1HB       ALA  64  -4.956  18.551   1.609
  522   2HB   ALA  64          2HB       ALA  64  -5.034  17.405   0.248
  523   3HB   ALA  64          3HB       ALA  64  -4.547  16.836   1.863
  524    H    VAL  65           H        VAL  65  -2.530  17.886  -1.717
  525    HA   VAL  65           HA       VAL  65  -2.037  15.086  -1.853
  526    HB   VAL  65           HB       VAL  65  -2.752  17.106  -3.592
  527   1HG1  VAL  65          1HG1      VAL  65  -1.069  17.169  -5.351
  528   2HG1  VAL  65          2HG1      VAL  65  -0.375  17.765  -3.824
  529   3HG1  VAL  65          3HG1      VAL  65   0.009  16.123  -4.393
  530   1HG2  VAL  65          1HG2      VAL  65  -2.260  14.210  -3.684
  531   2HG2  VAL  65          2HG2      VAL  65  -3.620  15.165  -4.322
  532   3HG2  VAL  65          3HG2      VAL  65  -2.119  15.011  -5.268
  533    H    LYS  66           H        LYS  66  -0.028  18.086  -1.856
  534    HA   LYS  66           HA       LYS  66   2.395  16.610  -2.161
  535   1HB   LYS  66          1HB       LYS  66   1.805  19.075  -2.818
  536   2HB   LYS  66          2HB       LYS  66   2.233  19.442  -1.159
  537   1HG   LYS  66          1HG       LYS  66   4.474  18.986  -1.484
  538   2HG   LYS  66          2HG       LYS  66   4.158  17.661  -2.587
  539   1HD   LYS  66          1HD       LYS  66   3.295  19.640  -4.186
  540   2HD   LYS  66          2HD       LYS  66   4.341  20.616  -3.173
  541   1HE   LYS  66          1HE       LYS  66   6.296  19.417  -3.808
  542   2HE   LYS  66          2HE       LYS  66   5.385  18.020  -4.347
  543   1HZ   LYS  66          1HZ       LYS  66   5.283  20.663  -5.701
  544   2HZ   LYS  66          2HZ       LYS  66   6.207  19.420  -6.203
  545    H    ALA  67           H        ALA  67   0.753  18.345   0.569
  546    HA   ALA  67           HA       ALA  67   2.676  17.661   2.480
  547   1HB   ALA  67          1HB       ALA  67  -0.291  18.155   2.933
  548   2HB   ALA  67          2HB       ALA  67   1.050  18.456   4.065
  549   3HB   ALA  67          3HB       ALA  67   0.879  19.453   2.600
  550    H    GLY  68           H        GLY  68  -0.531  16.159   1.664
  551   1HA   GLY  68          1HA       GLY  68  -0.492  14.088   3.483
  552   2HA   GLY  68          2HA       GLY  68  -1.272  14.051   1.915
  553    H    ILE  69           H        ILE  69   0.531  13.898  -0.010
  554    HA   ILE  69           HA       ILE  69   1.564  11.340   0.161
  555    HB   ILE  69           HB       ILE  69   1.021  12.866  -1.850
  556   1HG1  ILE  69          1HG1      ILE  69   3.468  11.085  -1.997
  557   2HG1  ILE  69          2HG1      ILE  69   1.826  10.483  -1.879
  558   1HG2  ILE  69          1HG2      ILE  69   3.879  13.391  -2.224
  559   2HG2  ILE  69          2HG2      ILE  69   2.466  14.425  -2.538
  560   3HG2  ILE  69          3HG2      ILE  69   3.150  14.329  -0.898
  561   1HD1  ILE  69          1HD1      ILE  69   1.463  12.195  -3.944
  562   2HD1  ILE  69          2HD1      ILE  69   3.194  11.847  -4.172
  563   3HD1  ILE  69          3HD1      ILE  69   2.010  10.518  -4.183
  564    H    LYS  70           H        LYS  70   2.858  14.444   1.243
  565    HA   LYS  70           HA       LYS  70   5.558  13.593   1.377
  566   1HB   LYS  70          1HB       LYS  70   5.479  15.862   1.327
  567   2HB   LYS  70          2HB       LYS  70   3.959  15.954   2.194
  568   1HG   LYS  70          1HG       LYS  70   5.698  16.838   3.646
  569   2HG   LYS  70          2HG       LYS  70   5.166  15.309   4.316
  570   1HD   LYS  70          1HD       LYS  70   7.147  14.312   2.828
  571   2HD   LYS  70          2HD       LYS  70   7.753  15.955   2.886
  572   1HE   LYS  70          1HE       LYS  70   7.324  14.015   5.176
  573   2HE   LYS  70          2HE       LYS  70   8.764  14.928   4.772
  574   1HZ   LYS  70          1HZ       LYS  70   6.441  15.790   6.278
  575   2HZ   LYS  70          2HZ       LYS  70   7.985  16.290   6.400
  576    H    ALA  71           H        ALA  71   2.703  13.371   3.495
  577    HA   ALA  71           HA       ALA  71   4.206  12.621   5.796
  578   1HB   ALA  71          1HB       ALA  71   2.172  13.507   6.404
  579   2HB   ALA  71          2HB       ALA  71   1.334  12.846   4.980
  580   3HB   ALA  71          3HB       ALA  71   1.714  11.788   6.359
  581    H    LEU  72           H        LEU  72   2.360  10.907   3.207
  582    HA   LEU  72           HA       LEU  72   2.837   8.348   4.351
  583   1HB   LEU  72          1HB       LEU  72   0.940   8.375   3.092
  584   2HB   LEU  72          2HB       LEU  72   1.610   9.447   1.878
  585    HG   LEU  72           HG       LEU  72   3.127   7.351   1.313
  586   1HD1  LEU  72          1HD1      LEU  72   0.875   5.600   1.803
  587   2HD1  LEU  72          2HD1      LEU  72   2.596   5.393   2.213
  588   3HD1  LEU  72          3HD1      LEU  72   1.513   6.263   3.326
  589   1HD2  LEU  72          1HD2      LEU  72   1.407   6.632  -0.340
  590   2HD2  LEU  72          2HD2      LEU  72   0.235   7.691   0.482
  591   3HD2  LEU  72          3HD2      LEU  72   1.677   8.391  -0.291
  592    H    GLN  73           H        GLN  73   4.707  10.608   2.484
  593    HA   GLN  73           HA       GLN  73   6.327   8.629   1.255
  594   1HB   GLN  73          1HB       GLN  73   6.181  11.598   1.344
  595   2HB   GLN  73          2HB       GLN  73   7.801  10.959   1.141
  596   1HG   GLN  73          1HG       GLN  73   5.897   9.513  -0.555
  597   2HG   GLN  73          2HG       GLN  73   5.815  11.237  -0.863
  598   1HE2  GLN  73          1HE2      GLN  73   7.738   8.361  -0.991
  599   2HE2  GLN  73          2HE2      GLN  73   9.066   8.974  -1.919
  600    H    GLU  74           H        GLU  74   6.592  10.848   4.097
  601    HA   GLU  74           HA       GLU  74   9.198   9.993   4.723
  602   1HB   GLU  74          1HB       GLU  74   8.981  11.374   6.673
  603   2HB   GLU  74          2HB       GLU  74   8.108  12.195   5.396
  604   1HG   GLU  74          1HG       GLU  74   6.295  12.225   6.756
  605   2HG   GLU  74          2HG       GLU  74   6.177  10.489   6.545
  606    HE2  GLU  74           HE       GLU  74   5.645   9.998   8.522
  607    H    ALA  75           H        ALA  75   5.944   8.794   5.378
  608    HA   ALA  75           HA       ALA  75   6.886   7.080   7.523
  609   1HB   ALA  75          1HB       ALA  75   4.483   8.361   6.948
  610   2HB   ALA  75          2HB       ALA  75   4.159   6.667   6.512
  611   3HB   ALA  75          3HB       ALA  75   4.717   7.072   8.153
  612    H    SER  76           H        SER  76   7.636   7.005   4.459
  613    HA   SER  76           HA       SER  76   6.523   4.774   3.341
  614   1HB   SER  76          1HB       SER  76   7.827   5.855   1.795
  615   2HB   SER  76          2HB       SER  76   9.010   6.361   2.985
  616    HG   SER  76           HG       SER  76   9.089   4.215   1.269
  617    H    GLY  77           H        GLY  77   9.914   4.836   4.656
  618   1HA   GLY  77          1HA       GLY  77  10.250   2.119   4.908
  619   2HA   GLY  77          2HA       GLY  77  11.071   3.335   5.867
  620    H    PHE  78           H        PHE  78   8.178   4.242   6.774
  621    HA   PHE  78           HA       PHE  78   8.220   2.673   9.151
  622   1HB   PHE  78          1HB       PHE  78   7.037   5.123   8.014
  623   2HB   PHE  78          2HB       PHE  78   5.802   4.211   8.862
  624    HD1  PHE  78           HD1      PHE  78   6.864   3.194  11.218
  625    HD2  PHE  78           HD2      PHE  78   7.971   6.798   9.270
  626    HE1  PHE  78           HE1      PHE  78   7.679   4.126  13.403
  627    HE2  PHE  78           HE2      PHE  78   8.787   7.729  11.453
  628    HZ   PHE  78           HZ       PHE  78   8.630   6.381  13.494
  629    H    ILE  79           H        ILE  79   6.084   2.964   6.256
  630    HA   ILE  79           HA       ILE  79   4.157   1.146   7.278
  631    HB   ILE  79           HB       ILE  79   3.383   1.171   4.874
  632   1HG1  ILE  79          1HG1      ILE  79   5.379   3.409   4.511
  633   2HG1  ILE  79          2HG1      ILE  79   5.742   1.763   4.030
  634   1HG2  ILE  79          1HG2      ILE  79   3.489   3.412   6.796
  635   2HG2  ILE  79          2HG2      ILE  79   3.023   3.846   5.135
  636   3HG2  ILE  79          3HG2      ILE  79   2.097   2.614   6.025
  637   1HD1  ILE  79          1HD1      ILE  79   4.357   1.853   2.216
  638   2HD1  ILE  79          2HD1      ILE  79   3.077   2.696   3.121
  639   3HD1  ILE  79          3HD1      ILE  79   4.442   3.617   2.446
  640    H    ARG  80           H        ARG  80   7.079   0.911   5.205
  641    HA   ARG  80           HA       ARG  80   6.612  -1.712   4.423
  642   1HB   ARG  80          1HB       ARG  80   8.224  -0.544   3.136
  643   2HB   ARG  80          2HB       ARG  80   9.038   0.098   4.549
  644   1HG   ARG  80          1HG       ARG  80  10.006  -2.079   5.081
  645   2HG   ARG  80          2HG       ARG  80   9.025  -2.874   3.865
  646   1HD   ARG  80          1HD       ARG  80  10.837  -2.606   2.494
  647   2HD   ARG  80          2HD       ARG  80  10.297  -0.945   2.338
  648    HE   ARG  80           HE       ARG  80  11.948  -1.338   4.710
  649   1HH1  ARG  80          2HH2      ARG  80  12.067  -0.773   1.213
  650   2HH1  ARG  80          1HH2      ARG  80  13.647  -0.062   1.258
  651   1HH2  ARG  80          1HH       ARG  80  14.782   0.148   3.358
  652    H    SER  81           H        SER  81   8.515  -0.236   7.128
  653    HA   SER  81           HA       SER  81   9.408  -2.742   8.065
  654   1HB   SER  81          1HB       SER  81  10.721  -0.757   8.531
  655   2HB   SER  81          2HB       SER  81   9.361   0.046   9.289
  656    HG   SER  81           HG       SER  81   9.438  -1.475  11.025
  657    H    LEU  82           H        LEU  82   6.618  -0.601   8.663
  658    HA   LEU  82           HA       LEU  82   5.797  -1.791  11.076
  659   1HB   LEU  82          1HB       LEU  82   5.070   0.399  10.486
  660   2HB   LEU  82          2HB       LEU  82   4.375  -0.160   8.977
  661    HG   LEU  82           HG       LEU  82   3.103  -1.640  11.036
  662   1HD1  LEU  82          1HD1      LEU  82   3.095   1.325  11.655
  663   2HD1  LEU  82          2HD1      LEU  82   2.173   0.050  12.486
  664   3HD1  LEU  82          3HD1      LEU  82   3.948   0.083  12.601
  665   1HD2  LEU  82          1HD2      LEU  82   1.889   0.731   9.630
  666   2HD2  LEU  82          2HD2      LEU  82   2.295  -0.763   8.753
  667   3HD2  LEU  82          3HD2      LEU  82   1.135  -0.811  10.101
  668    H    LEU  83           H        LEU  83   5.367  -2.592   7.631
  669    HA   LEU  83           HA       LEU  83   3.294  -4.477   8.099
  670   1HB   LEU  83          1HB       LEU  83   5.153  -4.013   5.764
  671   2HB   LEU  83          2HB       LEU  83   3.843  -5.177   5.761
  672    HG   LEU  83           HG       LEU  83   3.127  -2.379   6.480
  673   1HD1  LEU  83          1HD1      LEU  83   3.217  -2.825   3.567
  674   2HD1  LEU  83          2HD1      LEU  83   3.570  -1.367   4.526
  675   3HD1  LEU  83          3HD1      LEU  83   4.805  -2.637   4.351
  676   1HD2  LEU  83          1HD2      LEU  83   1.149  -3.387   6.302
  677   2HD2  LEU  83          2HD2      LEU  83   1.398  -3.336   4.540
  678   3HD2  LEU  83          3HD2      LEU  83   1.846  -4.793   5.460
  679    H    GLY  84           H        GLY  84   6.831  -4.802   7.320
  680   1HA   GLY  84          1HA       GLY  84   7.099  -7.507   7.472
  681   2HA   GLY  84          2HA       GLY  84   8.322  -6.360   7.977
  682    H    LYS  85           H        LYS  85   7.129  -5.141  10.226
  683    HA   LYS  85           HA       LYS  85   7.512  -7.214  12.145
  684   1HB   LYS  85          1HB       LYS  85   7.389  -4.289  12.088
  685   2HB   LYS  85          2HB       LYS  85   6.604  -4.967  13.500
  686   1HG   LYS  85          1HG       LYS  85   8.799  -6.507  13.575
  687   2HG   LYS  85          2HG       LYS  85   9.489  -5.197  12.637
  688   1HD   LYS  85          1HD       LYS  85   7.948  -4.590  15.180
  689   2HD   LYS  85          2HD       LYS  85   9.618  -5.113  15.273
  690   1HE   LYS  85          1HE       LYS  85  10.384  -3.220  13.962
  691   2HE   LYS  85          2HE       LYS  85   8.751  -2.796  13.492
  692   1HZ   LYS  85          1HZ       LYS  85   8.301  -1.946  15.594
  693   2HZ   LYS  85          2HZ       LYS  85   9.425  -2.843  16.357
  694    H    ALA  86           H        ALA  86   4.736  -5.324  10.853
  695    HA   ALA  86           HA       ALA  86   2.842  -6.228  12.687
  696   1HB   ALA  86          1HB       ALA  86   2.697  -5.247   9.816
  697   2HB   ALA  86          2HB       ALA  86   1.247  -5.632  10.774
  698   3HB   ALA  86          3HB       ALA  86   2.352  -4.342  11.310
  699    H    MET  87           H        MET  87   4.352  -7.728   9.843
  700    HA   MET  87           HA       MET  87   2.537  -9.985  10.209
  701   1HB   MET  87          1HB       MET  87   3.241  -8.533   7.889
  702   2HB   MET  87          2HB       MET  87   4.243  -9.968   7.776
  703   1HG   MET  87          1HG       MET  87   2.070 -11.319   8.289
  704   2HG   MET  87          2HG       MET  87   1.205  -9.829   7.964
  705   1HE   MET  87          1HE       MET  87   0.765  -9.068   5.066
  706   2HE   MET  87          2HE       MET  87   1.975  -8.321   6.138
  707   3HE   MET  87          3HE       MET  87   2.437  -8.839   4.499
  708    H    ARG  88           H        ARG  88   5.296  -9.058  11.484
  709    HA   ARG  88           HA       ARG  88   7.367  -9.913  11.682
  710   1HB   ARG  88          1HB       ARG  88   5.281 -11.730  12.883
  711   2HB   ARG  88          2HB       ARG  88   6.948 -12.265  12.964
  712   1HG   ARG  88          1HG       ARG  88   7.517  -9.942  13.933
  713   2HG   ARG  88          2HG       ARG  88   5.791  -9.671  14.073
  714   1HD   ARG  88          1HD       ARG  88   5.995 -12.149  15.257
  715   2HD   ARG  88          2HD       ARG  88   7.562 -11.482  15.663
  716    HE   ARG  88           HE       ARG  88   6.519  -9.834  17.010
  717   1HH1  ARG  88          2HH2      ARG  88   4.085 -11.666  15.198
  718   2HH1  ARG  88          1HH2      ARG  88   2.755 -11.046  16.118
  719   1HH2  ARG  88          1HH       ARG  88   3.178  -9.492  17.893
  720    H    LEU  89           H        LEU  89   7.882 -10.250   9.331
  721    HA   LEU  89           HA       LEU  89   7.843 -13.106   8.636
  722   1HB   LEU  89          1HB       LEU  89   6.653 -11.082   7.269
  723   2HB   LEU  89          2HB       LEU  89   8.226 -11.109   6.498
  724    HG   LEU  89           HG       LEU  89   7.928 -13.519   5.996
  725   1HD1  LEU  89          1HD1      LEU  89   5.253 -13.084   7.328
  726   2HD1  LEU  89          2HD1      LEU  89   5.554 -14.413   6.183
  727   3HD1  LEU  89          3HD1      LEU  89   6.493 -14.307   7.690
  728   1HD2  LEU  89          1HD2      LEU  89   6.691 -13.169   4.081
  729   2HD2  LEU  89          2HD2      LEU  89   5.519 -12.107   4.898
  730   3HD2  LEU  89          3HD2      LEU  89   7.153 -11.508   4.524
  731    H    ARG  90           H        ARG  90   9.710 -12.470   6.352
  732    HA   ARG  90           HA       ARG  90  12.052 -11.592   7.754
  733   1HB   ARG  90          1HB       ARG  90  12.226 -13.919   8.313
  734   2HB   ARG  90          2HB       ARG  90  11.652 -14.432   6.740
  735   1HG   ARG  90          1HG       ARG  90  13.746 -14.372   5.843
  736   2HG   ARG  90          2HG       ARG  90  14.063 -12.776   6.491
  737   1HD   ARG  90          1HD       ARG  90  15.449 -13.712   8.026
  738   2HD   ARG  90          2HD       ARG  90  14.067 -14.511   8.750
  739    HE   ARG  90           HE       ARG  90  14.972 -15.945   6.396
  740   1HH1  ARG  90          2HH2      ARG  90  15.721 -15.411   9.819
  741   2HH1  ARG  90          1HH2      ARG  90  16.530 -16.930  10.007
  742   1HH2  ARG  90          1HH       ARG  90  16.708 -18.407   8.128
  743    H    ILE  91           H        ILE  91  10.546 -12.993   4.784
  744    HA   ILE  91           HA       ILE  91  12.393 -12.573   2.898
  745    HB   ILE  91           HB       ILE  91  10.360 -11.849   1.452
  746   1HG1  ILE  91          1HG1      ILE  91   8.604 -13.039   3.501
  747   2HG1  ILE  91          2HG1      ILE  91   9.186 -11.435   3.898
  748   1HG2  ILE  91          1HG2      ILE  91   9.493 -14.400   2.144
  749   2HG2  ILE  91          2HG2      ILE  91  10.721 -13.981   0.924
  750   3HG2  ILE  91          3HG2      ILE  91  11.216 -14.387   2.585
  751   1HD1  ILE  91          1HD1      ILE  91   7.967 -10.437   2.237
  752   2HD1  ILE  91          2HD1      ILE  91   8.311 -11.737   1.072
  753   3HD1  ILE  91          3HD1      ILE  91   7.020 -11.943   2.278
  754    H    VAL  92           H        VAL  92  10.714 -10.100   4.795
  755    HA   VAL  92           HA       VAL  92  10.605  -7.844   4.415
  756    HB   VAL  92           HB       VAL  92  13.539  -8.467   4.802
  757   1HG1  VAL  92          1HG1      VAL  92  13.759  -6.235   4.566
  758   2HG1  VAL  92          2HG1      VAL  92  12.014  -5.941   4.755
  759   3HG1  VAL  92          3HG1      VAL  92  13.040  -6.160   6.194
  760   1HG2  VAL  92          1HG2      VAL  92  11.772  -7.722   7.082
  761   2HG2  VAL  92          2HG2      VAL  92  11.561  -9.351   6.399
  762   3HG2  VAL  92          3HG2      VAL  92  13.153  -8.844   7.016
  763    HA   PRO  93           HA       PRO  93  12.026  -7.864   0.067
  764   1HB   PRO  93          1HB       PRO  93   9.599  -7.851  -1.190
  765   2HB   PRO  93          2HB       PRO  93  10.533  -9.310  -0.925
  766   1HG   PRO  93          1HG       PRO  93   8.110  -8.377   0.490
  767   2HG   PRO  93          2HG       PRO  93   8.800  -9.987   0.438
  768   1HD   PRO  93          1HD       PRO  93   8.974  -8.114   2.603
  769   2HD   PRO  93          2HD       PRO  93   9.759  -9.678   2.504
  770    H    GLU  94           H        GLU  94  11.726  -6.209  -1.683
  771    HA   GLU  94           HA       GLU  94  11.676  -3.735  -0.380
  772   1HB   GLU  94          1HB       GLU  94  12.854  -4.549  -2.614
  773   2HB   GLU  94          2HB       GLU  94  11.371  -4.007  -3.375
  774   1HG   GLU  94          1HG       GLU  94  11.654  -1.746  -2.450
  775   2HG   GLU  94          2HG       GLU  94  13.035  -2.261  -1.502
  776    HE2  GLU  94           HE       GLU  94  14.108  -0.384  -3.901
  777    H    LEU  95           H        LEU  95   9.396  -4.348   0.597
  778    HA   LEU  95           HA       LEU  95   7.149  -4.138  -1.085
  779   1HB   LEU  95          1HB       LEU  95   7.576  -4.989   1.423
  780   2HB   LEU  95          2HB       LEU  95   6.960  -3.388   1.781
  781    HG   LEU  95           HG       LEU  95   5.138  -4.333  -0.076
  782   1HD1  LEU  95          1HD1      LEU  95   6.490  -6.598   0.565
  783   2HD1  LEU  95          2HD1      LEU  95   5.204  -6.615   1.794
  784   3HD1  LEU  95          3HD1      LEU  95   4.783  -6.548   0.066
  785   1HD2  LEU  95          1HD2      LEU  95   4.794  -3.071   2.084
  786   2HD2  LEU  95          2HD2      LEU  95   3.581  -4.318   1.711
  787   3HD2  LEU  95          3HD2      LEU  95   4.848  -4.644   2.918
  788    H    THR  96           H        THR  96   7.478  -2.324  -2.466
  789    HA   THR  96           HA       THR  96   7.715   0.277  -1.180
  790    HB   THR  96           HB       THR  96   8.834  -0.776  -3.437
  791    HG1  THR  96           HG1      THR  96   9.337   1.442  -3.712
  792   1HG2  THR  96          1HG2      THR  96   7.674  -0.290  -5.392
  793   2HG2  THR  96          2HG2      THR  96   6.261  -0.581  -4.351
  794   3HG2  THR  96          3HG2      THR  96   6.816   1.084  -4.654
  795    H    PHE  97           H        PHE  97   6.272   2.081  -2.103
  796    HA   PHE  97           HA       PHE  97   3.551   1.039  -2.424
  797   1HB   PHE  97          1HB       PHE  97   2.818   2.746  -0.800
  798   2HB   PHE  97          2HB       PHE  97   4.127   1.847  -0.057
  799    HD1  PHE  97           HD1      PHE  97   6.525   2.877  -0.389
  800    HD2  PHE  97           HD2      PHE  97   2.909   5.059  -0.799
  801    HE1  PHE  97           HE1      PHE  97   7.772   5.019   0.007
  802    HE2  PHE  97           HE2      PHE  97   4.156   7.201  -0.401
  803    HZ   PHE  97           HZ       PHE  97   6.573   7.155  -0.005
  804    H    PHE  98           H        PHE  98   2.839   1.687  -4.398
  805    HA   PHE  98           HA       PHE  98   3.975   4.094  -5.544
  806   1HB   PHE  98          1HB       PHE  98   2.809   1.539  -6.374
  807   2HB   PHE  98          2HB       PHE  98   1.895   2.830  -7.128
  808    HD1  PHE  98           HD1      PHE  98   2.690   3.832  -9.073
  809    HD2  PHE  98           HD2      PHE  98   5.384   1.627  -6.646
  810    HE1  PHE  98           HE1      PHE  98   4.464   4.057 -10.835
  811    HE2  PHE  98           HE2      PHE  98   7.158   1.853  -8.408
  812    HZ   PHE  98           HZ       PHE  98   6.676   3.066 -10.483
  813    H    TYR  99           H        TYR  99   3.024   6.031  -5.137
  814    HA   TYR  99           HA       TYR  99   0.200   6.052  -4.424
  815   1HB   TYR  99          1HB       TYR  99   1.308   8.658  -4.404
  816   2HB   TYR  99          2HB       TYR  99   1.198   7.607  -3.005
  817    HD1  TYR  99           HD1      TYR  99   3.178   5.946  -2.626
  818    HD2  TYR  99           HD2      TYR  99   3.404   9.375  -5.174
  819    HE1  TYR  99           HE1      TYR  99   5.714   5.907  -2.466
  820    HE2  TYR  99           HE2      TYR  99   5.939   9.325  -5.004
  821    HH   TYR  99           HH       TYR  99   7.554   7.338  -2.715
  822    H    ASP 100           H        ASP 100  -1.046   5.911  -6.280
  823    HA   ASP 100           HA       ASP 100  -0.348   7.811  -8.372
  824   1HB   ASP 100          1HB       ASP 100  -0.802   5.107  -8.591
  825   2HB   ASP 100          2HB       ASP 100  -2.422   5.712  -8.868
  826    HD2  ASP 100           HD       ASP 100  -2.838   6.566 -10.723
  827    H    ASN 101           H        ASN 101  -1.469   9.623  -7.336
  828    HA   ASN 101           HA       ASN 101  -4.216   9.226  -6.627
  829   1HB   ASN 101          1HB       ASN 101  -3.070  11.996  -6.739
  830   2HB   ASN 101          2HB       ASN 101  -4.015  11.240  -5.470
  831   1HD2  ASN 101          1HD2      ASN 101  -1.123  12.505  -6.134
  832   2HD2  ASN 101          2HD2      ASN 101  -0.083  11.626  -5.062
  833    H    SER 102           H        SER 102  -5.394  11.681  -7.370
  834    HA   SER 102           HA       SER 102  -5.581  11.298 -10.212
  835   1HB   SER 102          1HB       SER 102  -7.747  11.640  -9.633
  836   2HB   SER 102          2HB       SER 102  -7.307  12.291  -8.067
  837    HG   SER 102           HG       SER 102  -8.342  13.666 -10.033
  838    H    LEU 103           H        LEU 103  -3.307  12.757  -8.547
  839    HA   LEU 103           HA       LEU 103  -3.486  15.390  -9.776
  840   1HB   LEU 103          1HB       LEU 103  -2.831  14.856  -7.325
  841   2HB   LEU 103          2HB       LEU 103  -1.274  14.413  -7.998
  842    HG   LEU 103           HG       LEU 103  -1.712  16.887  -9.138
  843   1HD1  LEU 103          1HD1      LEU 103  -2.181  18.121  -6.774
  844   2HD1  LEU 103          2HD1      LEU 103  -3.424  17.815  -8.010
  845   3HD1  LEU 103          3HD1      LEU 103  -3.255  16.711  -6.624
  846   1HD2  LEU 103          1HD2      LEU 103  -0.102  15.842  -6.857
  847   2HD2  LEU 103          2HD2      LEU 103   0.417  16.561  -8.400
  848   3HD2  LEU 103          3HD2      LEU 103  -0.182  17.606  -7.087
  849    H    VAL 104           H        VAL 104  -2.691  12.372 -10.803
  850    HA   VAL 104           HA       VAL 104  -0.662  13.466 -12.609
  851    HB   VAL 104           HB       VAL 104  -0.480  11.111 -10.796
  852   1HG1  VAL 104          1HG1      VAL 104   1.256  10.108 -12.353
  853   2HG1  VAL 104          2HG1      VAL 104  -0.440   9.920 -12.859
  854   3HG1  VAL 104          3HG1      VAL 104   0.588  11.151 -13.632
  855   1HG2  VAL 104          1HG2      VAL 104   1.426  13.196 -11.885
  856   2HG2  VAL 104          2HG2      VAL 104   0.873  12.966 -10.209
  857   3HG2  VAL 104          3HG2      VAL 104   1.976  11.784 -10.953
  858    H    GLU 105           H        GLU 105  -3.727  12.318 -12.210
  859    HA   GLU 105           HA       GLU 105  -3.763  11.423 -14.949
  860   1HB   GLU 105          1HB       GLU 105  -5.343   9.763 -12.995
  861   2HB   GLU 105          2HB       GLU 105  -4.725   9.325 -14.576
  862   1HG   GLU 105          1HG       GLU 105  -2.347   9.625 -13.470
  863   2HG   GLU 105          2HG       GLU 105  -3.212   9.514 -11.951
  864    HE2  GLU 105           HE       GLU 105  -1.929   6.426 -12.853
  865    H    GLY 106           H        GLY 106  -5.429  12.431 -11.945
  866   1HA   GLY 106          1HA       GLY 106  -7.051  14.081 -11.859
  867   2HA   GLY 106          2HA       GLY 106  -7.386  13.871 -13.566
  868    H    MET 107           H        MET 107  -7.557  10.901 -13.453
  869    HA   MET 107           HA       MET 107  -9.875  10.582 -11.729
  870   1HB   MET 107          1HB       MET 107 -11.187   9.644 -13.566
  871   2HB   MET 107          2HB       MET 107 -10.548  11.174 -14.134
  872   1HG   MET 107          1HG       MET 107  -9.089   8.545 -14.642
  873   2HG   MET 107          2HG       MET 107 -10.331   9.133 -15.728
  874   1HE   MET 107          1HE       MET 107  -6.889   8.703 -16.017
  875   2HE   MET 107          2HE       MET 107  -6.033  10.236 -15.724
  876   3HE   MET 107          3HE       MET 107  -6.836   9.393 -14.377
  877    H    ARG 108           H        ARG 108  -7.008   9.681 -11.634
  878    HA   ARG 108           HA       ARG 108  -6.436   7.270 -12.490
  879   1HB   ARG 108          1HB       ARG 108  -4.922   7.092 -10.688
  880   2HB   ARG 108          2HB       ARG 108  -5.253   8.813 -10.705
  881   1HG   ARG 108          1HG       ARG 108  -6.527   6.729  -8.875
  882   2HG   ARG 108          2HG       ARG 108  -5.413   7.997  -8.401
  883   1HD   ARG 108          1HD       ARG 108  -7.055   9.737  -8.946
  884   2HD   ARG 108          2HD       ARG 108  -8.141   8.558  -9.657
  885    HE   ARG 108           HE       ARG 108  -7.429   8.056  -6.837
  886   1HH1  ARG 108          2HH2      ARG 108  -9.764   9.498  -9.079
  887   2HH1  ARG 108          1HH2      ARG 108 -11.050   9.520  -7.919
  888   1HH2  ARG 108          1HH       ARG 108 -10.653   8.683  -5.707
  Start of MODEL   15
    1    H    MET   1           H        MET   1 -12.225  -8.034  -2.624
    2    HA   MET   1           HA       MET   1 -10.652  -8.684  -4.761
    3   1HB   MET   1          1HB       MET   1  -9.522  -6.555  -3.147
    4   2HB   MET   1          2HB       MET   1  -8.551  -7.988  -2.877
    5   1HG   MET   1          1HG       MET   1  -7.707  -6.638  -4.807
    6   2HG   MET   1          2HG       MET   1  -8.170  -8.257  -5.296
    7   1HE   MET   1          1HE       MET   1  -7.985  -4.991  -6.188
    8   2HE   MET   1          2HE       MET   1  -9.385  -4.533  -7.187
    9   3HE   MET   1          3HE       MET   1  -9.459  -4.357  -5.418
   10    H    ALA   2           H        ALA   2 -11.652 -10.688  -4.056
   11    HA   ALA   2           HA       ALA   2 -10.239 -11.860  -1.760
   12   1HB   ALA   2          1HB       ALA   2 -13.031 -12.716  -2.474
   13   2HB   ALA   2          2HB       ALA   2 -12.204 -12.734  -0.899
   14   3HB   ALA   2          3HB       ALA   2 -12.809 -11.200  -1.569
   15    H    LYS   3           H        LYS   3  -9.138 -13.701  -2.252
   16    HA   LYS   3           HA       LYS   3 -10.082 -15.344  -4.439
   17   1HB   LYS   3          1HB       LYS   3  -8.209 -13.395  -5.014
   18   2HB   LYS   3          2HB       LYS   3  -7.207 -14.797  -4.699
   19   1HG   LYS   3          1HG       LYS   3  -9.628 -14.877  -6.556
   20   2HG   LYS   3          2HG       LYS   3  -8.008 -14.523  -7.121
   21   1HD   LYS   3          1HD       LYS   3  -7.214 -16.697  -6.651
   22   2HD   LYS   3          2HD       LYS   3  -8.455 -17.006  -5.453
   23   1HE   LYS   3          1HE       LYS   3  -9.338 -18.256  -7.194
   24   2HE   LYS   3          2HE       LYS   3 -10.090 -16.718  -7.571
   25   1HZ   LYS   3          1HZ       LYS   3  -7.441 -17.355  -8.705
   26   2HZ   LYS   3          2HZ       LYS   3  -8.783 -17.939  -9.417
   27    H    GLU   4           H        GLU   4 -10.543 -16.860  -2.766
   28    HA   GLU   4           HA       GLU   4  -8.280 -17.681  -1.174
   29   1HB   GLU   4          1HB       GLU   4 -10.765 -17.334  -0.362
   30   2HB   GLU   4          2HB       GLU   4 -11.039 -18.926  -1.042
   31   1HG   GLU   4          1HG       GLU   4  -9.789 -19.993   0.581
   32   2HG   GLU   4          2HG       GLU   4  -8.607 -18.702   0.675
   33    HE2  GLU   4           HE       GLU   4 -11.667 -19.625   2.413
   34    H    PHE   5           H        PHE   5  -6.953 -18.692  -2.788
   35    HA   PHE   5           HA       PHE   5  -7.934 -21.336  -3.510
   36   1HB   PHE   5          1HB       PHE   5  -8.067 -19.296  -5.319
   37   2HB   PHE   5          2HB       PHE   5  -6.364 -19.659  -5.504
   38    HD1  PHE   5           HD1      PHE   5  -9.141 -22.053  -4.889
   39    HD2  PHE   5           HD2      PHE   5  -6.262 -20.593  -7.643
   40    HE1  PHE   5           HE1      PHE   5  -9.708 -23.916  -6.472
   41    HE2  PHE   5           HE2      PHE   5  -6.831 -22.456  -9.226
   42    HZ   PHE   5           HZ       PHE   5  -8.547 -24.095  -8.620
   43    H    GLY   6           H        GLY   6  -6.364 -22.910  -3.325
   44   1HA   GLY   6          1HA       GLY   6  -4.129 -22.642  -1.860
   45   2HA   GLY   6          2HA       GLY   6  -4.303 -23.832  -3.136
   46    H    ARG   7           H        ARG   7  -4.587 -21.536  -5.194
   47    HA   ARG   7           HA       ARG   7  -1.989 -21.560  -6.039
   48   1HB   ARG   7          1HB       ARG   7  -4.506 -20.378  -6.858
   49   2HB   ARG   7          2HB       ARG   7  -3.258 -19.159  -7.020
   50   1HG   ARG   7          1HG       ARG   7  -1.925 -21.276  -8.101
   51   2HG   ARG   7          2HG       ARG   7  -3.566 -21.769  -8.470
   52   1HD   ARG   7          1HD       ARG   7  -3.266 -18.937  -9.075
   53   2HD   ARG   7          2HD       ARG   7  -1.971 -19.829  -9.849
   54    HE   ARG   7           HE       ARG   7  -4.648 -21.023 -10.169
   55   1HH1  ARG   7          2HH2      ARG   7  -2.209 -18.862 -11.560
   56   2HH1  ARG   7          1HH2      ARG   7  -2.846 -18.974 -13.166
   57   1HH2  ARG   7          1HH       ARG   7  -4.773 -20.338 -13.571
   58    HA   PRO   8           HA       PRO   8  -0.112 -18.079  -4.165
   59   1HB   PRO   8          1HB       PRO   8   0.979 -16.554  -6.154
   60   2HB   PRO   8          2HB       PRO   8   1.704 -18.042  -5.582
   61   1HG   PRO   8          1HG       PRO   8   0.216 -17.550  -8.087
   62   2HG   PRO   8          2HG       PRO   8   1.294 -18.874  -7.693
   63   1HD   PRO   8          1HD       PRO   8  -1.572 -18.956  -7.758
   64   2HD   PRO   8          2HD       PRO   8  -0.497 -20.245  -7.251
   65    H    GLN   9           H        GLN   9  -2.928 -17.680  -5.630
   66    HA   GLN   9           HA       GLN   9  -3.000 -14.840  -5.588
   67   1HB   GLN   9          1HB       GLN   9  -4.572 -16.931  -6.683
   68   2HB   GLN   9          2HB       GLN   9  -5.626 -16.118  -5.543
   69   1HG   GLN   9          1HG       GLN   9  -5.988 -14.679  -7.295
   70   2HG   GLN   9          2HG       GLN   9  -4.505 -13.933  -6.735
   71   1HE2  GLN   9          1HE2      GLN   9  -3.798 -13.211  -8.670
   72   2HE2  GLN   9          2HE2      GLN   9  -3.275 -14.222  -9.976
   73    H    ARG  10           H        ARG  10  -4.052 -17.547  -3.465
   74    HA   ARG  10           HA       ARG  10  -5.581 -16.085  -1.733
   75   1HB   ARG  10          1HB       ARG  10  -5.310 -18.616  -1.808
   76   2HB   ARG  10          2HB       ARG  10  -3.756 -18.436  -1.018
   77   1HG   ARG  10          1HG       ARG  10  -6.058 -17.056   0.312
   78   2HG   ARG  10          2HG       ARG  10  -6.108 -18.807   0.332
   79   1HD   ARG  10          1HD       ARG  10  -3.411 -18.043   0.973
   80   2HD   ARG  10          2HD       ARG  10  -4.469 -17.029   1.934
   81    HE   ARG  10           HE       ARG  10  -5.292 -18.949   3.066
   82   1HH1  ARG  10          2HH2      ARG  10  -3.120 -19.886   0.429
   83   2HH1  ARG  10          1HH2      ARG  10  -2.968 -21.526   0.972
   84   1HH2  ARG  10          1HH       ARG  10  -4.137 -22.222   2.943
   85    H    VAL  11           H        VAL  11  -2.103 -17.110  -1.315
   86    HA   VAL  11           HA       VAL  11  -1.597 -15.678   0.975
   87    HB   VAL  11           HB       VAL  11  -0.237 -17.381  -0.601
   88   1HG1  VAL  11          1HG1      VAL  11   1.048 -14.669  -1.072
   89   2HG1  VAL  11          2HG1      VAL  11   1.791 -16.242  -1.451
   90   3HG1  VAL  11          3HG1      VAL  11   0.315 -15.727  -2.302
   91   1HG2  VAL  11          1HG2      VAL  11   0.067 -16.704   1.856
   92   2HG2  VAL  11          2HG2      VAL  11   1.512 -17.259   0.975
   93   3HG2  VAL  11          3HG2      VAL  11   1.255 -15.520   1.258
   94    H    ALA  12           H        ALA  12  -1.460 -14.649  -2.478
   95    HA   ALA  12           HA       ALA  12  -0.344 -12.135  -2.007
   96   1HB   ALA  12          1HB       ALA  12  -1.834 -11.762  -4.246
   97   2HB   ALA  12          2HB       ALA  12  -0.284 -12.638  -4.236
   98   3HB   ALA  12          3HB       ALA  12  -1.817 -13.541  -4.182
   99    H    GLN  13           H        GLN  13  -3.698 -13.389  -1.839
  100    HA   GLN  13           HA       GLN  13  -4.852 -10.835  -1.628
  101   1HB   GLN  13          1HB       GLN  13  -5.800 -13.663  -1.099
  102   2HB   GLN  13          2HB       GLN  13  -6.810 -12.303  -0.646
  103   1HG   GLN  13          1HG       GLN  13  -5.785 -12.989  -3.434
  104   2HG   GLN  13          2HG       GLN  13  -7.450 -12.985  -2.890
  105   1HE2  GLN  13          1HE2      GLN  13  -4.715 -11.088  -3.866
  106   2HE2  GLN  13          2HE2      GLN  13  -5.508  -9.559  -4.040
  107    H    GLU  14           H        GLU  14  -4.508 -13.490   0.847
  108    HA   GLU  14           HA       GLU  14  -5.296 -12.202   3.018
  109   1HB   GLU  14          1HB       GLU  14  -3.257 -14.303   2.480
  110   2HB   GLU  14          2HB       GLU  14  -3.100 -13.518   4.040
  111   1HG   GLU  14          1HG       GLU  14  -5.757 -14.620   3.026
  112   2HG   GLU  14          2HG       GLU  14  -4.629 -15.590   3.953
  113    HE2  GLU  14           HE       GLU  14  -5.345 -15.653   5.894
  114    H    MET  15           H        MET  15  -2.100 -11.815   1.403
  115    HA   MET  15           HA       MET  15  -1.107 -10.104   3.415
  116   1HB   MET  15          1HB       MET  15  -0.201 -11.389   0.972
  117   2HB   MET  15          2HB       MET  15   0.196  -9.685   0.856
  118   1HG   MET  15          1HG       MET  15   1.626  -9.742   2.726
  119   2HG   MET  15          2HG       MET  15   0.807 -11.114   3.447
  120   1HE   MET  15          1HE       MET  15   3.866 -10.653   3.173
  121   2HE   MET  15          2HE       MET  15   4.705 -11.568   1.897
  122   3HE   MET  15          3HE       MET  15   3.907 -10.025   1.508
  123    H    GLN  16           H        GLN  16  -2.748  -9.662   0.247
  124    HA   GLN  16           HA       GLN  16  -2.293  -6.926   0.077
  125   1HB   GLN  16          1HB       GLN  16  -3.104  -8.569  -1.741
  126   2HB   GLN  16          2HB       GLN  16  -4.707  -8.389  -1.057
  127   1HG   GLN  16          1HG       GLN  16  -3.408  -5.779  -1.466
  128   2HG   GLN  16          2HG       GLN  16  -3.497  -6.695  -2.958
  129   1HE2  GLN  16          1HE2      GLN  16  -4.942  -4.971  -3.596
  130   2HE2  GLN  16          2HE2      GLN  16  -6.627  -5.052  -3.203
  131    H    LYS  17           H        LYS  17  -4.729  -8.899   1.776
  132    HA   LYS  17           HA       LYS  17  -6.434  -6.676   2.335
  133   1HB   LYS  17          1HB       LYS  17  -7.869  -8.224   3.150
  134   2HB   LYS  17          2HB       LYS  17  -6.860  -9.317   2.223
  135   1HG   LYS  17          1HG       LYS  17  -6.849 -10.406   4.284
  136   2HG   LYS  17          2HG       LYS  17  -5.411  -9.418   4.453
  137   1HD   LYS  17          1HD       LYS  17  -7.044  -7.613   5.463
  138   2HD   LYS  17          2HD       LYS  17  -8.164  -8.949   5.645
  139   1HE   LYS  17          1HE       LYS  17  -5.781 -10.009   6.659
  140   2HE   LYS  17          2HE       LYS  17  -5.710  -8.338   7.181
  141   1HZ   LYS  17          1HZ       LYS  17  -7.468 -10.413   8.087
  142   2HZ   LYS  17          2HZ       LYS  17  -7.097  -9.002   8.811
  143    H    GLU  18           H        GLU  18  -3.781  -8.445   3.992
  144    HA   GLU  18           HA       GLU  18  -4.140  -7.116   6.429
  145   1HB   GLU  18          1HB       GLU  18  -2.928  -9.283   6.162
  146   2HB   GLU  18          2HB       GLU  18  -1.650  -8.462   5.288
  147   1HG   GLU  18          1HG       GLU  18  -0.831  -8.588   7.517
  148   2HG   GLU  18          2HG       GLU  18  -1.400  -6.938   7.369
  149    HE2  GLU  18           HE       GLU  18  -2.840  -7.033  10.036
  150    H    ILE  19           H        ILE  19  -2.139  -6.499   3.501
  151    HA   ILE  19           HA       ILE  19  -0.773  -4.297   4.689
  152    HB   ILE  19           HB       ILE  19   0.259  -4.032   2.592
  153   1HG1  ILE  19          1HG1      ILE  19  -2.073  -5.583   1.452
  154   2HG1  ILE  19          2HG1      ILE  19  -1.593  -3.935   1.094
  155   1HG2  ILE  19          1HG2      ILE  19   1.420  -5.859   3.082
  156   2HG2  ILE  19          2HG2      ILE  19  -0.009  -6.648   3.791
  157   3HG2  ILE  19          3HG2      ILE  19   0.308  -6.784   2.045
  158   1HD1  ILE  19          1HD1      ILE  19  -0.345  -6.522   0.185
  159   2HD1  ILE  19          2HD1      ILE  19  -0.667  -5.034  -0.737
  160   3HD1  ILE  19          3HD1      ILE  19   0.711  -5.103   0.387
  161    H    ALA  20           H        ALA  20  -3.578  -4.730   2.456
  162    HA   ALA  20           HA       ALA  20  -4.003  -2.054   1.898
  163   1HB   ALA  20          1HB       ALA  20  -5.128  -3.757   0.646
  164   2HB   ALA  20          2HB       ALA  20  -5.861  -4.448   2.115
  165   3HB   ALA  20          3HB       ALA  20  -6.394  -2.858   1.517
  166    H    LEU  21           H        LEU  21  -4.823  -4.039   4.757
  167    HA   LEU  21           HA       LEU  21  -6.563  -2.109   5.887
  168   1HB   LEU  21          1HB       LEU  21  -6.832  -4.377   6.490
  169   2HB   LEU  21          2HB       LEU  21  -5.146  -4.548   6.936
  170    HG   LEU  21           HG       LEU  21  -6.279  -2.477   8.556
  171   1HD1  LEU  21          1HD1      LEU  21  -8.216  -3.266   9.429
  172   2HD1  LEU  21          2HD1      LEU  21  -8.371  -3.961   7.799
  173   3HD1  LEU  21          3HD1      LEU  21  -7.790  -4.971   9.144
  174   1HD2  LEU  21          1HD2      LEU  21  -4.943  -5.112   8.905
  175   2HD2  LEU  21          2HD2      LEU  21  -4.526  -3.511   9.560
  176   3HD2  LEU  21          3HD2      LEU  21  -5.842  -4.458  10.295
  177    H    ILE  22           H        ILE  22  -3.177  -3.138   6.735
  178    HA   ILE  22           HA       ILE  22  -2.763  -1.074   8.550
  179    HB   ILE  22           HB       ILE  22  -0.783  -2.622   6.877
  180   1HG1  ILE  22          1HG1      ILE  22  -1.800  -3.163   9.682
  181   2HG1  ILE  22          2HG1      ILE  22  -2.337  -4.011   8.244
  182   1HG2  ILE  22          1HG2      ILE  22   0.037  -0.464   7.944
  183   2HG2  ILE  22          2HG2      ILE  22  -0.246  -1.253   9.514
  184   3HG2  ILE  22          3HG2      ILE  22   0.917  -1.953   8.362
  185   1HD1  ILE  22          1HD1      ILE  22   0.620  -3.841   8.911
  186   2HD1  ILE  22          2HD1      ILE  22  -0.420  -5.078   9.660
  187   3HD1  ILE  22          3HD1      ILE  22  -0.223  -5.031   7.891
  188    H    LEU  23           H        LEU  23  -2.961  -1.078   5.071
  189    HA   LEU  23           HA       LEU  23  -1.425   1.362   4.826
  190   1HB   LEU  23          1HB       LEU  23  -1.393  -0.547   3.175
  191   2HB   LEU  23          2HB       LEU  23  -3.026  -0.097   2.725
  192    HG   LEU  23           HG       LEU  23  -1.310   2.227   2.626
  193   1HD1  LEU  23          1HD1      LEU  23   0.256   0.094   2.184
  194   2HD1  LEU  23          2HD1      LEU  23  -0.410   0.306   0.548
  195   3HD1  LEU  23          3HD1      LEU  23   0.457   1.645   1.336
  196   1HD2  LEU  23          1HD2      LEU  23  -2.238   2.494   0.455
  197   2HD2  LEU  23          2HD2      LEU  23  -2.667   0.769   0.350
  198   3HD2  LEU  23          3HD2      LEU  23  -3.524   1.833   1.492
  199    H    GLN  24           H        GLN  24  -4.660   0.352   5.548
  200    HA   GLN  24           HA       GLN  24  -5.607   3.010   4.812
  201   1HB   GLN  24          1HB       GLN  24  -6.834   0.308   4.706
  202   2HB   GLN  24          2HB       GLN  24  -7.887   1.544   5.367
  203   1HG   GLN  24          1HG       GLN  24  -7.084   2.974   3.285
  204   2HG   GLN  24          2HG       GLN  24  -6.608   1.424   2.621
  205   1HE2  GLN  24          1HE2      GLN  24  -8.046   0.850   1.181
  206   2HE2  GLN  24          2HE2      GLN  24  -9.770   0.847   1.364
  207    H    ARG  25           H        ARG  25  -4.510   1.131   7.392
  208    HA   ARG  25           HA       ARG  25  -6.240   2.565   9.241
  209   1HB   ARG  25          1HB       ARG  25  -5.267  -0.194   9.157
  210   2HB   ARG  25          2HB       ARG  25  -4.772   0.567  10.655
  211   1HG   ARG  25          1HG       ARG  25  -6.906  -0.281  11.194
  212   2HG   ARG  25          2HG       ARG  25  -7.247   1.399  10.829
  213   1HD   ARG  25          1HD       ARG  25  -7.388   0.067   8.323
  214   2HD   ARG  25          2HD       ARG  25  -8.181  -1.013   9.451
  215    HE   ARG  25           HE       ARG  25  -9.252   1.447   8.477
  216   1HH1  ARG  25          2HH2      ARG  25  -8.952  -0.319  11.533
  217   2HH1  ARG  25          1HH2      ARG  25 -10.377   0.382  12.223
  218   1HH2  ARG  25          1HH       ARG  25 -11.644   1.963  10.943
  219    H    GLU  26           H        GLU  26  -2.878   1.165   9.012
  220    HA   GLU  26           HA       GLU  26  -1.861   2.862  10.972
  221   1HB   GLU  26          1HB       GLU  26  -0.056   1.514  10.753
  222   2HB   GLU  26          2HB       GLU  26  -0.966   0.636   9.539
  223   1HG   GLU  26          1HG       GLU  26   1.026   1.197   8.396
  224   2HG   GLU  26          2HG       GLU  26  -0.091   2.431   7.852
  225    HE2  GLU  26           HE       GLU  26   1.172   3.964  10.944
  226    H    ILE  27           H        ILE  27  -2.652   3.343   7.616
  227    HA   ILE  27           HA       ILE  27  -0.772   5.482   7.225
  228    HB   ILE  27           HB       ILE  27  -2.035   3.751   5.568
  229   1HG1  ILE  27          1HG1      ILE  27  -0.692   6.404   5.110
  230   2HG1  ILE  27          2HG1      ILE  27  -0.065   4.787   4.861
  231   1HG2  ILE  27          1HG2      ILE  27  -3.588   5.066   4.162
  232   2HG2  ILE  27          2HG2      ILE  27  -4.214   4.769   5.801
  233   3HG2  ILE  27          3HG2      ILE  27  -3.553   6.366   5.377
  234   1HD1  ILE  27          1HD1      ILE  27  -2.013   6.347   3.148
  235   2HD1  ILE  27          2HD1      ILE  27  -0.533   5.484   2.664
  236   3HD1  ILE  27          3HD1      ILE  27  -2.002   4.569   3.082
  237    H    LYS  28           H        LYS  28  -1.879   7.626   6.257
  238    HA   LYS  28           HA       LYS  28  -3.655   8.508   8.401
  239   1HB   LYS  28          1HB       LYS  28  -2.964  10.788   7.667
  240   2HB   LYS  28          2HB       LYS  28  -1.645   9.790   8.244
  241   1HG   LYS  28          1HG       LYS  28  -1.929   9.310   5.414
  242   2HG   LYS  28          2HG       LYS  28  -1.943  11.044   5.661
  243   1HD   LYS  28          1HD       LYS  28   0.340  10.817   5.652
  244   2HD   LYS  28          2HD       LYS  28   0.114  10.372   7.331
  245   1HE   LYS  28          1HE       LYS  28   0.012   8.295   5.105
  246   2HE   LYS  28          2HE       LYS  28   1.526   8.768   5.848
  247   1HZ   LYS  28          1HZ       LYS  28   1.041   7.453   7.585
  248   2HZ   LYS  28          2HZ       LYS  28  -0.369   8.217   7.874
  249    H    ASP  29           H        ASP  29  -5.425   7.220   7.315
  250    HA   ASP  29           HA       ASP  29  -6.309   8.319   4.825
  251   1HB   ASP  29          1HB       ASP  29  -7.032   6.165   4.715
  252   2HB   ASP  29          2HB       ASP  29  -6.805   5.930   6.436
  253    HD2  ASP  29           HD       ASP  29  -9.942   6.149   7.324
  254    HA   PRO  30           HA       PRO  30  -9.667   9.661   7.959
  255   1HB   PRO  30          1HB       PRO  30  -9.174   9.416  10.636
  256   2HB   PRO  30          2HB       PRO  30 -10.075   8.228   9.716
  257   1HG   PRO  30          1HG       PRO  30  -7.302   8.074  10.727
  258   2HG   PRO  30          2HG       PRO  30  -8.349   6.774  10.192
  259   1HD   PRO  30          1HD       PRO  30  -6.170   7.934   8.731
  260   2HD   PRO  30          2HD       PRO  30  -7.289   6.715   8.153
  261    H    ARG  31           H        ARG  31  -6.375  10.298   8.271
  262    HA   ARG  31           HA       ARG  31  -6.811  12.764   9.630
  263   1HB   ARG  31          1HB       ARG  31  -4.239  12.106   8.174
  264   2HB   ARG  31          2HB       ARG  31  -4.451  12.945   9.699
  265   1HG   ARG  31          1HG       ARG  31  -5.339  10.699  10.643
  266   2HG   ARG  31          2HG       ARG  31  -4.739   9.957   9.174
  267   1HD   ARG  31          1HD       ARG  31  -2.685   9.830  10.136
  268   2HD   ARG  31          2HD       ARG  31  -2.596  11.579  10.091
  269    HE   ARG  31           HE       ARG  31  -3.225  11.678  12.379
  270   1HH1  ARG  31          2HH2      ARG  31  -3.425   8.352  11.174
  271   2HH1  ARG  31          1HH2      ARG  31  -3.571   7.656  12.752
  272   1HH2  ARG  31          1HH       ARG  31  -3.565   9.091  14.673
  273    H    LEU  32           H        LEU  32  -5.821  11.650   6.320
  274    HA   LEU  32           HA       LEU  32  -5.706  14.282   5.271
  275   1HB   LEU  32          1HB       LEU  32  -5.586  11.503   4.170
  276   2HB   LEU  32          2HB       LEU  32  -5.832  12.848   3.074
  277    HG   LEU  32           HG       LEU  32  -3.727  13.762   3.491
  278   1HD1  LEU  32          1HD1      LEU  32  -2.255  13.002   5.380
  279   2HD1  LEU  32          2HD1      LEU  32  -3.717  13.891   5.869
  280   3HD1  LEU  32          3HD1      LEU  32  -3.658  12.120   6.031
  281   1HD2  LEU  32          1HD2      LEU  32  -2.946  12.094   2.222
  282   2HD2  LEU  32          2HD2      LEU  32  -2.272  11.444   3.736
  283   3HD2  LEU  32          3HD2      LEU  32  -3.839  10.853   3.134
  284    H    GLY  33           H        GLY  33  -8.257  11.978   5.945
  285   1HA   GLY  33          1HA       GLY  33 -10.502  12.413   5.924
  286   2HA   GLY  33          2HA       GLY  33 -10.228  13.892   5.026
  287    H    MET  34           H        MET  34  -8.907  10.681   4.104
  288    HA   MET  34           HA       MET  34 -10.902  10.545   2.000
  289   1HB   MET  34          1HB       MET  34  -7.868  10.631   1.721
  290   2HB   MET  34          2HB       MET  34  -8.821   9.784   0.520
  291   1HG   MET  34          1HG       MET  34  -8.658  11.963  -0.389
  292   2HG   MET  34          2HG       MET  34 -10.238  11.981   0.367
  293   1HE   MET  34          1HE       MET  34  -7.970  14.503  -0.310
  294   2HE   MET  34          2HE       MET  34  -6.914  14.809   1.090
  295   3HE   MET  34          3HE       MET  34  -6.759  13.292   0.173
  296    H    MET  35           H        MET  35 -10.724   8.320   0.806
  297    HA   MET  35           HA       MET  35 -10.015   6.336   2.827
  298   1HB   MET  35          1HB       MET  35 -12.524   6.822   1.941
  299   2HB   MET  35          2HB       MET  35 -12.016   5.806   0.606
  300   1HG   MET  35          1HG       MET  35 -11.321   4.032   2.291
  301   2HG   MET  35          2HG       MET  35 -11.986   5.036   3.565
  302   1HE   MET  35          1HE       MET  35 -14.171   2.012   1.201
  303   2HE   MET  35          2HE       MET  35 -12.596   2.654   0.674
  304   3HE   MET  35          3HE       MET  35 -12.772   1.950   2.299
  305    H    THR  36           H        THR  36  -7.799   6.459   1.798
  306    HA   THR  36           HA       THR  36  -7.122   6.012  -0.759
  307    HB   THR  36           HB       THR  36  -5.106   4.867   0.215
  308    HG1  THR  36           HG1      THR  36  -6.720   5.100   2.650
  309   1HG2  THR  36          1HG2      THR  36  -4.352   6.665   1.549
  310   2HG2  THR  36          2HG2      THR  36  -5.670   7.445   0.641
  311   3HG2  THR  36          3HG2      THR  36  -5.945   6.892   2.310
  312    H    THR  37           H        THR  37  -6.473   4.104  -2.015
  313    HA   THR  37           HA       THR  37  -7.949   1.684  -1.296
  314    HB   THR  37           HB       THR  37  -8.346   3.454  -3.738
  315    HG1  THR  37           HG1      THR  37  -9.920   3.611  -2.080
  316   1HG2  THR  37          1HG2      THR  37  -7.878   1.099  -4.559
  317   2HG2  THR  37          2HG2      THR  37  -9.152   0.511  -3.463
  318   3HG2  THR  37          3HG2      THR  37  -9.569   1.598  -4.809
  319    H    VAL  38           H        VAL  38  -7.330  -0.184  -2.758
  320    HA   VAL  38           HA       VAL  38  -4.537   0.156  -3.604
  321    HB   VAL  38           HB       VAL  38  -5.809  -2.079  -2.019
  322   1HG1  VAL  38          1HG1      VAL  38  -4.288  -2.878  -3.885
  323   2HG1  VAL  38          2HG1      VAL  38  -2.962  -2.028  -3.055
  324   3HG1  VAL  38          3HG1      VAL  38  -3.814  -3.360  -2.238
  325   1HG2  VAL  38          1HG2      VAL  38  -4.624  -1.360  -0.215
  326   2HG2  VAL  38          2HG2      VAL  38  -3.265  -0.767  -1.200
  327   3HG2  VAL  38          3HG2      VAL  38  -4.751   0.203  -1.059
  328    H    SER  39           H        SER  39  -5.318   0.519  -5.777
  329    HA   SER  39           HA       SER  39  -6.847  -1.633  -6.923
  330   1HB   SER  39          1HB       SER  39  -6.607   1.143  -7.417
  331   2HB   SER  39          2HB       SER  39  -5.882   0.380  -8.818
  332    HG   SER  39           HG       SER  39  -7.893  -0.995  -8.883
  333    H    GLY  40           H        GLY  40  -3.966  -1.918  -5.934
  334   1HA   GLY  40          1HA       GLY  40  -3.001  -3.492  -8.095
  335   2HA   GLY  40          2HA       GLY  40  -2.116  -1.984  -7.988
  336    H    VAL  41           H        VAL  41  -1.579  -5.010  -7.284
  337    HA   VAL  41           HA       VAL  41  -0.037  -4.375  -4.931
  338    HB   VAL  41           HB       VAL  41  -2.138  -5.021  -3.939
  339   1HG1  VAL  41          1HG1      VAL  41  -3.502  -6.395  -5.052
  340   2HG1  VAL  41          2HG1      VAL  41  -2.178  -6.964  -6.098
  341   3HG1  VAL  41          3HG1      VAL  41  -2.464  -7.741  -4.522
  342   1HG2  VAL  41          1HG2      VAL  41  -1.324  -7.239  -2.811
  343   2HG2  VAL  41          2HG2      VAL  41   0.166  -6.943  -3.740
  344   3HG2  VAL  41          3HG2      VAL  41  -0.407  -5.732  -2.569
  345    H    GLU  42           H        GLU  42   1.888  -5.510  -4.915
  346    HA   GLU  42           HA       GLU  42   2.046  -7.883  -6.532
  347   1HB   GLU  42          1HB       GLU  42   3.883  -5.504  -7.054
  348   2HB   GLU  42          2HB       GLU  42   3.981  -7.068  -7.839
  349   1HG   GLU  42          1HG       GLU  42   1.721  -6.749  -8.819
  350   2HG   GLU  42          2HG       GLU  42   1.550  -5.221  -7.977
  351    HE2  GLU  42           HE       GLU  42   1.615  -3.871  -9.539
  352    H    MET  43           H        MET  43   3.525  -9.360  -5.690
  353    HA   MET  43           HA       MET  43   5.362  -8.308  -3.693
  354   1HB   MET  43          1HB       MET  43   3.952 -10.972  -3.283
  355   2HB   MET  43          2HB       MET  43   4.679  -9.931  -2.076
  356   1HG   MET  43          1HG       MET  43   2.522  -9.274  -1.659
  357   2HG   MET  43          2HG       MET  43   2.739  -8.247  -3.063
  358   1HE   MET  43          1HE       MET  43  -0.112 -10.178  -1.790
  359   2HE   MET  43          2HE       MET  43   0.142  -8.548  -2.456
  360   3HE   MET  43          3HE       MET  43  -0.872  -9.719  -3.333
  361    H    SER  44           H        SER  44   7.361  -8.733  -4.540
  362    HA   SER  44           HA       SER  44   7.652 -11.256  -5.956
  363   1HB   SER  44          1HB       SER  44   8.507  -8.605  -6.543
  364   2HB   SER  44          2HB       SER  44   9.964  -9.497  -6.153
  365    HG   SER  44           HG       SER  44   9.638  -9.829  -8.344
  366    H    ARG  45           H        ARG  45   8.363 -12.861  -4.586
  367    HA   ARG  45           HA       ARG  45  10.194 -12.056  -2.491
  368   1HB   ARG  45          1HB       ARG  45   8.287 -14.367  -2.887
  369   2HB   ARG  45          2HB       ARG  45   9.683 -14.633  -1.862
  370   1HG   ARG  45          1HG       ARG  45   8.629 -13.575  -0.160
  371   2HG   ARG  45          2HG       ARG  45   8.610 -12.095  -1.098
  372   1HD   ARG  45          1HD       ARG  45   6.312 -12.856  -0.356
  373   2HD   ARG  45          2HD       ARG  45   6.455 -12.650  -2.091
  374    HE   ARG  45           HE       ARG  45   7.133 -15.347  -1.520
  375   1HH1  ARG  45          2HH2      ARG  45   4.290 -13.242  -1.314
  376   2HH1  ARG  45          1HH2      ARG  45   3.161 -14.539  -1.518
  377   1HH2  ARG  45          1HH       ARG  45   3.978 -16.776  -1.795
  378    H    ASP  46           H        ASP  46  10.258 -13.192  -5.646
  379    HA   ASP  46           HA       ASP  46  11.842 -15.363  -5.700
  380   1HB   ASP  46          1HB       ASP  46  11.667 -12.894  -7.441
  381   2HB   ASP  46          2HB       ASP  46  12.891 -14.094  -7.803
  382    HD2  ASP  46           HD       ASP  46  11.008 -13.615  -9.620
  383    H    LEU  47           H        LEU  47  12.570 -12.107  -4.596
  384    HA   LEU  47           HA       LEU  47  15.273 -12.941  -3.955
  385   1HB   LEU  47          1HB       LEU  47  14.593 -10.954  -6.008
  386   2HB   LEU  47          2HB       LEU  47  15.722 -10.375  -4.801
  387    HG   LEU  47           HG       LEU  47  16.359 -13.048  -5.886
  388   1HD1  LEU  47          1HD1      LEU  47  15.455 -11.236  -7.759
  389   2HD1  LEU  47          2HD1      LEU  47  17.218 -10.990  -7.779
  390   3HD1  LEU  47          3HD1      LEU  47  16.541 -12.611  -8.066
  391   1HD2  LEU  47          1HD2      LEU  47  18.607 -12.227  -5.827
  392   2HD2  LEU  47          2HD2      LEU  47  18.048 -10.549  -5.632
  393   3HD2  LEU  47          3HD2      LEU  47  17.795 -11.728  -4.324
  394    H    ALA  48           H        ALA  48  13.233  -9.928  -3.981
  395    HA   ALA  48           HA       ALA  48  12.379  -9.896  -1.445
  396   1HB   ALA  48          1HB       ALA  48  14.429  -8.276  -0.601
  397   2HB   ALA  48          2HB       ALA  48  14.270 -10.000  -0.191
  398   3HB   ALA  48          3HB       ALA  48  15.313  -9.500  -1.544
  399    H    TYR  49           H        TYR  49  11.197  -8.924  -3.533
  400    HA   TYR  49           HA       TYR  49  11.341  -6.043  -3.153
  401   1HB   TYR  49          1HB       TYR  49  11.158  -7.293  -5.936
  402   2HB   TYR  49          2HB       TYR  49  11.669  -5.668  -5.527
  403    HD1  TYR  49           HD1      TYR  49  13.850  -5.752  -3.807
  404    HD2  TYR  49           HD2      TYR  49  12.829  -8.638  -6.794
  405    HE1  TYR  49           HE1      TYR  49  16.279  -6.491  -3.933
  406    HE2  TYR  49           HE2      TYR  49  15.262  -9.368  -6.910
  407    HH   TYR  49           HH       TYR  49  17.439  -8.445  -6.446
  408    H    ALA  50           H        ALA  50   9.320  -5.167  -3.039
  409    HA   ALA  50           HA       ALA  50   7.144  -6.634  -4.331
  410   1HB   ALA  50          1HB       ALA  50   7.656  -6.422  -1.469
  411   2HB   ALA  50          2HB       ALA  50   6.095  -5.683  -1.901
  412   3HB   ALA  50          3HB       ALA  50   6.430  -7.380  -2.332
  413    H    LYS  51           H        LYS  51   5.220  -5.262  -4.688
  414    HA   LYS  51           HA       LYS  51   5.704  -2.414  -4.340
  415   1HB   LYS  51          1HB       LYS  51   4.677  -2.985  -7.011
  416   2HB   LYS  51          2HB       LYS  51   5.950  -1.896  -6.503
  417   1HG   LYS  51          1HG       LYS  51   7.507  -3.871  -6.273
  418   2HG   LYS  51          2HG       LYS  51   6.232  -4.918  -6.865
  419   1HD   LYS  51          1HD       LYS  51   6.668  -4.359  -9.023
  420   2HD   LYS  51          2HD       LYS  51   6.550  -2.648  -8.668
  421   1HE   LYS  51          1HE       LYS  51   9.005  -3.465  -7.498
  422   2HE   LYS  51          2HE       LYS  51   8.945  -4.294  -9.040
  423   1HZ   LYS  51          1HZ       LYS  51   9.432  -2.353 -10.024
  424   2HZ   LYS  51          2HZ       LYS  51   8.078  -1.657  -9.448
  425    H    VAL  52           H        VAL  52   3.970  -1.735  -3.207
  426    HA   VAL  52           HA       VAL  52   1.404  -3.022  -3.829
  427    HB   VAL  52           HB       VAL  52   2.536  -3.164  -1.502
  428   1HG1  VAL  52          1HG1      VAL  52   1.397  -0.350  -1.398
  429   2HG1  VAL  52          2HG1      VAL  52   1.943  -1.292   0.011
  430   3HG1  VAL  52          3HG1      VAL  52   3.109  -0.814  -1.245
  431   1HG2  VAL  52          1HG2      VAL  52   0.201  -3.846  -2.086
  432   2HG2  VAL  52          2HG2      VAL  52   0.382  -3.250  -0.419
  433   3HG2  VAL  52          3HG2      VAL  52  -0.338  -2.203  -1.664
  434    H    TYR  53           H        TYR  53  -0.087  -1.811  -4.875
  435    HA   TYR  53           HA       TYR  53   0.507   0.962  -5.362
  436   1HB   TYR  53          1HB       TYR  53  -0.759  -1.197  -6.642
  437   2HB   TYR  53          2HB       TYR  53  -2.139  -0.284  -6.064
  438    HD1  TYR  53           HD1      TYR  53   1.147   0.976  -7.342
  439    HD2  TYR  53           HD2      TYR  53  -3.072   0.675  -7.984
  440    HE1  TYR  53           HE1      TYR  53   1.333   2.533  -9.344
  441    HE2  TYR  53           HE2      TYR  53  -2.872   2.233  -9.984
  442    HH   TYR  53           HH       TYR  53   0.087   3.923 -10.661
  443    H    VAL  54           H        VAL  54  -0.883   2.754  -4.858
  444    HA   VAL  54           HA       VAL  54  -3.083   2.274  -3.055
  445    HB   VAL  54           HB       VAL  54  -2.228   3.549  -1.238
  446   1HG1  VAL  54          1HG1      VAL  54  -0.420   2.124  -0.431
  447   2HG1  VAL  54          2HG1      VAL  54  -1.633   1.150  -1.294
  448   3HG1  VAL  54          3HG1      VAL  54  -0.093   1.561  -2.087
  449   1HG2  VAL  54          1HG2      VAL  54  -0.936   5.228  -2.393
  450   2HG2  VAL  54          2HG2      VAL  54   0.120   4.409  -1.218
  451   3HG2  VAL  54          3HG2      VAL  54   0.236   4.010  -2.950
  452    H    THR  55           H        THR  55  -4.686   3.570  -3.774
  453    HA   THR  55           HA       THR  55  -3.874   6.051  -5.139
  454    HB   THR  55           HB       THR  55  -5.001   4.834  -6.788
  455    HG1  THR  55           HG1      THR  55  -6.738   6.205  -6.836
  456   1HG2  THR  55          1HG2      THR  55  -5.577   2.766  -5.737
  457   2HG2  THR  55          2HG2      THR  55  -6.499   3.582  -4.451
  458   3HG2  THR  55          3HG2      THR  55  -7.159   3.495  -6.102
  459    H    PHE  56           H        PHE  56  -4.502   7.984  -4.365
  460    HA   PHE  56           HA       PHE  56  -6.438   7.895  -2.157
  461   1HB   PHE  56          1HB       PHE  56  -4.198   9.932  -2.660
  462   2HB   PHE  56          2HB       PHE  56  -5.092   9.708  -1.170
  463    HD1  PHE  56           HD1      PHE  56  -4.938   6.656  -1.114
  464    HD2  PHE  56           HD2      PHE  56  -2.009   9.645  -1.812
  465    HE1  PHE  56           HE1      PHE  56  -3.153   5.102  -0.277
  466    HE2  PHE  56           HE2      PHE  56  -0.223   8.093  -0.975
  467    HZ   PHE  56           HZ       PHE  56  -0.817   5.839  -0.217
  468    H    LEU  57           H        LEU  57  -7.458  10.177  -1.786
  469    HA   LEU  57           HA       LEU  57  -8.161  11.222  -4.439
  470   1HB   LEU  57          1HB       LEU  57  -9.920  10.047  -3.068
  471   2HB   LEU  57          2HB       LEU  57  -9.795  11.353  -1.906
  472    HG   LEU  57           HG       LEU  57 -10.279  12.880  -3.998
  473   1HD1  LEU  57          1HD1      LEU  57 -10.655  10.205  -5.069
  474   2HD1  LEU  57          2HD1      LEU  57 -12.127  11.193  -5.215
  475   3HD1  LEU  57          3HD1      LEU  57 -10.593  11.776  -5.903
  476   1HD2  LEU  57          1HD2      LEU  57 -12.708  12.696  -3.527
  477   2HD2  LEU  57          2HD2      LEU  57 -12.381  11.229  -2.574
  478   3HD2  LEU  57          3HD2      LEU  57 -11.706  12.793  -2.059
  479    H    ASN  58           H        ASN  58  -5.764  11.923  -2.796
  480    HA   ASN  58           HA       ASN  58  -6.307  14.361  -1.528
  481   1HB   ASN  58          1HB       ASN  58  -3.954  12.700  -2.199
  482   2HB   ASN  58          2HB       ASN  58  -3.595  14.411  -2.326
  483   1HD2  ASN  58          1HD2      ASN  58  -5.205  15.520  -0.427
  484   2HD2  ASN  58          2HD2      ASN  58  -4.739  15.008   1.161
  485    H    ASP  59           H        ASP  59  -5.591  13.293  -4.842
  486    HA   ASP  59           HA       ASP  59  -4.473  15.322  -6.072
  487   1HB   ASP  59          1HB       ASP  59  -5.193  13.547  -7.449
  488   2HB   ASP  59          2HB       ASP  59  -6.830  13.591  -6.825
  489    HD2  ASP  59           HD       ASP  59  -7.958  15.266  -9.460
  490    H    LYS  60           H        LYS  60  -7.919  15.142  -4.978
  491    HA   LYS  60           HA       LYS  60  -9.075  17.267  -6.087
  492   1HB   LYS  60          1HB       LYS  60  -9.274  15.954  -3.437
  493   2HB   LYS  60          2HB       LYS  60  -9.979  17.554  -3.538
  494   1HG   LYS  60          1HG       LYS  60 -10.882  16.435  -5.901
  495   2HG   LYS  60          2HG       LYS  60 -10.829  15.024  -4.862
  496   1HD   LYS  60          1HD       LYS  60 -11.968  17.191  -3.336
  497   2HD   LYS  60          2HD       LYS  60 -12.778  17.153  -4.890
  498   1HE   LYS  60          1HE       LYS  60 -13.154  14.660  -4.567
  499   2HE   LYS  60          2HE       LYS  60 -12.467  14.801  -2.962
  500   1HZ   LYS  60          1HZ       LYS  60 -14.740  15.084  -2.599
  501   2HZ   LYS  60          2HZ       LYS  60 -14.256  16.636  -2.670
  502    H    ASP  61           H        ASP  61  -6.669  17.369  -3.403
  503    HA   ASP  61           HA       ASP  61  -6.438  20.215  -3.985
  504   1HB   ASP  61          1HB       ASP  61  -5.655  19.215  -1.270
  505   2HB   ASP  61          2HB       ASP  61  -6.350  20.759  -1.725
  506    HD2  ASP  61           HD       ASP  61  -8.489  20.911  -0.969
  507    H    GLU  62           H        GLU  62  -4.384  20.601  -4.826
  508    HA   GLU  62           HA       GLU  62  -2.429  18.608  -4.785
  509   1HB   GLU  62          1HB       GLU  62  -2.842  20.596  -6.454
  510   2HB   GLU  62          2HB       GLU  62  -1.846  21.529  -5.355
  511   1HG   GLU  62          1HG       GLU  62  -0.034  19.782  -5.567
  512   2HG   GLU  62          2HG       GLU  62  -1.026  18.928  -6.734
  513    HE2  GLU  62           HE       GLU  62   0.428  20.105  -9.050
  514    H    ASP  63           H        ASP  63  -3.336  21.087  -2.517
  515    HA   ASP  63           HA       ASP  63  -0.801  21.489  -1.391
  516   1HB   ASP  63          1HB       ASP  63  -3.384  22.552  -1.090
  517   2HB   ASP  63          2HB       ASP  63  -3.100  21.762   0.449
  518    HD2  ASP  63           HD       ASP  63  -0.619  23.880   1.454
  519    H    ALA  64           H        ALA  64  -3.651  19.366  -0.697
  520    HA   ALA  64           HA       ALA  64  -2.391  18.189   1.600
  521   1HB   ALA  64          1HB       ALA  64  -4.433  16.850   1.690
  522   2HB   ALA  64          2HB       ALA  64  -4.852  18.555   1.393
  523   3HB   ALA  64          3HB       ALA  64  -4.888  17.382   0.056
  524    H    VAL  65           H        VAL  65  -2.359  17.767  -1.859
  525    HA   VAL  65           HA       VAL  65  -1.776  14.973  -1.811
  526    HB   VAL  65           HB       VAL  65  -2.607  16.810  -3.676
  527   1HG1  VAL  65          1HG1      VAL  65  -0.958  16.983  -5.411
  528   2HG1  VAL  65          2HG1      VAL  65  -0.223  17.577  -3.902
  529   3HG1  VAL  65          3HG1      VAL  65   0.180  15.953  -4.510
  530   1HG2  VAL  65          1HG2      VAL  65  -3.306  14.829  -4.432
  531   2HG2  VAL  65          2HG2      VAL  65  -1.695  14.593  -5.150
  532   3HG2  VAL  65          3HG2      VAL  65  -2.041  13.974  -3.518
  533    H    LYS  66           H        LYS  66   0.079  18.051  -1.882
  534    HA   LYS  66           HA       LYS  66   2.577  16.698  -2.199
  535   1HB   LYS  66          1HB       LYS  66   1.609  19.331  -2.468
  536   2HB   LYS  66          2HB       LYS  66   2.780  19.398  -1.165
  537   1HG   LYS  66          1HG       LYS  66   4.186  19.659  -3.012
  538   2HG   LYS  66          2HG       LYS  66   4.274  17.922  -2.788
  539   1HD   LYS  66          1HD       LYS  66   3.560  17.682  -4.927
  540   2HD   LYS  66          2HD       LYS  66   1.996  18.283  -4.416
  541   1HE   LYS  66          1HE       LYS  66   2.337  20.362  -5.348
  542   2HE   LYS  66          2HE       LYS  66   4.022  20.416  -4.872
  543   1HZ   LYS  66          1HZ       LYS  66   4.409  18.727  -6.700
  544   2HZ   LYS  66          2HZ       LYS  66   2.891  19.006  -7.218
  545    H    ALA  67           H        ALA  67   0.879  18.400   0.520
  546    HA   ALA  67           HA       ALA  67   2.856  17.759   2.415
  547   1HB   ALA  67          1HB       ALA  67   1.603  19.181   3.625
  548   2HB   ALA  67          2HB       ALA  67   0.468  19.269   2.257
  549   3HB   ALA  67          3HB       ALA  67   0.206  18.080   3.554
  550    H    GLY  68           H        GLY  68  -0.323  16.249   1.542
  551   1HA   GLY  68          1HA       GLY  68  -0.350  14.237   3.449
  552   2HA   GLY  68          2HA       GLY  68  -1.109  14.171   1.871
  553    H    ILE  69           H        ILE  69   0.716  13.951  -0.024
  554    HA   ILE  69           HA       ILE  69   1.710  11.391   0.202
  555    HB   ILE  69           HB       ILE  69   1.248  12.857  -1.846
  556   1HG1  ILE  69          1HG1      ILE  69   3.775  11.451  -2.400
  557   2HG1  ILE  69          2HG1      ILE  69   2.625  10.503  -1.478
  558   1HG2  ILE  69          1HG2      ILE  69   2.816  14.677  -1.149
  559   2HG2  ILE  69          2HG2      ILE  69   4.169  13.573  -1.494
  560   3HG2  ILE  69          3HG2      ILE  69   3.071  14.073  -2.803
  561   1HD1  ILE  69          1HD1      ILE  69   2.505  10.492  -4.114
  562   2HD1  ILE  69          2HD1      ILE  69   0.996  10.559  -3.172
  563   3HD1  ILE  69          3HD1      ILE  69   1.660  12.043  -3.896
  564    H    LYS  70           H        LYS  70   3.140  14.530   1.106
  565    HA   LYS  70           HA       LYS  70   5.774  13.610   1.383
  566   1HB   LYS  70          1HB       LYS  70   5.316  15.955   1.184
  567   2HB   LYS  70          2HB       LYS  70   4.271  15.943   2.590
  568   1HG   LYS  70          1HG       LYS  70   6.800  14.832   3.400
  569   2HG   LYS  70          2HG       LYS  70   7.142  16.286   2.484
  570   1HD   LYS  70          1HD       LYS  70   4.966  17.026   4.111
  571   2HD   LYS  70          2HD       LYS  70   5.930  16.002   5.156
  572   1HE   LYS  70          1HE       LYS  70   7.301  17.779   5.510
  573   2HE   LYS  70          2HE       LYS  70   7.835  17.628   3.847
  574   1HZ   LYS  70          1HZ       LYS  70   6.393  19.731   4.921
  575   2HZ   LYS  70          2HZ       LYS  70   6.744  19.512   3.345
  576    H    ALA  71           H        ALA  71   2.890  13.514   3.487
  577    HA   ALA  71           HA       ALA  71   4.335  12.739   5.807
  578   1HB   ALA  71          1HB       ALA  71   1.424  12.742   4.962
  579   2HB   ALA  71          2HB       ALA  71   1.943  12.081   6.530
  580   3HB   ALA  71          3HB       ALA  71   2.239  13.794   6.145
  581    H    LEU  72           H        LEU  72   2.638  11.049   3.122
  582    HA   LEU  72           HA       LEU  72   2.942   8.485   4.313
  583   1HB   LEU  72          1HB       LEU  72   1.510   9.624   2.199
  584   2HB   LEU  72          2HB       LEU  72   2.604   8.487   1.435
  585    HG   LEU  72           HG       LEU  72   1.229   7.397   3.800
  586   1HD1  LEU  72          1HD1      LEU  72  -0.721   7.227   1.739
  587   2HD1  LEU  72          2HD1      LEU  72  -0.867   7.961   3.355
  588   3HD1  LEU  72          3HD1      LEU  72  -0.326   8.946   1.973
  589   1HD2  LEU  72          1HD2      LEU  72   0.936   6.127   1.154
  590   2HD2  LEU  72          2HD2      LEU  72   2.613   6.370   1.696
  591   3HD2  LEU  72          3HD2      LEU  72   1.475   5.449   2.708
  592    H    GLN  73           H        GLN  73   5.032  10.686   2.623
  593    HA   GLN  73           HA       GLN  73   6.698   8.659   1.539
  594   1HB   GLN  73          1HB       GLN  73   6.343  11.386   1.100
  595   2HB   GLN  73          2HB       GLN  73   7.894  11.338   1.915
  596   1HG   GLN  73          1HG       GLN  73   7.780   9.191  -0.045
  597   2HG   GLN  73          2HG       GLN  73   7.334  10.699  -0.817
  598   1HE2  GLN  73          1HE2      GLN  73   8.985  11.575  -1.786
  599   2HE2  GLN  73          2HE2      GLN  73  10.612  11.690  -1.204
  600    H    GLU  74           H        GLU  74   6.827  10.931   4.357
  601    HA   GLU  74           HA       GLU  74   9.324   9.998   5.220
  602   1HB   GLU  74          1HB       GLU  74   8.773  11.244   7.318
  603   2HB   GLU  74          2HB       GLU  74   8.520  12.203   5.873
  604   1HG   GLU  74          1HG       GLU  74   6.232  12.276   6.150
  605   2HG   GLU  74          2HG       GLU  74   6.141  10.631   6.746
  606    HE2  GLU  74           HE       GLU  74   5.623  13.425   9.164
  607    H    ALA  75           H        ALA  75   5.970   8.940   5.690
  608    HA   ALA  75           HA       ALA  75   6.752   7.145   7.838
  609   1HB   ALA  75          1HB       ALA  75   4.465   6.919   8.246
  610   2HB   ALA  75          2HB       ALA  75   4.561   8.584   7.622
  611   3HB   ALA  75          3HB       ALA  75   4.024   7.263   6.556
  612    H    SER  76           H        SER  76   7.661   7.032   4.863
  613    HA   SER  76           HA       SER  76   6.395   4.860   3.700
  614   1HB   SER  76          1HB       SER  76   7.717   6.134   2.237
  615   2HB   SER  76          2HB       SER  76   9.061   6.224   3.356
  616    HG   SER  76           HG       SER  76   8.327   3.644   2.384
  617    H    GLY  77           H        GLY  77   9.804   4.858   4.966
  618   1HA   GLY  77          1HA       GLY  77  10.121   2.145   5.190
  619   2HA   GLY  77          2HA       GLY  77  10.946   3.339   6.172
  620    H    PHE  78           H        PHE  78   8.072   4.257   7.100
  621    HA   PHE  78           HA       PHE  78   8.093   2.643   9.443
  622   1HB   PHE  78          1HB       PHE  78   6.936   5.122   8.352
  623   2HB   PHE  78          2HB       PHE  78   5.682   4.203   9.163
  624    HD1  PHE  78           HD1      PHE  78   6.953   3.034  11.454
  625    HD2  PHE  78           HD2      PHE  78   7.621   6.846   9.713
  626    HE1  PHE  78           HE1      PHE  78   7.748   3.908  13.669
  627    HE2  PHE  78           HE2      PHE  78   8.415   7.720  11.929
  628    HZ   PHE  78           HZ       PHE  78   8.468   6.239  13.881
  629    H    ILE  79           H        ILE  79   5.914   3.034   6.582
  630    HA   ILE  79           HA       ILE  79   3.988   1.207   7.556
  631    HB   ILE  79           HB       ILE  79   3.225   1.266   5.151
  632   1HG1  ILE  79          1HG1      ILE  79   5.259   3.474   4.812
  633   2HG1  ILE  79          2HG1      ILE  79   5.595   1.826   4.320
  634   1HG2  ILE  79          1HG2      ILE  79   3.531   3.779   6.801
  635   2HG2  ILE  79          2HG2      ILE  79   2.552   3.706   5.317
  636   3HG2  ILE  79          3HG2      ILE  79   2.139   2.673   6.707
  637   1HD1  ILE  79          1HD1      ILE  79   3.126   2.147   3.186
  638   2HD1  ILE  79          2HD1      ILE  79   3.727   3.821   3.124
  639   3HD1  ILE  79          3HD1      ILE  79   4.649   2.513   2.344
  640    H    ARG  80           H        ARG  80   6.944   0.956   5.545
  641    HA   ARG  80           HA       ARG  80   6.448  -1.648   4.706
  642   1HB   ARG  80          1HB       ARG  80   8.097  -0.402   3.496
  643   2HB   ARG  80          2HB       ARG  80   8.948   0.066   4.955
  644   1HG   ARG  80          1HG       ARG  80   9.908  -2.099   5.244
  645   2HG   ARG  80          2HG       ARG  80   8.730  -2.865   4.197
  646   1HD   ARG  80          1HD       ARG  80   9.854  -2.271   2.258
  647   2HD   ARG  80          2HD       ARG  80  10.384  -0.731   2.906
  648    HE   ARG  80           HE       ARG  80  11.864  -3.211   2.977
  649   1HH1  ARG  80          2HH2      ARG  80  11.275  -0.275   4.870
  650   2HH1  ARG  80          1HH2      ARG  80  12.799  -0.348   5.690
  651   1HH2  ARG  80          1HH       ARG  80  14.311  -2.141   5.197
  652    H    SER  81           H        SER  81   8.300  -0.237   7.479
  653    HA   SER  81           HA       SER  81   9.201  -2.734   8.392
  654   1HB   SER  81          1HB       SER  81  10.127  -0.350   8.879
  655   2HB   SER  81          2HB       SER  81   8.878  -0.242  10.103
  656    HG   SER  81           HG       SER  81  10.687  -2.485  10.019
  657    H    LEU  82           H        LEU  82   6.321  -0.694   8.964
  658    HA   LEU  82           HA       LEU  82   5.430  -2.013  11.279
  659   1HB   LEU  82          1HB       LEU  82   4.740   0.239  10.474
  660   2HB   LEU  82          2HB       LEU  82   3.825  -0.531   9.193
  661    HG   LEU  82           HG       LEU  82   3.329  -0.871  12.163
  662   1HD1  LEU  82          1HD1      LEU  82   1.484   0.563  11.965
  663   2HD1  LEU  82          2HD1      LEU  82   2.795   1.383  11.082
  664   3HD1  LEU  82          3HD1      LEU  82   1.524   0.518  10.187
  665   1HD2  LEU  82          1HD2      LEU  82   1.081  -1.783  10.971
  666   2HD2  LEU  82          2HD2      LEU  82   2.302  -2.295   9.783
  667   3HD2  LEU  82          3HD2      LEU  82   2.434  -2.821  11.478
  668    H    LEU  83           H        LEU  83   5.062  -2.631   7.769
  669    HA   LEU  83           HA       LEU  83   3.073  -4.606   8.063
  670   1HB   LEU  83          1HB       LEU  83   5.061  -4.039   5.861
  671   2HB   LEU  83          2HB       LEU  83   3.771  -5.219   5.742
  672    HG   LEU  83           HG       LEU  83   3.007  -2.431   6.488
  673   1HD1  LEU  83          1HD1      LEU  83   3.479  -1.415   4.538
  674   2HD1  LEU  83          2HD1      LEU  83   4.751  -2.654   4.424
  675   3HD1  LEU  83          3HD1      LEU  83   3.203  -2.885   3.576
  676   1HD2  LEU  83          1HD2      LEU  83   1.789  -4.670   4.868
  677   2HD2  LEU  83          2HD2      LEU  83   1.220  -3.966   6.400
  678   3HD2  LEU  83          3HD2      LEU  83   1.116  -3.023   4.894
  679    H    GLY  84           H        GLY  84   6.606  -4.957   7.259
  680   1HA   GLY  84          1HA       GLY  84   6.908  -7.622   7.431
  681   2HA   GLY  84          2HA       GLY  84   8.105  -6.478   8.007
  682    H    LYS  85           H        LYS  85   7.049  -5.349  10.274
  683    HA   LYS  85           HA       LYS  85   7.321  -7.451  12.137
  684   1HB   LYS  85          1HB       LYS  85   7.016  -4.511  12.176
  685   2HB   LYS  85          2HB       LYS  85   6.388  -5.331  13.589
  686   1HG   LYS  85          1HG       LYS  85   8.584  -6.564  13.808
  687   2HG   LYS  85          2HG       LYS  85   9.204  -5.651  12.447
  688   1HD   LYS  85          1HD       LYS  85   8.110  -4.333  14.974
  689   2HD   LYS  85          2HD       LYS  85   9.804  -4.725  14.758
  690   1HE   LYS  85          1HE       LYS  85   9.542  -3.378  12.479
  691   2HE   LYS  85          2HE       LYS  85   8.128  -2.695  13.257
  692   1HZ   LYS  85          1HZ       LYS  85  10.452  -1.594  13.603
  693   2HZ   LYS  85          2HZ       LYS  85   9.431  -1.679  14.870
  694    H    ALA  86           H        ALA  86   4.540  -5.624  10.783
  695    HA   ALA  86           HA       ALA  86   2.608  -6.567  12.548
  696   1HB   ALA  86          1HB       ALA  86   2.561  -5.605   9.673
  697   2HB   ALA  86          2HB       ALA  86   1.075  -6.064  10.540
  698   3HB   ALA  86          3HB       ALA  86   2.082  -4.726  11.145
  699    H    MET  87           H        MET  87   4.191  -8.030   9.705
  700    HA   MET  87           HA       MET  87   2.464 -10.349  10.087
  701   1HB   MET  87          1HB       MET  87   3.002 -10.916   7.746
  702   2HB   MET  87          2HB       MET  87   2.478  -9.243   7.802
  703   1HG   MET  87          1HG       MET  87   4.708  -8.406   7.561
  704   2HG   MET  87          2HG       MET  87   5.431  -9.935   8.025
  705   1HE   MET  87          1HE       MET  87   4.263  -8.530   3.919
  706   2HE   MET  87          2HE       MET  87   3.023  -8.345   5.182
  707   3HE   MET  87          3HE       MET  87   4.636  -7.627   5.407
  708    H    ARG  88           H        ARG  88   5.175  -9.323  11.390
  709    HA   ARG  88           HA       ARG  88   7.269 -10.105  11.626
  710   1HB   ARG  88          1HB       ARG  88   5.173 -11.734  12.931
  711   2HB   ARG  88          2HB       ARG  88   6.691 -12.600  12.797
  712   1HG   ARG  88          1HG       ARG  88   7.820 -10.468  13.754
  713   2HG   ARG  88          2HG       ARG  88   6.204  -9.912  14.145
  714   1HD   ARG  88          1HD       ARG  88   6.000 -11.363  15.910
  715   2HD   ARG  88          2HD       ARG  88   6.689 -12.701  15.013
  716    HE   ARG  88           HE       ARG  88   8.818 -10.908  15.531
  717   1HH1  ARG  88          2HH2      ARG  88   6.592 -12.932  17.402
  718   2HH1  ARG  88          1HH2      ARG  88   7.700 -13.156  18.714
  719   1HH2  ARG  88          1HH       ARG  88   9.864 -12.131  18.608
  720    H    LEU  89           H        LEU  89   7.760 -10.434   9.245
  721    HA   LEU  89           HA       LEU  89   7.848 -13.294   8.580
  722   1HB   LEU  89          1HB       LEU  89   6.673 -11.235   7.183
  723   2HB   LEU  89          2HB       LEU  89   8.235 -11.374   6.402
  724    HG   LEU  89           HG       LEU  89   7.797 -13.812   6.051
  725   1HD1  LEU  89          1HD1      LEU  89   6.268 -14.485   7.655
  726   2HD1  LEU  89          2HD1      LEU  89   5.202 -13.087   7.381
  727   3HD1  LEU  89          3HD1      LEU  89   5.271 -14.402   6.183
  728   1HD2  LEU  89          1HD2      LEU  89   7.206 -11.817   4.453
  729   2HD2  LEU  89          2HD2      LEU  89   6.672 -13.472   4.074
  730   3HD2  LEU  89          3HD2      LEU  89   5.529 -12.311   4.790
  731    H    ARG  90           H        ARG  90   9.727 -12.650   6.327
  732    HA   ARG  90           HA       ARG  90  12.028 -11.720   7.785
  733   1HB   ARG  90          1HB       ARG  90  13.355 -13.756   6.966
  734   2HB   ARG  90          2HB       ARG  90  12.204 -14.084   8.246
  735   1HG   ARG  90          1HG       ARG  90  10.517 -14.744   6.433
  736   2HG   ARG  90          2HG       ARG  90  11.816 -14.613   5.264
  737   1HD   ARG  90          1HD       ARG  90  13.143 -16.296   6.633
  738   2HD   ARG  90          2HD       ARG  90  11.747 -16.491   7.676
  739    HE   ARG  90           HE       ARG  90  10.706 -16.907   5.140
  740   1HH1  ARG  90          2HH2      ARG  90  13.401 -18.336   6.943
  741   2HH1  ARG  90          1HH2      ARG  90  13.281 -19.870   6.150
  742   1HH2  ARG  90          1HH       ARG  90  11.596 -20.198   4.477
  743    H    ILE  91           H        ILE  91  10.636 -13.083   4.734
  744    HA   ILE  91           HA       ILE  91  12.511 -12.496   2.913
  745    HB   ILE  91           HB       ILE  91  10.516 -11.913   1.400
  746   1HG1  ILE  91          1HG1      ILE  91   8.714 -13.095   3.427
  747   2HG1  ILE  91          2HG1      ILE  91   9.210 -11.446   3.752
  748   1HG2  ILE  91          1HG2      ILE  91  11.545 -14.336   2.442
  749   2HG2  ILE  91          2HG2      ILE  91   9.777 -14.516   2.347
  750   3HG2  ILE  91          3HG2      ILE  91  10.705 -14.063   0.898
  751   1HD1  ILE  91          1HD1      ILE  91   7.150 -12.181   2.050
  752   2HD1  ILE  91          2HD1      ILE  91   7.980 -10.607   2.024
  753   3HD1  ILE  91          3HD1      ILE  91   8.493 -11.902   0.915
  754    H    VAL  92           H        VAL  92  10.606 -10.197   4.820
  755    HA   VAL  92           HA       VAL  92  10.347  -7.940   4.461
  756    HB   VAL  92           HB       VAL  92  13.292  -8.337   5.022
  757   1HG1  VAL  92          1HG1      VAL  92  11.801  -6.111   6.286
  758   2HG1  VAL  92          2HG1      VAL  92  13.450  -6.160   5.616
  759   3HG1  VAL  92          3HG1      VAL  92  12.053  -5.966   4.530
  760   1HG2  VAL  92          1HG2      VAL  92  11.556  -9.621   6.451
  761   2HG2  VAL  92          2HG2      VAL  92  12.792  -8.648   7.287
  762   3HG2  VAL  92          3HG2      VAL  92  11.134  -8.021   7.109
  763    HA   PRO  93           HA       PRO  93  12.046  -7.745   0.224
  764   1HB   PRO  93          1HB       PRO  93   9.702  -7.790  -1.182
  765   2HB   PRO  93          2HB       PRO  93  10.678  -9.217  -0.900
  766   1HG   PRO  93          1HG       PRO  93   8.135  -8.428   0.385
  767   2HG   PRO  93          2HG       PRO  93   8.894 -10.007   0.331
  768   1HD   PRO  93          1HD       PRO  93   8.856  -8.198   2.555
  769   2HD   PRO  93          2HD       PRO  93   9.711  -9.725   2.461
  770    H    GLU  94           H        GLU  94  12.016  -6.002  -1.355
  771    HA   GLU  94           HA       GLU  94  11.566  -3.606   0.020
  772   1HB   GLU  94          1HB       GLU  94  13.104  -4.360  -2.117
  773   2HB   GLU  94          2HB       GLU  94  11.813  -3.521  -2.953
  774   1HG   GLU  94          1HG       GLU  94  12.199  -1.480  -1.705
  775   2HG   GLU  94          2HG       GLU  94  13.247  -2.295  -0.561
  776    HE2  GLU  94           HE       GLU  94  13.683  -0.140  -2.677
  777    H    LEU  95           H        LEU  95   9.164  -4.490   0.444
  778    HA   LEU  95           HA       LEU  95   7.328  -4.159  -1.685
  779   1HB   LEU  95          1HB       LEU  95   5.657  -4.220   0.197
  780   2HB   LEU  95          2HB       LEU  95   6.690  -5.622   0.002
  781    HG   LEU  95           HG       LEU  95   7.863  -3.727   1.867
  782   1HD1  LEU  95          1HD1      LEU  95   5.269  -4.885   2.860
  783   2HD1  LEU  95          2HD1      LEU  95   6.278  -3.597   3.560
  784   3HD1  LEU  95          3HD1      LEU  95   5.325  -3.280   2.091
  785   1HD2  LEU  95          1HD2      LEU  95   6.917  -6.361   2.813
  786   2HD2  LEU  95          2HD2      LEU  95   8.004  -6.396   1.404
  787   3HD2  LEU  95          3HD2      LEU  95   8.525  -5.605   2.912
  788    H    THR  96           H        THR  96   7.758  -2.126  -2.661
  789    HA   THR  96           HA       THR  96   7.657   0.245  -1.022
  790    HB   THR  96           HB       THR  96   9.058  -0.293  -3.206
  791    HG1  THR  96           HG1      THR  96   9.223   1.829  -2.539
  792   1HG2  THR  96          1HG2      THR  96   6.871  -0.762  -4.546
  793   2HG2  THR  96          2HG2      THR  96   6.578   0.990  -4.438
  794   3HG2  THR  96          3HG2      THR  96   8.027   0.379  -5.274
  795    H    PHE  97           H        PHE  97   6.170   2.091  -1.679
  796    HA   PHE  97           HA       PHE  97   3.519   0.981  -2.275
  797   1HB   PHE  97          1HB       PHE  97   2.664   2.521  -0.544
  798   2HB   PHE  97          2HB       PHE  97   3.977   1.605   0.170
  799    HD1  PHE  97           HD1      PHE  97   2.683   4.837  -0.400
  800    HD2  PHE  97           HD2      PHE  97   6.334   2.728   0.074
  801    HE1  PHE  97           HE1      PHE  97   3.836   6.975   0.225
  802    HE2  PHE  97           HE2      PHE  97   7.488   4.867   0.700
  803    HZ   PHE  97           HZ       PHE  97   6.225   6.966   0.769
  804    H    PHE  98           H        PHE  98   2.975   1.720  -4.282
  805    HA   PHE  98           HA       PHE  98   3.962   4.311  -5.113
  806   1HB   PHE  98          1HB       PHE  98   3.002   1.759  -6.251
  807   2HB   PHE  98          2HB       PHE  98   2.173   3.103  -7.011
  808    HD1  PHE  98           HD1      PHE  98   5.531   1.712  -6.303
  809    HD2  PHE  98           HD2      PHE  98   3.255   4.436  -8.629
  810    HE1  PHE  98           HE1      PHE  98   7.510   2.089  -7.799
  811    HE2  PHE  98           HE2      PHE  98   5.235   4.814 -10.123
  812    HZ   PHE  98           HZ       PHE  98   7.340   3.636  -9.691
  813    H    TYR  99           H        TYR  99   2.813   6.121  -4.637
  814    HA   TYR  99           HA       TYR  99  -0.004   5.870  -4.029
  815   1HB   TYR  99          1HB       TYR  99   0.825   8.578  -4.048
  816   2HB   TYR  99          2HB       TYR  99   0.823   7.542  -2.635
  817    HD1  TYR  99           HD1      TYR  99   2.977   8.429  -5.573
  818    HD2  TYR  99           HD2      TYR  99   2.820   7.171  -1.486
  819    HE1  TYR  99           HE1      TYR  99   5.505   8.647  -5.400
  820    HE2  TYR  99           HE2      TYR  99   5.348   7.393  -1.328
  821    HH   TYR  99           HH       TYR  99   7.226   7.496  -2.599
  822    H    ASP 100           H        ASP 100  -1.254   5.597  -5.862
  823    HA   ASP 100           HA       ASP 100  -0.680   7.393  -8.067
  824   1HB   ASP 100          1HB       ASP 100  -1.313   4.680  -7.987
  825   2HB   ASP 100          2HB       ASP 100  -2.862   5.401  -8.370
  826    HD2  ASP 100           HD       ASP 100   0.093   5.899 -11.048
  827    H    ASN 101           H        ASN 101  -1.706   9.339  -7.284
  828    HA   ASN 101           HA       ASN 101  -4.419   9.096  -6.351
  829   1HB   ASN 101          1HB       ASN 101  -3.108  11.780  -6.756
  830   2HB   ASN 101          2HB       ASN 101  -4.130  11.241  -5.439
  831   1HD2  ASN 101          1HD2      ASN 101  -3.161   9.312  -4.188
  832   2HD2  ASN 101          2HD2      ASN 101  -1.509   9.470  -3.695
  833    H    SER 102           H        SER 102  -5.635  11.432  -7.240
  834    HA   SER 102           HA       SER 102  -5.933  10.852 -10.029
  835   1HB   SER 102          1HB       SER 102  -7.528  13.106  -9.221
  836   2HB   SER 102          2HB       SER 102  -8.060  11.484  -9.619
  837    HG   SER 102           HG       SER 102  -8.705  11.929  -7.483
  838    H    LEU 103           H        LEU 103  -3.550  12.385  -8.599
  839    HA   LEU 103           HA       LEU 103  -3.724  14.894 -10.072
  840   1HB   LEU 103          1HB       LEU 103  -3.103  14.862  -7.670
  841   2HB   LEU 103          2HB       LEU 103  -1.669  13.940  -8.074
  842    HG   LEU 103           HG       LEU 103  -1.406  16.090  -9.754
  843   1HD1  LEU 103          1HD1      LEU 103  -3.481  17.000  -8.434
  844   2HD1  LEU 103          2HD1      LEU 103  -2.264  17.399  -7.198
  845   3HD1  LEU 103          3HD1      LEU 103  -2.120  18.074  -8.838
  846   1HD2  LEU 103          1HD2      LEU 103   0.468  15.379  -8.590
  847   2HD2  LEU 103          2HD2      LEU 103   0.140  16.970  -7.865
  848   3HD2  LEU 103          3HD2      LEU 103  -0.340  15.486  -7.008
  849    H    VAL 104           H        VAL 104  -2.965  11.757 -10.755
  850    HA   VAL 104           HA       VAL 104  -1.069  12.620 -12.797
  851    HB   VAL 104           HB       VAL 104  -0.647  10.451 -10.753
  852   1HG1  VAL 104          1HG1      VAL 104  -0.099   9.178 -12.585
  853   2HG1  VAL 104          2HG1      VAL 104   0.337  10.590 -13.578
  854   3HG1  VAL 104          3HG1      VAL 104   1.452  10.011 -12.316
  855   1HG2  VAL 104          1HG2      VAL 104   0.322  12.501 -10.072
  856   2HG2  VAL 104          2HG2      VAL 104   1.662  11.537 -10.737
  857   3HG2  VAL 104          3HG2      VAL 104   0.942  12.845 -11.703
  858    H    GLU 105           H        GLU 105  -4.032  11.516 -12.129
  859    HA   GLU 105           HA       GLU 105  -4.098  10.027 -14.588
  860   1HB   GLU 105          1HB       GLU 105  -5.555   8.778 -12.262
  861   2HB   GLU 105          2HB       GLU 105  -4.994   8.032 -13.744
  862   1HG   GLU 105          1HG       GLU 105  -3.038   9.139 -11.690
  863   2HG   GLU 105          2HG       GLU 105  -3.682   7.515 -11.552
  864    HE2  GLU 105           HE       GLU 105  -1.480   7.048 -11.819
  865    H    GLY 106           H        GLY 106  -5.741  11.576 -11.805
  866   1HA   GLY 106          1HA       GLY 106  -7.444  13.111 -11.948
  867   2HA   GLY 106          2HA       GLY 106  -7.736  12.666 -13.617
  868    H    MET 107           H        MET 107  -7.920   9.781 -13.261
  869    HA   MET 107           HA       MET 107 -10.585   9.737 -12.194
  870   1HB   MET 107          1HB       MET 107 -10.746   7.595 -13.348
  871   2HB   MET 107          2HB       MET 107  -9.849   8.660 -14.412
  872   1HG   MET 107          1HG       MET 107  -7.830   7.538 -12.830
  873   2HG   MET 107          2HG       MET 107  -8.951   6.205 -13.019
  874   1HE   MET 107          1HE       MET 107  -7.146   8.931 -15.971
  875   2HE   MET 107          2HE       MET 107  -6.741   8.690 -14.254
  876   3HE   MET 107          3HE       MET 107  -5.872   7.776 -15.511
  877    H    ARG 108           H        ARG 108  -7.912   9.840 -10.543
  878    HA   ARG 108           HA       ARG 108  -8.512   7.474  -8.955
  879   1HB   ARG 108          1HB       ARG 108  -5.929   9.022  -9.404
  880   2HB   ARG 108          2HB       ARG 108  -6.116   7.999  -7.994
  881   1HG   ARG 108          1HG       ARG 108  -6.060   7.202 -10.914
  882   2HG   ARG 108          2HG       ARG 108  -5.124   6.551  -9.583
  883   1HD   ARG 108          1HD       ARG 108  -7.470   5.780  -8.631
  884   2HD   ARG 108          2HD       ARG 108  -8.036   6.031 -10.271
  885    HE   ARG 108           HE       ARG 108  -6.410   3.834  -9.354
  886   1HH1  ARG 108          2HH2      ARG 108  -6.859   5.952 -12.159
  887   2HH1  ARG 108          1HH2      ARG 108  -6.243   4.793 -13.289
  888   1HH2  ARG 108          1HH       ARG 108  -5.508   2.655 -12.495
  Start of MODEL   16
    1    H    MET   1           H        MET   1 -14.082 -12.444  -3.654
    2    HA   MET   1           HA       MET   1 -14.091  -9.739  -3.331
    3   1HB   MET   1          1HB       MET   1 -14.788 -11.317  -0.839
    4   2HB   MET   1          2HB       MET   1 -13.712  -9.947  -0.644
    5   1HG   MET   1          1HG       MET   1 -15.681  -8.847  -2.253
    6   2HG   MET   1          2HG       MET   1 -16.617  -9.990  -1.310
    7   1HE   MET   1          1HE       MET   1 -16.742  -8.650   2.155
    8   2HE   MET   1          2HE       MET   1 -17.686  -9.289   0.790
    9   3HE   MET   1          3HE       MET   1 -16.272 -10.187   1.391
   10    H    ALA   2           H        ALA   2 -12.827 -12.915  -2.295
   11    HA   ALA   2           HA       ALA   2 -10.123 -11.791  -2.542
   12   1HB   ALA   2          1HB       ALA   2 -11.366 -13.487  -0.397
   13   2HB   ALA   2          2HB       ALA   2  -9.663 -13.780  -0.825
   14   3HB   ALA   2          3HB       ALA   2 -10.173 -12.171  -0.261
   15    H    LYS   3           H        LYS   3  -8.656 -14.130  -2.474
   16    HA   LYS   3           HA       LYS   3  -9.889 -15.834  -4.507
   17   1HB   LYS   3          1HB       LYS   3  -8.498 -14.134  -5.650
   18   2HB   LYS   3          2HB       LYS   3  -7.110 -14.637  -4.709
   19   1HG   LYS   3          1HG       LYS   3  -7.372 -15.667  -7.074
   20   2HG   LYS   3          2HG       LYS   3  -6.998 -16.766  -5.760
   21   1HD   LYS   3          1HD       LYS   3  -9.255 -17.567  -5.628
   22   2HD   LYS   3          2HD       LYS   3  -9.882 -16.217  -6.551
   23   1HE   LYS   3          1HE       LYS   3  -9.743 -18.352  -7.885
   24   2HE   LYS   3          2HE       LYS   3  -8.845 -17.031  -8.605
   25   1HZ   LYS   3          1HZ       LYS   3  -7.101 -18.338  -6.864
   26   2HZ   LYS   3          2HZ       LYS   3  -7.843 -19.512  -7.715
   27    H    GLU   4           H        GLU   4 -10.260 -17.404  -2.869
   28    HA   GLU   4           HA       GLU   4  -7.991 -18.255  -1.343
   29   1HB   GLU   4          1HB       GLU   4  -9.722 -19.975  -0.477
   30   2HB   GLU   4          2HB       GLU   4 -10.002 -18.287  -0.099
   31   1HG   GLU   4          1HG       GLU   4 -11.748 -18.076  -1.683
   32   2HG   GLU   4          2HG       GLU   4 -11.193 -19.440  -2.633
   33    HE2  GLU   4           HE       GLU   4 -13.367 -18.589  -0.236
   34    H    PHE   5           H        PHE   5  -6.557 -19.040  -3.007
   35    HA   PHE   5           HA       PHE   5  -7.374 -21.667  -3.987
   36   1HB   PHE   5          1HB       PHE   5  -7.628 -19.842  -5.763
   37   2HB   PHE   5          2HB       PHE   5  -5.942 -19.423  -5.534
   38    HD1  PHE   5           HD1      PHE   5  -6.689 -22.941  -5.324
   39    HD2  PHE   5           HD2      PHE   5  -5.741 -19.792  -8.007
   40    HE1  PHE   5           HE1      PHE   5  -6.034 -24.624  -7.067
   41    HE2  PHE   5           HE2      PHE   5  -5.086 -21.475  -9.750
   42    HZ   PHE   5           HZ       PHE   5  -5.241 -23.871  -9.259
   43    H    GLY   6           H        GLY   6  -5.840 -23.212  -3.608
   44   1HA   GLY   6          1HA       GLY   6  -3.731 -23.005  -1.996
   45   2HA   GLY   6          2HA       GLY   6  -3.774 -24.122  -3.346
   46    H    ARG   7           H        ARG   7  -3.874 -21.852  -5.368
   47    HA   ARG   7           HA       ARG   7  -1.206 -21.743  -5.908
   48   1HB   ARG   7          1HB       ARG   7  -3.664 -20.612  -6.972
   49   2HB   ARG   7          2HB       ARG   7  -2.418 -19.381  -7.011
   50   1HG   ARG   7          1HG       ARG   7  -0.909 -21.322  -8.013
   51   2HG   ARG   7          2HG       ARG   7  -2.444 -22.087  -8.374
   52   1HD   ARG   7          1HD       ARG   7  -3.161 -19.964  -9.572
   53   2HD   ARG   7          2HD       ARG   7  -1.556 -19.313  -9.301
   54    HE   ARG   7           HE       ARG   7  -2.293 -21.426 -11.208
   55   1HH1  ARG   7          2HH2      ARG   7   0.368 -19.897  -9.436
   56   2HH1  ARG   7          1HH2      ARG   7   1.584 -20.452 -10.539
   57   1HH2  ARG   7          1HH       ARG   7   0.940 -21.779 -12.426
   58    HA   PRO   8           HA       PRO   8   0.315 -18.231  -3.788
   59   1HB   PRO   8          1HB       PRO   8   1.571 -16.640  -5.622
   60   2HB   PRO   8          2HB       PRO   8   2.279 -18.111  -4.984
   61   1HG   PRO   8          1HG       PRO   8   1.074 -17.634  -7.641
   62   2HG   PRO   8          2HG       PRO   8   2.147 -18.926  -7.137
   63   1HD   PRO   8          1HD       PRO   8  -0.687 -19.106  -7.535
   64   2HD   PRO   8          2HD       PRO   8   0.366 -20.363  -6.920
   65    H    GLN   9           H        GLN   9  -2.323 -17.906  -5.570
   66    HA   GLN   9           HA       GLN   9  -2.508 -15.076  -5.525
   67   1HB   GLN   9          1HB       GLN   9  -3.861 -17.197  -6.801
   68   2HB   GLN   9          2HB       GLN   9  -5.067 -16.491  -5.742
   69   1HG   GLN   9          1HG       GLN   9  -5.366 -14.954  -7.402
   70   2HG   GLN   9          2HG       GLN   9  -3.896 -14.217  -6.794
   71   1HE2  GLN   9          1HE2      GLN   9  -2.208 -14.040  -8.077
   72   2HE2  GLN   9          2HE2      GLN   9  -1.982 -14.818  -9.608
   73    H    ARG  10           H        ARG  10  -3.602 -17.816  -3.483
   74    HA   ARG  10           HA       ARG  10  -5.374 -16.414  -1.927
   75   1HB   ARG  10          1HB       ARG  10  -4.940 -18.950  -1.993
   76   2HB   ARG  10          2HB       ARG  10  -3.551 -18.670  -0.961
   77   1HG   ARG  10          1HG       ARG  10  -6.270 -17.594  -0.154
   78   2HG   ARG  10          2HG       ARG  10  -5.883 -19.279   0.126
   79   1HD   ARG  10          1HD       ARG  10  -3.598 -17.939   1.061
   80   2HD   ARG  10          2HD       ARG  10  -4.905 -16.875   1.539
   81    HE   ARG  10           HE       ARG  10  -5.420 -18.428   3.190
   82   1HH1  ARG  10          2HH2      ARG  10  -4.002 -20.181   0.458
   83   2HH1  ARG  10          1HH2      ARG  10  -4.112 -21.727   1.231
   84   1HH2  ARG  10          1HH       ARG  10  -5.035 -21.871   3.439
   85    H    VAL  11           H        VAL  11  -1.805 -16.885  -1.660
   86    HA   VAL  11           HA       VAL  11  -1.623 -15.518   0.833
   87    HB   VAL  11           HB       VAL  11  -0.063 -17.248  -0.586
   88   1HG1  VAL  11          1HG1      VAL  11   1.379 -14.579  -0.694
   89   2HG1  VAL  11          2HG1      VAL  11   1.979 -16.160  -1.250
   90   3HG1  VAL  11          3HG1      VAL  11   0.628 -15.371  -2.100
   91   1HG2  VAL  11          1HG2      VAL  11   1.538 -17.020   1.202
   92   2HG2  VAL  11          2HG2      VAL  11   0.958 -15.380   1.579
   93   3HG2  VAL  11          3HG2      VAL  11  -0.094 -16.787   1.875
   94    H    ALA  12           H        ALA  12  -1.450 -14.666  -2.629
   95    HA   ALA  12           HA       ALA  12  -0.292 -12.132  -2.281
   96   1HB   ALA  12          1HB       ALA  12  -0.200 -12.875  -4.467
   97   2HB   ALA  12          2HB       ALA  12  -1.828 -13.593  -4.407
   98   3HB   ALA  12          3HB       ALA  12  -1.638 -11.830  -4.565
   99    H    GLN  13           H        GLN  13  -3.703 -13.317  -2.339
  100    HA   GLN  13           HA       GLN  13  -4.782 -10.737  -2.140
  101   1HB   GLN  13          1HB       GLN  13  -5.943 -13.488  -1.534
  102   2HB   GLN  13          2HB       GLN  13  -6.893 -12.017  -1.494
  103   1HG   GLN  13          1HG       GLN  13  -5.567 -13.345  -3.876
  104   2HG   GLN  13          2HG       GLN  13  -7.240 -12.855  -3.689
  105   1HE2  GLN  13          1HE2      GLN  13  -3.941 -11.760  -4.165
  106   2HE2  GLN  13          2HE2      GLN  13  -4.297 -10.205  -4.838
  107    H    GLU  14           H        GLU  14  -4.733 -13.439   0.306
  108    HA   GLU  14           HA       GLU  14  -5.613 -12.129   2.434
  109   1HB   GLU  14          1HB       GLU  14  -4.673 -14.564   2.144
  110   2HB   GLU  14          2HB       GLU  14  -3.159 -13.888   2.712
  111   1HG   GLU  14          1HG       GLU  14  -5.338 -12.968   4.416
  112   2HG   GLU  14          2HG       GLU  14  -5.395 -14.714   4.285
  113    HE2  GLU  14           HE       GLU  14  -2.841 -12.664   6.311
  114    H    MET  15           H        MET  15  -2.286 -11.936   1.070
  115    HA   MET  15           HA       MET  15  -1.355 -10.299   3.180
  116   1HB   MET  15          1HB       MET  15  -0.342 -11.084   0.407
  117   2HB   MET  15          2HB       MET  15   0.541  -9.920   1.372
  118   1HG   MET  15          1HG       MET  15   0.678 -11.604   3.244
  119   2HG   MET  15          2HG       MET  15  -0.157 -12.769   2.236
  120   1HE   MET  15          1HE       MET  15   2.378 -10.093   2.109
  121   2HE   MET  15          2HE       MET  15   3.669 -11.154   2.725
  122   3HE   MET  15          3HE       MET  15   3.665 -10.655   1.015
  123    H    GLN  16           H        GLN  16  -2.743  -9.770  -0.082
  124    HA   GLN  16           HA       GLN  16  -2.052  -7.083  -0.263
  125   1HB   GLN  16          1HB       GLN  16  -2.784  -8.504  -2.179
  126   2HB   GLN  16          2HB       GLN  16  -4.407  -8.561  -1.520
  127   1HG   GLN  16          1HG       GLN  16  -3.487  -5.791  -1.679
  128   2HG   GLN  16          2HG       GLN  16  -3.313  -6.574  -3.238
  129   1HE2  GLN  16          1HE2      GLN  16  -4.957  -5.033  -3.868
  130   2HE2  GLN  16          2HE2      GLN  16  -6.634  -5.403  -3.638
  131    H    LYS  17           H        LYS  17  -4.779  -8.817   1.268
  132    HA   LYS  17           HA       LYS  17  -6.258  -6.415   1.749
  133   1HB   LYS  17          1HB       LYS  17  -7.834  -7.837   2.846
  134   2HB   LYS  17          2HB       LYS  17  -7.302  -8.648   1.388
  135   1HG   LYS  17          1HG       LYS  17  -5.875 -10.154   2.612
  136   2HG   LYS  17          2HG       LYS  17  -5.957  -9.179   4.066
  137   1HD   LYS  17          1HD       LYS  17  -8.660  -9.804   3.427
  138   2HD   LYS  17          2HD       LYS  17  -7.765 -11.289   3.164
  139   1HE   LYS  17          1HE       LYS  17  -6.673 -10.857   5.483
  140   2HE   LYS  17          2HE       LYS  17  -7.905  -9.635   5.719
  141   1HZ   LYS  17          1HZ       LYS  17  -8.427 -12.508   5.173
  142   2HZ   LYS  17          2HZ       LYS  17  -8.657 -11.754   6.598
  143    H    GLU  18           H        GLU  18  -3.927  -8.497   3.502
  144    HA   GLU  18           HA       GLU  18  -4.338  -7.259   5.976
  145   1HB   GLU  18          1HB       GLU  18  -3.292  -9.510   5.655
  146   2HB   GLU  18          2HB       GLU  18  -1.886  -8.748   4.936
  147   1HG   GLU  18          1HG       GLU  18  -1.058  -8.719   7.067
  148   2HG   GLU  18          2HG       GLU  18  -2.088  -7.318   7.286
  149    HE2  GLU  18           HE       GLU  18  -2.253  -9.289   9.878
  150    H    ILE  19           H        ILE  19  -2.020  -6.724   3.261
  151    HA   ILE  19           HA       ILE  19  -0.622  -4.669   4.654
  152    HB   ILE  19           HB       ILE  19   0.662  -4.457   2.706
  153   1HG1  ILE  19          1HG1      ILE  19  -1.666  -5.709   1.236
  154   2HG1  ILE  19          2HG1      ILE  19  -0.997  -4.102   1.028
  155   1HG2  ILE  19          1HG2      ILE  19   1.570  -6.417   3.218
  156   2HG2  ILE  19          2HG2      ILE  19  -0.002  -7.077   3.726
  157   3HG2  ILE  19          3HG2      ILE  19   0.494  -7.172   2.019
  158   1HD1  ILE  19          1HD1      ILE  19   0.245  -5.002  -0.651
  159   2HD1  ILE  19          2HD1      ILE  19   1.230  -5.743   0.633
  160   3HD1  ILE  19          3HD1      ILE  19  -0.097  -6.664  -0.114
  161    H    ALA  20           H        ALA  20  -3.240  -4.834   2.183
  162    HA   ALA  20           HA       ALA  20  -3.378  -2.107   1.660
  163   1HB   ALA  20          1HB       ALA  20  -4.474  -3.712   0.239
  164   2HB   ALA  20          2HB       ALA  20  -5.447  -4.335   1.593
  165   3HB   ALA  20          3HB       ALA  20  -5.744  -2.696   0.962
  166    H    LEU  21           H        LEU  21  -4.612  -4.105   4.349
  167    HA   LEU  21           HA       LEU  21  -6.337  -2.088   5.357
  168   1HB   LEU  21          1HB       LEU  21  -6.910  -4.270   5.908
  169   2HB   LEU  21          2HB       LEU  21  -5.270  -4.707   6.345
  170    HG   LEU  21           HG       LEU  21  -6.190  -2.600   8.087
  171   1HD1  LEU  21          1HD1      LEU  21  -8.168  -4.709   7.451
  172   2HD1  LEU  21          2HD1      LEU  21  -7.884  -4.400   9.181
  173   3HD1  LEU  21          3HD1      LEU  21  -8.394  -3.072   8.111
  174   1HD2  LEU  21          1HD2      LEU  21  -4.553  -3.789   9.082
  175   2HD2  LEU  21          2HD2      LEU  21  -5.915  -4.767   9.679
  176   3HD2  LEU  21          3HD2      LEU  21  -4.991  -5.303   8.255
  177    H    ILE  22           H        ILE  22  -3.098  -3.357   6.413
  178    HA   ILE  22           HA       ILE  22  -2.729  -1.448   8.401
  179    HB   ILE  22           HB       ILE  22  -0.729  -3.007   6.763
  180   1HG1  ILE  22          1HG1      ILE  22  -1.934  -3.589   9.485
  181   2HG1  ILE  22          2HG1      ILE  22  -2.400  -4.372   7.988
  182   1HG2  ILE  22          1HG2      ILE  22   0.108  -0.909   7.997
  183   2HG2  ILE  22          2HG2      ILE  22  -0.214  -1.828   9.487
  184   3HG2  ILE  22          3HG2      ILE  22   0.945  -2.452   8.291
  185   1HD1  ILE  22          1HD1      ILE  22  -0.301  -5.460   7.746
  186   2HD1  ILE  22          2HD1      ILE  22   0.506  -4.342   8.873
  187   3HD1  ILE  22          3HD1      ILE  22  -0.634  -5.561   9.493
  188    H    LEU  23           H        LEU  23  -2.574  -1.239   4.906
  189    HA   LEU  23           HA       LEU  23  -0.980   1.174   4.989
  190   1HB   LEU  23          1HB       LEU  23  -0.903  -0.710   3.230
  191   2HB   LEU  23          2HB       LEU  23  -2.364   0.012   2.587
  192    HG   LEU  23           HG       LEU  23  -1.087   2.190   2.383
  193   1HD1  LEU  23          1HD1      LEU  23   1.428   1.902   2.239
  194   2HD1  LEU  23          2HD1      LEU  23   0.724   1.913   3.874
  195   3HD1  LEU  23          3HD1      LEU  23   1.210   0.374   3.126
  196   1HD2  LEU  23          1HD2      LEU  23  -1.517   0.369   0.571
  197   2HD2  LEU  23          2HD2      LEU  23  -0.360   1.685   0.248
  198   3HD2  LEU  23          3HD2      LEU  23   0.233   0.072   0.713
  199    H    GLN  24           H        GLN  24  -4.265   0.228   5.370
  200    HA   GLN  24           HA       GLN  24  -5.105   2.916   4.616
  201   1HB   GLN  24          1HB       GLN  24  -6.348   0.244   4.331
  202   2HB   GLN  24          2HB       GLN  24  -7.441   1.451   4.979
  203   1HG   GLN  24          1HG       GLN  24  -7.620   2.504   2.971
  204   2HG   GLN  24          2HG       GLN  24  -5.880   2.570   2.769
  205   1HE2  GLN  24          1HE2      GLN  24  -6.500   2.198   0.518
  206   2HE2  GLN  24          2HE2      GLN  24  -6.682   0.575  -0.062
  207    H    ARG  25           H        ARG  25  -4.286   0.933   7.238
  208    HA   ARG  25           HA       ARG  25  -6.096   2.416   8.970
  209   1HB   ARG  25          1HB       ARG  25  -4.903  -0.359   9.129
  210   2HB   ARG  25          2HB       ARG  25  -5.246   0.474  10.632
  211   1HG   ARG  25          1HG       ARG  25  -7.381   0.407   8.489
  212   2HG   ARG  25          2HG       ARG  25  -7.106  -1.034   9.449
  213   1HD   ARG  25          1HD       ARG  25  -7.650   0.089  11.505
  214   2HD   ARG  25          2HD       ARG  25  -7.495   1.676  10.779
  215    HE   ARG  25           HE       ARG  25  -9.506   0.542   9.277
  216   1HH1  ARG  25          2HH2      ARG  25  -9.026   0.884  12.771
  217   2HH1  ARG  25          1HH2      ARG  25 -10.721   0.939  13.124
  218   1HH2  ARG  25          1HH       ARG  25 -12.300   0.778  11.327
  219    H    GLU  26           H        GLU  26  -2.803   0.848   8.944
  220    HA   GLU  26           HA       GLU  26  -1.862   2.417  11.051
  221   1HB   GLU  26          1HB       GLU  26  -0.119   0.979  10.930
  222   2HB   GLU  26          2HB       GLU  26  -0.974   0.189   9.620
  223   1HG   GLU  26          1HG       GLU  26   1.134   0.670   8.661
  224   2HG   GLU  26          2HG       GLU  26   0.126   1.972   8.064
  225    HE2  GLU  26           HE       GLU  26   2.123   3.928   8.456
  226    H    ILE  27           H        ILE  27  -2.381   3.062   7.678
  227    HA   ILE  27           HA       ILE  27  -0.351   5.096   7.505
  228    HB   ILE  27           HB       ILE  27  -1.558   3.494   5.691
  229   1HG1  ILE  27          1HG1      ILE  27  -0.058   6.086   5.457
  230   2HG1  ILE  27          2HG1      ILE  27   0.489   4.451   5.145
  231   1HG2  ILE  27          1HG2      ILE  27  -2.948   4.922   4.226
  232   2HG2  ILE  27          2HG2      ILE  27  -3.705   4.597   5.803
  233   3HG2  ILE  27          3HG2      ILE  27  -2.950   6.179   5.488
  234   1HD1  ILE  27          1HD1      ILE  27  -1.295   6.201   3.425
  235   2HD1  ILE  27          2HD1      ILE  27   0.205   5.354   2.976
  236   3HD1  ILE  27          3HD1      ILE  27  -1.296   4.432   3.229
  237    H    LYS  28           H        LYS  28  -1.333   7.309   6.462
  238    HA   LYS  28           HA       LYS  28  -3.168   8.242   8.535
  239   1HB   LYS  28          1HB       LYS  28  -2.331  10.481   7.957
  240   2HB   LYS  28          2HB       LYS  28  -1.045   9.398   8.446
  241   1HG   LYS  28          1HG       LYS  28  -1.240   9.016   5.654
  242   2HG   LYS  28          2HG       LYS  28  -1.465  10.741   5.864
  243   1HD   LYS  28          1HD       LYS  28   0.939  10.183   5.594
  244   2HD   LYS  28          2HD       LYS  28   0.633  10.898   7.165
  245   1HE   LYS  28          1HE       LYS  28   0.951   8.873   8.314
  246   2HE   LYS  28          2HE       LYS  28   0.490   7.892   6.936
  247   1HZ   LYS  28          1HZ       LYS  28   2.882   9.505   6.562
  248   2HZ   LYS  28          2HZ       LYS  28   3.030   8.293   7.639
  249    H    ASP  29           H        ASP  29  -4.930   7.044   7.336
  250    HA   ASP  29           HA       ASP  29  -5.641   8.251   4.832
  251   1HB   ASP  29          1HB       ASP  29  -6.413   6.126   4.584
  252   2HB   ASP  29          2HB       ASP  29  -6.264   5.802   6.299
  253    HD2  ASP  29           HD       ASP  29  -9.806   6.082   4.787
  254    HA   PRO  30           HA       PRO  30  -9.163   9.529   7.804
  255   1HB   PRO  30          1HB       PRO  30  -8.906   9.066  10.485
  256   2HB   PRO  30          2HB       PRO  30  -9.771   7.990   9.406
  257   1HG   PRO  30          1HG       PRO  30  -7.100   7.638  10.622
  258   2HG   PRO  30          2HG       PRO  30  -8.148   6.430   9.907
  259   1HD   PRO  30          1HD       PRO  30  -5.811   7.595   8.720
  260   2HD   PRO  30          2HD       PRO  30  -6.925   6.474   7.962
  261    H    ARG  31           H        ARG  31  -5.928  10.097   8.150
  262    HA   ARG  31           HA       ARG  31  -6.426  12.506   9.671
  263   1HB   ARG  31          1HB       ARG  31  -4.499  11.369  10.497
  264   2HB   ARG  31          2HB       ARG  31  -3.937  10.950   8.892
  265   1HG   ARG  31          1HG       ARG  31  -4.161  13.880   9.555
  266   2HG   ARG  31          2HG       ARG  31  -2.857  12.982  10.309
  267   1HD   ARG  31          1HD       ARG  31  -1.813  12.492   8.252
  268   2HD   ARG  31          2HD       ARG  31  -3.299  12.645   7.336
  269    HE   ARG  31           HE       ARG  31  -2.856  15.199   8.387
  270   1HH1  ARG  31          2HH2      ARG  31  -1.035  12.979   6.312
  271   2HH1  ARG  31          1HH2      ARG  31  -0.211  14.248   5.467
  272   1HH2  ARG  31          1HH       ARG  31  -0.657  16.529   6.050
  273    H    LEU  32           H        LEU  32  -6.137  11.355   6.433
  274    HA   LEU  32           HA       LEU  32  -5.068  13.845   5.402
  275   1HB   LEU  32          1HB       LEU  32  -5.743  11.157   4.264
  276   2HB   LEU  32          2HB       LEU  32  -5.595  12.539   3.197
  277    HG   LEU  32           HG       LEU  32  -3.409  11.730   5.126
  278   1HD1  LEU  32          1HD1      LEU  32  -4.075   9.915   3.449
  279   2HD1  LEU  32          2HD1      LEU  32  -3.439  11.009   2.197
  280   3HD1  LEU  32          3HD1      LEU  32  -2.368  10.416   3.488
  281   1HD2  LEU  32          1HD2      LEU  32  -3.273  13.391   2.596
  282   2HD2  LEU  32          2HD2      LEU  32  -3.406  14.062   4.241
  283   3HD2  LEU  32          3HD2      LEU  32  -1.975  13.108   3.782
  284    H    GLY  33           H        GLY  33  -8.134  12.273   6.084
  285   1HA   GLY  33          1HA       GLY  33 -10.156  13.380   6.165
  286   2HA   GLY  33          2HA       GLY  33  -9.525  14.657   5.143
  287    H    MET  34           H        MET  34  -8.920  11.297   4.220
  288    HA   MET  34           HA       MET  34 -11.244  11.204   2.551
  289   1HB   MET  34          1HB       MET  34  -8.394  11.465   1.464
  290   2HB   MET  34          2HB       MET  34  -9.684  10.778   0.497
  291   1HG   MET  34          1HG       MET  34  -9.936  12.983  -0.158
  292   2HG   MET  34          2HG       MET  34 -10.956  13.040   1.264
  293   1HE   MET  34          1HE       MET  34  -6.668  13.263   1.192
  294   2HE   MET  34          2HE       MET  34  -7.672  13.348  -0.275
  295   3HE   MET  34          3HE       MET  34  -6.963  14.832   0.405
  296    H    MET  35           H        MET  35 -10.985   9.082   1.036
  297    HA   MET  35           HA       MET  35  -9.846   7.062   2.810
  298   1HB   MET  35          1HB       MET  35 -12.483   7.375   1.998
  299   2HB   MET  35          2HB       MET  35 -11.895   6.281   0.763
  300   1HG   MET  35          1HG       MET  35 -10.879   4.937   2.822
  301   2HG   MET  35          2HG       MET  35 -12.056   5.838   3.757
  302   1HE   MET  35          1HE       MET  35 -12.357   2.592   3.649
  303   2HE   MET  35          2HE       MET  35 -12.853   1.984   2.051
  304   3HE   MET  35          3HE       MET  35 -11.289   2.813   2.242
  305    H    THR  36           H        THR  36  -8.218   5.792   2.009
  306    HA   THR  36           HA       THR  36  -7.505   6.161  -0.786
  307    HB   THR  36           HB       THR  36  -5.415   4.966   0.004
  308    HG1  THR  36           HG1      THR  36  -6.933   3.896   1.720
  309   1HG2  THR  36          1HG2      THR  36  -6.056   6.988   2.164
  310   2HG2  THR  36          2HG2      THR  36  -4.548   6.771   1.244
  311   3HG2  THR  36          3HG2      THR  36  -5.952   7.552   0.478
  312    H    THR  37           H        THR  37  -6.668   4.146  -1.977
  313    HA   THR  37           HA       THR  37  -8.221   1.770  -1.320
  314    HB   THR  37           HB       THR  37  -8.598   3.563  -3.746
  315    HG1  THR  37           HG1      THR  37 -10.189   1.951  -1.877
  316   1HG2  THR  37          1HG2      THR  37  -9.308   0.590  -3.508
  317   2HG2  THR  37          2HG2      THR  37  -9.875   1.685  -4.793
  318   3HG2  THR  37          3HG2      THR  37  -8.145   1.280  -4.667
  319    H    VAL  38           H        VAL  38  -7.617  -0.085  -2.824
  320    HA   VAL  38           HA       VAL  38  -4.820   0.237  -3.658
  321    HB   VAL  38           HB       VAL  38  -5.091  -0.896  -1.443
  322   1HG1  VAL  38          1HG1      VAL  38  -5.988  -3.411  -2.732
  323   2HG1  VAL  38          2HG1      VAL  38  -6.339  -2.757  -1.114
  324   3HG1  VAL  38          3HG1      VAL  38  -7.235  -2.156  -2.531
  325   1HG2  VAL  38          1HG2      VAL  38  -3.056  -1.400  -2.396
  326   2HG2  VAL  38          2HG2      VAL  38  -3.767  -3.027  -2.278
  327   3HG2  VAL  38          3HG2      VAL  38  -3.789  -2.158  -3.832
  328    H    SER  39           H        SER  39  -5.525   0.558  -5.840
  329    HA   SER  39           HA       SER  39  -7.073  -1.606  -6.964
  330   1HB   SER  39          1HB       SER  39  -6.897   1.178  -7.461
  331   2HB   SER  39          2HB       SER  39  -6.181   0.425  -8.872
  332    HG   SER  39           HG       SER  39  -8.088  -0.448  -9.446
  333    H    GLY  40           H        GLY  40  -4.281  -2.023  -6.000
  334   1HA   GLY  40          1HA       GLY  40  -3.275  -3.549  -8.110
  335   2HA   GLY  40          2HA       GLY  40  -2.446  -2.006  -8.140
  336    H    VAL  41           H        VAL  41  -1.691  -4.922  -7.310
  337    HA   VAL  41           HA       VAL  41  -0.126  -4.081  -5.036
  338    HB   VAL  41           HB       VAL  41  -2.347  -6.081  -4.884
  339   1HG1  VAL  41          1HG1      VAL  41  -1.260  -7.048  -2.838
  340   2HG1  VAL  41          2HG1      VAL  41  -0.454  -7.469  -4.369
  341   3HG1  VAL  41          3HG1      VAL  41   0.244  -6.219  -3.310
  342   1HG2  VAL  41          1HG2      VAL  41  -3.133  -4.453  -3.568
  343   2HG2  VAL  41          2HG2      VAL  41  -1.868  -4.895  -2.396
  344   3HG2  VAL  41          3HG2      VAL  41  -1.571  -3.598  -3.578
  345    H    GLU  42           H        GLU  42   1.760  -5.402  -4.748
  346    HA   GLU  42           HA       GLU  42   2.055  -7.669  -6.453
  347   1HB   GLU  42          1HB       GLU  42   3.880  -5.265  -6.888
  348   2HB   GLU  42          2HB       GLU  42   3.989  -6.810  -7.711
  349   1HG   GLU  42          1HG       GLU  42   1.660  -6.438  -8.631
  350   2HG   GLU  42          2HG       GLU  42   1.644  -4.857  -7.876
  351    HE2  GLU  42           HE       GLU  42   4.823  -5.036 -10.087
  352    H    MET  43           H        MET  43   3.463  -9.139  -5.519
  353    HA   MET  43           HA       MET  43   5.289  -8.071  -3.523
  354   1HB   MET  43          1HB       MET  43   4.065 -10.716  -2.877
  355   2HB   MET  43          2HB       MET  43   4.381  -9.359  -1.813
  356   1HG   MET  43          1HG       MET  43   2.378  -8.173  -2.674
  357   2HG   MET  43          2HG       MET  43   2.085  -9.457  -3.830
  358   1HE   MET  43          1HE       MET  43   0.350  -8.104  -1.654
  359   2HE   MET  43          2HE       MET  43  -0.267  -9.217  -0.410
  360   3HE   MET  43          3HE       MET  43   1.237  -8.311  -0.126
  361    H    SER  44           H        SER  44   7.278  -8.565  -4.357
  362    HA   SER  44           HA       SER  44   7.524 -11.163  -5.643
  363   1HB   SER  44          1HB       SER  44   8.429  -8.549  -6.362
  364   2HB   SER  44          2HB       SER  44   9.864  -9.475  -5.968
  365    HG   SER  44           HG       SER  44   8.590 -11.193  -7.410
  366    H    ARG  45           H        ARG  45   8.224 -12.698  -4.191
  367    HA   ARG  45           HA       ARG  45  10.084 -11.801  -2.159
  368   1HB   ARG  45          1HB       ARG  45   8.998 -14.606  -2.141
  369   2HB   ARG  45          2HB       ARG  45   9.269 -13.516  -0.796
  370   1HG   ARG  45          1HG       ARG  45   7.301 -12.145  -2.146
  371   2HG   ARG  45          2HG       ARG  45   6.873 -13.794  -2.560
  372   1HD   ARG  45          1HD       ARG  45   7.518 -13.170   0.329
  373   2HD   ARG  45          2HD       ARG  45   5.970 -12.646  -0.307
  374    HE   ARG  45           HE       ARG  45   6.760 -15.381   0.273
  375   1HH1  ARG  45          2HH2      ARG  45   4.704 -13.431  -1.853
  376   2HH1  ARG  45          1HH2      ARG  45   3.585 -14.718  -2.157
  377   1HH2  ARG  45          1HH       ARG  45   3.945 -16.854  -1.133
  378    H    ASP  46           H        ASP  46  10.183 -13.000  -5.247
  379    HA   ASP  46           HA       ASP  46  11.792 -15.225  -5.088
  380   1HB   ASP  46          1HB       ASP  46  11.133 -13.142  -7.121
  381   2HB   ASP  46          2HB       ASP  46  12.649 -13.976  -7.399
  382    HD2  ASP  46           HD       ASP  46  10.912 -14.380  -9.242
  383    H    LEU  47           H        LEU  47  12.379 -11.907  -4.279
  384    HA   LEU  47           HA       LEU  47  15.207 -12.479  -3.943
  385   1HB   LEU  47          1HB       LEU  47  14.081 -10.491  -5.832
  386   2HB   LEU  47          2HB       LEU  47  15.427  -9.958  -4.845
  387    HG   LEU  47           HG       LEU  47  16.093 -12.526  -5.912
  388   1HD1  LEU  47          1HD1      LEU  47  16.012 -12.111  -8.306
  389   2HD1  LEU  47          2HD1      LEU  47  14.372 -12.102  -7.614
  390   3HD1  LEU  47          3HD1      LEU  47  15.170 -10.567  -8.032
  391   1HD2  LEU  47          1HD2      LEU  47  17.816 -11.055  -5.321
  392   2HD2  LEU  47          2HD2      LEU  47  17.857 -11.098  -7.099
  393   3HD2  LEU  47          3HD2      LEU  47  17.120  -9.713  -6.259
  394    H    ALA  48           H        ALA  48  13.018  -9.584  -3.775
  395    HA   ALA  48           HA       ALA  48  12.335  -9.550  -1.207
  396   1HB   ALA  48          1HB       ALA  48  14.345  -8.029  -0.309
  397   2HB   ALA  48          2HB       ALA  48  14.379  -9.803  -0.168
  398   3HB   ALA  48          3HB       ALA  48  15.271  -8.998  -1.480
  399    H    TYR  49           H        TYR  49  11.147  -8.552  -3.345
  400    HA   TYR  49           HA       TYR  49  11.158  -5.708  -2.816
  401   1HB   TYR  49          1HB       TYR  49  11.489  -5.214  -5.238
  402   2HB   TYR  49          2HB       TYR  49  12.846  -6.169  -4.677
  403    HD1  TYR  49           HD1      TYR  49   9.866  -6.126  -6.809
  404    HD2  TYR  49           HD2      TYR  49  13.099  -8.523  -5.360
  405    HE1  TYR  49           HE1      TYR  49   9.427  -7.838  -8.638
  406    HE2  TYR  49           HE2      TYR  49  12.650 -10.226  -7.193
  407    HH   TYR  49           HH       TYR  49   9.982  -9.736  -9.494
  408    H    ALA  50           H        ALA  50   9.092  -4.932  -2.834
  409    HA   ALA  50           HA       ALA  50   7.125  -6.374  -4.441
  410   1HB   ALA  50          1HB       ALA  50   7.102  -5.964  -1.443
  411   2HB   ALA  50          2HB       ALA  50   5.583  -6.118  -2.361
  412   3HB   ALA  50          3HB       ALA  50   6.769  -7.444  -2.375
  413    H    LYS  51           H        LYS  51   5.260  -5.062  -4.991
  414    HA   LYS  51           HA       LYS  51   5.556  -2.234  -4.300
  415   1HB   LYS  51          1HB       LYS  51   4.672  -2.501  -7.028
  416   2HB   LYS  51          2HB       LYS  51   6.021  -1.595  -6.378
  417   1HG   LYS  51          1HG       LYS  51   7.397  -3.705  -6.343
  418   2HG   LYS  51          2HG       LYS  51   6.050  -4.574  -7.052
  419   1HD   LYS  51          1HD       LYS  51   7.375  -4.028  -8.933
  420   2HD   LYS  51          2HD       LYS  51   6.130  -2.794  -8.957
  421   1HE   LYS  51          1HE       LYS  51   7.590  -1.109  -8.147
  422   2HE   LYS  51          2HE       LYS  51   8.706  -2.267  -7.451
  423   1HZ   LYS  51          1HZ       LYS  51   8.971  -2.973  -9.954
  424   2HZ   LYS  51          2HZ       LYS  51   8.444  -1.463 -10.260
  425    H    VAL  52           H        VAL  52   3.696  -1.459  -3.464
  426    HA   VAL  52           HA       VAL  52   1.234  -2.876  -4.221
  427    HB   VAL  52           HB       VAL  52   2.217  -3.094  -1.833
  428   1HG1  VAL  52          1HG1      VAL  52   0.967  -0.330  -1.672
  429   2HG1  VAL  52          2HG1      VAL  52   1.470  -1.319  -0.280
  430   3HG1  VAL  52          3HG1      VAL  52   2.685  -0.733  -1.442
  431   1HG2  VAL  52          1HG2      VAL  52   0.047  -3.959  -2.392
  432   2HG2  VAL  52          2HG2      VAL  52  -0.101  -3.054  -0.866
  433   3HG2  VAL  52          3HG2      VAL  52  -0.665  -2.327  -2.390
  434    H    TYR  53           H        TYR  53  -0.323  -1.659  -5.183
  435    HA   TYR  53           HA       TYR  53   0.247   1.145  -5.568
  436   1HB   TYR  53          1HB       TYR  53  -0.926  -1.001  -6.975
  437   2HB   TYR  53          2HB       TYR  53  -2.337  -0.109  -6.443
  438    HD1  TYR  53           HD1      TYR  53  -3.139   0.780  -8.478
  439    HD2  TYR  53           HD2      TYR  53   0.971   1.318  -7.420
  440    HE1  TYR  53           HE1      TYR  53  -2.842   2.394 -10.420
  441    HE2  TYR  53           HE2      TYR  53   1.254   2.931  -9.363
  442    HH   TYR  53           HH       TYR  53   0.043   4.287 -10.765
  443    H    VAL  54           H        VAL  54  -1.061   2.890  -4.905
  444    HA   VAL  54           HA       VAL  54  -3.392   2.292  -3.295
  445    HB   VAL  54           HB       VAL  54  -2.168   4.105  -1.675
  446   1HG1  VAL  54          1HG1      VAL  54  -1.746   1.156  -1.216
  447   2HG1  VAL  54          2HG1      VAL  54  -2.193   2.428  -0.055
  448   3HG1  VAL  54          3HG1      VAL  54  -3.385   1.848  -1.242
  449   1HG2  VAL  54          1HG2      VAL  54  -0.026   3.987  -2.794
  450   2HG2  VAL  54          2HG2      VAL  54   0.109   3.204  -1.201
  451   3HG2  VAL  54          3HG2      VAL  54  -0.015   2.211  -2.674
  452    H    THR  55           H        THR  55  -4.955   3.618  -4.046
  453    HA   THR  55           HA       THR  55  -4.082   6.164  -5.237
  454    HB   THR  55           HB       THR  55  -5.217   5.017  -6.939
  455    HG1  THR  55           HG1      THR  55  -7.117   6.230  -6.993
  456   1HG2  THR  55          1HG2      THR  55  -7.433   3.745  -6.335
  457   2HG2  THR  55          2HG2      THR  55  -5.890   2.949  -5.938
  458   3HG2  THR  55          3HG2      THR  55  -6.818   3.774  -4.664
  459    H    PHE  56           H        PHE  56  -4.644   8.068  -4.361
  460    HA   PHE  56           HA       PHE  56  -6.616   7.933  -2.188
  461   1HB   PHE  56          1HB       PHE  56  -4.330   9.943  -2.560
  462   2HB   PHE  56          2HB       PHE  56  -5.230   9.637  -1.087
  463    HD1  PHE  56           HD1      PHE  56  -5.135   6.616  -1.136
  464    HD2  PHE  56           HD2      PHE  56  -2.135   9.536  -1.828
  465    HE1  PHE  56           HE1      PHE  56  -3.375   4.983  -0.401
  466    HE2  PHE  56           HE2      PHE  56  -0.375   7.904  -1.093
  467    HZ   PHE  56           HZ       PHE  56  -1.017   5.647  -0.389
  468    H    LEU  57           H        LEU  57  -7.637  10.173  -1.736
  469    HA   LEU  57           HA       LEU  57  -8.358  11.302  -4.333
  470   1HB   LEU  57          1HB       LEU  57 -10.040  10.275  -2.687
  471   2HB   LEU  57          2HB       LEU  57  -9.797  11.720  -1.725
  472    HG   LEU  57           HG       LEU  57 -10.450  13.061  -3.796
  473   1HD1  LEU  57          1HD1      LEU  57 -10.102  10.960  -5.281
  474   2HD1  LEU  57          2HD1      LEU  57 -11.755  10.537  -4.778
  475   3HD1  LEU  57          3HD1      LEU  57 -11.450  12.067  -5.635
  476   1HD2  LEU  57          1HD2      LEU  57 -11.890  12.493  -1.755
  477   2HD2  LEU  57          2HD2      LEU  57 -12.725  13.011  -3.238
  478   3HD2  LEU  57          3HD2      LEU  57 -12.678  11.287  -2.800
  479    H    ASN  58           H        ASN  58  -5.878  11.807  -2.494
  480    HA   ASN  58           HA       ASN  58  -6.129  14.306  -1.388
  481   1HB   ASN  58          1HB       ASN  58  -3.927  12.508  -2.250
  482   2HB   ASN  58          2HB       ASN  58  -3.482  14.202  -2.317
  483   1HD2  ASN  58          1HD2      ASN  58  -4.910  15.305  -0.284
  484   2HD2  ASN  58          2HD2      ASN  58  -4.396  14.690   1.251
  485    H    ASP  59           H        ASP  59  -5.554  13.174  -4.734
  486    HA   ASP  59           HA       ASP  59  -4.439  15.165  -6.012
  487   1HB   ASP  59          1HB       ASP  59  -5.237  13.421  -7.374
  488   2HB   ASP  59          2HB       ASP  59  -6.842  13.467  -6.673
  489    HD2  ASP  59           HD       ASP  59  -8.268  14.297  -7.860
  490    H    LYS  60           H        LYS  60  -7.859  15.082  -4.820
  491    HA   LYS  60           HA       LYS  60  -8.965  17.251  -5.917
  492   1HB   LYS  60          1HB       LYS  60  -9.191  15.899  -3.292
  493   2HB   LYS  60          2HB       LYS  60  -9.831  17.529  -3.347
  494   1HG   LYS  60          1HG       LYS  60 -11.314  16.985  -5.190
  495   2HG   LYS  60          2HG       LYS  60 -10.520  15.448  -5.464
  496   1HD   LYS  60          1HD       LYS  60 -12.495  14.875  -4.265
  497   2HD   LYS  60          2HD       LYS  60 -11.228  14.810  -3.056
  498   1HE   LYS  60          1HE       LYS  60 -12.256  16.415  -1.825
  499   2HE   LYS  60          2HE       LYS  60 -12.226  17.527  -3.179
  500   1HZ   LYS  60          1HZ       LYS  60 -14.287  16.550  -3.990
  501   2HZ   LYS  60          2HZ       LYS  60 -14.298  15.430  -2.808
  502    H    ASP  61           H        ASP  61  -6.486  17.234  -3.309
  503    HA   ASP  61           HA       ASP  61  -6.216  20.091  -3.814
  504   1HB   ASP  61          1HB       ASP  61  -5.388  18.952  -1.158
  505   2HB   ASP  61          2HB       ASP  61  -5.985  20.555  -1.535
  506    HD2  ASP  61           HD       ASP  61  -6.846  18.682   0.492
  507    H    GLU  62           H        GLU  62  -4.175  20.482  -4.687
  508    HA   GLU  62           HA       GLU  62  -2.268  18.442  -4.786
  509   1HB   GLU  62          1HB       GLU  62  -2.692  20.475  -6.387
  510   2HB   GLU  62          2HB       GLU  62  -1.655  21.368  -5.293
  511   1HG   GLU  62          1HG       GLU  62  -0.395  18.824  -5.863
  512   2HG   GLU  62          2HG       GLU  62  -0.882  19.546  -7.383
  513    HE2  GLU  62           HE       GLU  62   1.271  21.160  -7.944
  514    H    ASP  63           H        ASP  63  -3.052  20.851  -2.407
  515    HA   ASP  63           HA       ASP  63  -0.460  21.151  -1.360
  516   1HB   ASP  63          1HB       ASP  63  -3.035  22.259  -0.935
  517   2HB   ASP  63          2HB       ASP  63  -2.628  21.497   0.590
  518    HD2  ASP  63           HD       ASP  63  -1.525  23.929  -1.639
  519    H    ALA  64           H        ALA  64  -3.376  19.135  -0.622
  520    HA   ALA  64           HA       ALA  64  -2.127  17.871   1.626
  521   1HB   ALA  64          1HB       ALA  64  -4.566  18.285   1.485
  522   2HB   ALA  64          2HB       ALA  64  -4.662  17.204   0.074
  523   3HB   ALA  64          3HB       ALA  64  -4.205  16.552   1.666
  524    H    VAL  65           H        VAL  65  -2.175  17.485  -1.848
  525    HA   VAL  65           HA       VAL  65  -1.633  14.684  -1.837
  526    HB   VAL  65           HB       VAL  65  -2.464  16.557  -3.668
  527   1HG1  VAL  65          1HG1      VAL  65   0.311  15.665  -4.518
  528   2HG1  VAL  65          2HG1      VAL  65  -0.833  16.658  -5.452
  529   3HG1  VAL  65          3HG1      VAL  65  -0.104  17.304  -3.963
  530   1HG2  VAL  65          1HG2      VAL  65  -3.231  14.574  -4.367
  531   2HG2  VAL  65          2HG2      VAL  65  -1.676  14.366  -5.209
  532   3HG2  VAL  65          3HG2      VAL  65  -1.900  13.699  -3.574
  533    H    LYS  66           H        LYS  66   0.291  17.728  -2.015
  534    HA   LYS  66           HA       LYS  66   2.748  16.347  -2.375
  535   1HB   LYS  66          1HB       LYS  66   2.359  18.643  -3.175
  536   2HB   LYS  66          2HB       LYS  66   2.173  19.202  -1.525
  537   1HG   LYS  66          1HG       LYS  66   4.612  17.769  -1.505
  538   2HG   LYS  66          2HG       LYS  66   4.632  18.635  -3.028
  539   1HD   LYS  66          1HD       LYS  66   4.334  20.773  -1.932
  540   2HD   LYS  66          2HD       LYS  66   3.919  20.016  -0.408
  541   1HE   LYS  66          1HE       LYS  66   6.108  19.790   0.189
  542   2HE   LYS  66          2HE       LYS  66   6.538  19.089  -1.357
  543   1HZ   LYS  66          1HZ       LYS  66   6.594  21.902  -0.560
  544   2HZ   LYS  66          2HZ       LYS  66   7.644  21.082  -1.496
  545    H    ALA  67           H        ALA  67   1.299  18.152   0.430
  546    HA   ALA  67           HA       ALA  67   3.267  17.365   2.243
  547   1HB   ALA  67          1HB       ALA  67   2.071  18.690   3.633
  548   2HB   ALA  67          2HB       ALA  67   1.065  19.045   2.209
  549   3HB   ALA  67          3HB       ALA  67   0.570  17.775   3.353
  550    H    GLY  68           H        GLY  68  -0.064  16.036   1.642
  551   1HA   GLY  68          1HA       GLY  68  -0.081  13.992   3.455
  552   2HA   GLY  68          2HA       GLY  68  -0.867  13.947   1.890
  553    H    ILE  69           H        ILE  69   0.902  13.651  -0.037
  554    HA   ILE  69           HA       ILE  69   1.864  11.064   0.251
  555    HB   ILE  69           HB       ILE  69   1.284  12.506  -1.827
  556   1HG1  ILE  69          1HG1      ILE  69   3.531  10.473  -1.768
  557   2HG1  ILE  69          2HG1      ILE  69   1.816  10.145  -1.929
  558   1HG2  ILE  69          1HG2      ILE  69   3.496  13.927  -1.056
  559   2HG2  ILE  69          2HG2      ILE  69   4.159  12.858  -2.314
  560   3HG2  ILE  69          3HG2      ILE  69   2.784  13.926  -2.688
  561   1HD1  ILE  69          1HD1      ILE  69   2.485  12.064  -3.955
  562   2HD1  ILE  69          2HD1      ILE  69   3.717  10.780  -4.002
  563   3HD1  ILE  69          3HD1      ILE  69   1.996  10.367  -4.171
  564    H    LYS  70           H        LYS  70   3.265  14.202   1.076
  565    HA   LYS  70           HA       LYS  70   5.949  13.318   1.159
  566   1HB   LYS  70          1HB       LYS  70   4.411  15.733   1.907
  567   2HB   LYS  70          2HB       LYS  70   5.861  15.459   2.850
  568   1HG   LYS  70          1HG       LYS  70   6.997  15.009   0.500
  569   2HG   LYS  70          2HG       LYS  70   5.605  15.853  -0.147
  570   1HD   LYS  70          1HD       LYS  70   7.036  17.659   0.183
  571   2HD   LYS  70          2HD       LYS  70   6.204  17.660   1.725
  572   1HE   LYS  70          1HE       LYS  70   8.073  17.001   2.885
  573   2HE   LYS  70          2HE       LYS  70   8.558  15.850   1.655
  574   1HZ   LYS  70          1HZ       LYS  70   8.986  18.786   1.548
  575   2HZ   LYS  70          2HZ       LYS  70  10.140  17.648   1.706
  576    H    ALA  71           H        ALA  71   3.166  13.108   3.341
  577    HA   ALA  71           HA       ALA  71   4.763  12.476   5.634
  578   1HB   ALA  71          1HB       ALA  71   1.785  12.209   5.048
  579   2HB   ALA  71          2HB       ALA  71   2.541  11.997   6.645
  580   3HB   ALA  71          3HB       ALA  71   2.586  13.586   5.843
  581    H    LEU  72           H        LEU  72   2.883  10.702   3.121
  582    HA   LEU  72           HA       LEU  72   3.185   8.177   4.324
  583   1HB   LEU  72          1HB       LEU  72   2.624   9.017   1.479
  584   2HB   LEU  72          2HB       LEU  72   2.579   7.358   2.037
  585    HG   LEU  72           HG       LEU  72   0.783   9.626   2.927
  586   1HD1  LEU  72          1HD1      LEU  72  -0.925   8.646   1.720
  587   2HD1  LEU  72          2HD1      LEU  72   0.480   8.375   0.661
  588   3HD1  LEU  72          3HD1      LEU  72  -0.134   7.053   1.682
  589   1HD2  LEU  72          1HD2      LEU  72   1.125   8.369   4.891
  590   2HD2  LEU  72          2HD2      LEU  72  -0.413   7.786   4.212
  591   3HD2  LEU  72          3HD2      LEU  72   1.069   6.822   4.012
  592    H    GLN  73           H        GLN  73   5.268  10.223   2.317
  593    HA   GLN  73           HA       GLN  73   6.997   8.064   1.650
  594   1HB   GLN  73          1HB       GLN  73   7.909   9.548   0.186
  595   2HB   GLN  73          2HB       GLN  73   6.530  10.555   0.581
  596   1HG   GLN  73          1HG       GLN  73   7.829  11.710   2.343
  597   2HG   GLN  73          2HG       GLN  73   9.193  10.644   2.077
  598   1HE2  GLN  73          1HE2      GLN  73  10.511  12.409   1.620
  599   2HE2  GLN  73          2HE2      GLN  73  10.469  13.247   0.106
  600    H    GLU  74           H        GLU  74   7.054  10.887   3.921
  601    HA   GLU  74           HA       GLU  74   9.588  10.339   4.915
  602   1HB   GLU  74          1HB       GLU  74   9.166  12.060   6.452
  603   2HB   GLU  74          2HB       GLU  74   8.079  12.463   5.138
  604   1HG   GLU  74          1HG       GLU  74   6.469  12.530   6.759
  605   2HG   GLU  74          2HG       GLU  74   6.471  10.783   6.616
  606    HE2  GLU  74           HE       GLU  74   7.336  12.385   9.981
  607    H    ALA  75           H        ALA  75   6.513   8.776   5.378
  608    HA   ALA  75           HA       ALA  75   7.557   7.421   7.769
  609   1HB   ALA  75          1HB       ALA  75   5.084   6.804   8.053
  610   2HB   ALA  75          2HB       ALA  75   5.506   8.515   8.303
  611   3HB   ALA  75          3HB       ALA  75   4.746   7.999   6.779
  612    H    SER  76           H        SER  76   8.095   7.017   4.749
  613    HA   SER  76           HA       SER  76   6.757   4.826   3.832
  614   1HB   SER  76          1HB       SER  76   9.655   5.678   3.429
  615   2HB   SER  76          2HB       SER  76   8.904   4.390   2.509
  616    HG   SER  76           HG       SER  76   8.877   6.624   1.540
  617    H    GLY  77           H        GLY  77  10.166   4.647   5.089
  618   1HA   GLY  77          1HA       GLY  77  10.337   1.968   5.501
  619   2HA   GLY  77          2HA       GLY  77  11.161   3.171   6.475
  620    H    PHE  78           H        PHE  78   8.385   4.301   7.305
  621    HA   PHE  78           HA       PHE  78   8.186   2.750   9.666
  622   1HB   PHE  78          1HB       PHE  78   7.295   5.275   8.498
  623   2HB   PHE  78          2HB       PHE  78   5.887   4.462   9.153
  624    HD1  PHE  78           HD1      PHE  78   8.461   6.678   9.902
  625    HD2  PHE  78           HD2      PHE  78   6.283   3.459  11.606
  626    HE1  PHE  78           HE1      PHE  78   9.063   7.486  12.201
  627    HE2  PHE  78           HE2      PHE  78   6.887   4.267  13.904
  628    HZ   PHE  78           HZ       PHE  78   8.269   6.272  14.174
  629    H    ILE  79           H        ILE  79   6.142   3.179   6.713
  630    HA   ILE  79           HA       ILE  79   4.108   1.446   7.680
  631    HB   ILE  79           HB       ILE  79   3.351   1.570   5.279
  632   1HG1  ILE  79          1HG1      ILE  79   5.492   3.679   4.966
  633   2HG1  ILE  79          2HG1      ILE  79   5.734   2.024   4.443
  634   1HG2  ILE  79          1HG2      ILE  79   3.646   3.848   7.175
  635   2HG2  ILE  79          2HG2      ILE  79   3.053   4.205   5.535
  636   3HG2  ILE  79          3HG2      ILE  79   2.185   3.039   6.562
  637   1HD1  ILE  79          1HD1      ILE  79   4.818   3.703   2.693
  638   2HD1  ILE  79          2HD1      ILE  79   3.978   2.140   2.833
  639   3HD1  ILE  79          3HD1      ILE  79   3.278   3.597   3.581
  640    H    ARG  80           H        ARG  80   7.008   1.114   5.579
  641    HA   ARG  80           HA       ARG  80   6.410  -1.481   4.782
  642   1HB   ARG  80          1HB       ARG  80   8.047  -0.144   3.556
  643   2HB   ARG  80          2HB       ARG  80   9.043   0.058   4.984
  644   1HG   ARG  80          1HG       ARG  80   9.508  -2.390   5.025
  645   2HG   ARG  80          2HG       ARG  80   8.473  -2.623   3.631
  646   1HD   ARG  80          1HD       ARG  80  10.214  -2.159   2.252
  647   2HD   ARG  80          2HD       ARG  80  10.330  -0.548   2.933
  648    HE   ARG  80           HE       ARG  80  12.063  -1.279   4.388
  649   1HH1  ARG  80          2HH2      ARG  80  10.715  -4.005   2.570
  650   2HH1  ARG  80          1HH2      ARG  80  12.006  -5.082   2.987
  651   1HH2  ARG  80          1HH       ARG  80  13.789  -4.293   4.380
  652    H    SER  81           H        SER  81   8.497  -0.122   7.421
  653    HA   SER  81           HA       SER  81   9.323  -2.639   8.324
  654   1HB   SER  81          1HB       SER  81  10.579  -0.558   8.781
  655   2HB   SER  81          2HB       SER  81   9.248   0.063   9.736
  656    HG   SER  81           HG       SER  81   9.733  -2.286  10.837
  657    H    LEU  82           H        LEU  82   6.557  -0.490   9.012
  658    HA   LEU  82           HA       LEU  82   5.743  -1.743  11.393
  659   1HB   LEU  82          1HB       LEU  82   5.024   0.465  10.866
  660   2HB   LEU  82          2HB       LEU  82   4.314  -0.051   9.349
  661    HG   LEU  82           HG       LEU  82   3.250  -1.301  11.838
  662   1HD1  LEU  82          1HD1      LEU  82   3.107   0.758  12.795
  663   2HD1  LEU  82          2HD1      LEU  82   3.101   1.614  11.234
  664   3HD1  LEU  82          3HD1      LEU  82   1.624   0.803  11.810
  665   1HD2  LEU  82          1HD2      LEU  82   1.134  -0.531  10.292
  666   2HD2  LEU  82          2HD2      LEU  82   2.398  -0.800   9.068
  667   3HD2  LEU  82          3HD2      LEU  82   1.959  -2.105  10.194
  668    H    LEU  83           H        LEU  83   5.251  -2.435   7.927
  669    HA   LEU  83           HA       LEU  83   3.172  -4.310   8.344
  670   1HB   LEU  83          1HB       LEU  83   5.067  -3.830   6.043
  671   2HB   LEU  83          2HB       LEU  83   3.750  -4.985   6.001
  672    HG   LEU  83           HG       LEU  83   3.048  -2.190   6.755
  673   1HD1  LEU  83          1HD1      LEU  83   3.632  -1.156   4.871
  674   2HD1  LEU  83          2HD1      LEU  83   4.705  -2.543   4.560
  675   3HD1  LEU  83          3HD1      LEU  83   3.070  -2.507   3.857
  676   1HD2  LEU  83          1HD2      LEU  83   1.074  -2.703   5.342
  677   2HD2  LEU  83          2HD2      LEU  83   1.758  -4.314   5.021
  678   3HD2  LEU  83          3HD2      LEU  83   1.307  -3.854   6.680
  679    H    GLY  84           H        GLY  84   6.703  -4.701   7.566
  680   1HA   GLY  84          1HA       GLY  84   6.926  -7.406   7.688
  681   2HA   GLY  84          2HA       GLY  84   8.163  -6.289   8.230
  682    H    LYS  85           H        LYS  85   7.128  -5.111  10.506
  683    HA   LYS  85           HA       LYS  85   7.403  -7.214  12.380
  684   1HB   LYS  85          1HB       LYS  85   7.228  -4.271  12.394
  685   2HB   LYS  85          2HB       LYS  85   6.543  -5.033  13.816
  686   1HG   LYS  85          1HG       LYS  85   8.736  -6.469  13.858
  687   2HG   LYS  85          2HG       LYS  85   9.378  -5.278  12.745
  688   1HD   LYS  85          1HD       LYS  85   8.082  -4.443  15.368
  689   2HD   LYS  85          2HD       LYS  85   9.772  -4.901  15.297
  690   1HE   LYS  85          1HE       LYS  85  10.354  -3.067  13.911
  691   2HE   LYS  85          2HE       LYS  85   8.712  -2.850  13.334
  692   1HZ   LYS  85          1HZ       LYS  85   8.098  -2.084  15.579
  693   2HZ   LYS  85          2HZ       LYS  85   9.630  -2.271  16.101
  694    H    ALA  86           H        ALA  86   4.650  -5.283  11.101
  695    HA   ALA  86           HA       ALA  86   2.738  -6.209  12.907
  696   1HB   ALA  86          1HB       ALA  86   2.242  -4.298  11.584
  697   2HB   ALA  86          2HB       ALA  86   2.638  -5.144  10.069
  698   3HB   ALA  86          3HB       ALA  86   1.166  -5.576  10.971
  699    H    MET  87           H        MET  87   4.238  -7.651  10.026
  700    HA   MET  87           HA       MET  87   2.402  -9.898  10.327
  701   1HB   MET  87          1HB       MET  87   3.130  -8.415   8.053
  702   2HB   MET  87          2HB       MET  87   4.170  -9.818   7.932
  703   1HG   MET  87          1HG       MET  87   1.962 -11.191   8.436
  704   2HG   MET  87          2HG       MET  87   1.137  -9.719   7.963
  705   1HE   MET  87          1HE       MET  87   0.904  -8.884   5.492
  706   2HE   MET  87          2HE       MET  87   2.557  -8.336   5.864
  707   3HE   MET  87          3HE       MET  87   2.215  -9.148   4.318
  708    H    ARG  88           H        ARG  88   5.167  -9.021  11.650
  709    HA   ARG  88           HA       ARG  88   7.216  -9.912  11.879
  710   1HB   ARG  88          1HB       ARG  88   5.083 -11.721  13.007
  711   2HB   ARG  88          2HB       ARG  88   6.738 -12.287  13.102
  712   1HG   ARG  88          1HG       ARG  88   7.298  -9.938  14.094
  713   2HG   ARG  88          2HG       ARG  88   5.568  -9.741  14.291
  714   1HD   ARG  88          1HD       ARG  88   5.609 -12.027  15.535
  715   2HD   ARG  88          2HD       ARG  88   7.353 -11.855  15.569
  716    HE   ARG  88           HE       ARG  88   7.139 -10.189  17.203
  717   1HH1  ARG  88          2HH2      ARG  88   3.993 -10.676  15.647
  718   2HH1  ARG  88          1HH2      ARG  88   3.146  -9.656  16.762
  719   1HH2  ARG  88          1HH       ARG  88   4.358  -8.588  18.531
  720    H    LEU  89           H        LEU  89   7.777 -10.209   9.535
  721    HA   LEU  89           HA       LEU  89   7.736 -13.053   8.796
  722   1HB   LEU  89          1HB       LEU  89   6.542 -11.012   7.447
  723   2HB   LEU  89          2HB       LEU  89   8.116 -11.042   6.674
  724    HG   LEU  89           HG       LEU  89   7.792 -13.477   6.203
  725   1HD1  LEU  89          1HD1      LEU  89   5.097 -13.909   6.295
  726   2HD1  LEU  89          2HD1      LEU  89   6.273 -14.508   7.488
  727   3HD1  LEU  89          3HD1      LEU  89   5.370 -13.008   7.807
  728   1HD2  LEU  89          1HD2      LEU  89   6.699 -13.084   4.229
  729   2HD2  LEU  89          2HD2      LEU  89   5.458 -12.056   4.986
  730   3HD2  LEU  89          3HD2      LEU  89   7.096 -11.417   4.712
  731    H    ARG  90           H        ARG  90   9.605 -12.430   6.534
  732    HA   ARG  90           HA       ARG  90  11.942 -11.571   7.978
  733   1HB   ARG  90          1HB       ARG  90  12.074 -13.943   8.399
  734   2HB   ARG  90          2HB       ARG  90  11.568 -14.343   6.770
  735   1HG   ARG  90          1HG       ARG  90  13.693 -14.189   5.954
  736   2HG   ARG  90          2HG       ARG  90  13.985 -12.664   6.766
  737   1HD   ARG  90          1HD       ARG  90  14.799 -13.693   8.721
  738   2HD   ARG  90          2HD       ARG  90  13.899 -15.171   8.449
  739    HE   ARG  90           HE       ARG  90  15.920 -14.657   6.391
  740   1HH1  ARG  90          2HH2      ARG  90  15.334 -16.111   9.568
  741   2HH1  ARG  90          1HH2      ARG  90  16.685 -17.190   9.462
  742   1HH2  ARG  90          1HH       ARG  90  18.065 -17.154   7.501
  743    H    ILE  91           H        ILE  91  10.487 -12.850   4.922
  744    HA   ILE  91           HA       ILE  91  12.372 -12.250   3.100
  745    HB   ILE  91           HB       ILE  91  10.353 -11.642   1.611
  746   1HG1  ILE  91          1HG1      ILE  91   8.592 -12.930   3.605
  747   2HG1  ILE  91          2HG1      ILE  91   9.065 -11.290   3.999
  748   1HG2  ILE  91          1HG2      ILE  91   9.565 -14.217   2.159
  749   2HG2  ILE  91          2HG2      ILE  91  10.925 -13.744   1.110
  750   3HG2  ILE  91          3HG2      ILE  91  11.221 -14.173   2.812
  751   1HD1  ILE  91          1HD1      ILE  91   7.789 -10.399   2.335
  752   2HD1  ILE  91          2HD1      ILE  91   8.342 -11.609   1.151
  753   3HD1  ILE  91          3HD1      ILE  91   7.010 -11.999   2.266
  754    H    VAL  92           H        VAL  92  10.409  -9.979   5.001
  755    HA   VAL  92           HA       VAL  92  10.150  -7.722   4.670
  756    HB   VAL  92           HB       VAL  92  13.106  -8.038   5.221
  757   1HG1  VAL  92          1HG1      VAL  92  11.587  -5.730   4.937
  758   2HG1  VAL  92          2HG1      VAL  92  11.635  -5.988   6.697
  759   3HG1  VAL  92          3HG1      VAL  92  13.152  -5.869   5.775
  760   1HG2  VAL  92          1HG2      VAL  92  11.619  -7.753   7.629
  761   2HG2  VAL  92          2HG2      VAL  92  10.855  -9.054   6.686
  762   3HG2  VAL  92          3HG2      VAL  92  12.588  -9.145   7.085
  763    HA   PRO  93           HA       PRO  93  11.896  -7.482   0.452
  764   1HB   PRO  93          1HB       PRO  93   9.574  -7.567  -0.987
  765   2HB   PRO  93          2HB       PRO  93  10.576  -8.977  -0.699
  766   1HG   PRO  93          1HG       PRO  93   8.000  -8.246   0.555
  767   2HG   PRO  93          2HG       PRO  93   8.792  -9.809   0.502
  768   1HD   PRO  93          1HD       PRO  93   8.685  -8.013   2.736
  769   2HD   PRO  93          2HD       PRO  93   9.573  -9.520   2.645
  770    H    GLU  94           H        GLU  94  11.807  -5.742  -1.151
  771    HA   GLU  94           HA       GLU  94  11.365  -3.354   0.222
  772   1HB   GLU  94          1HB       GLU  94  12.690  -4.170  -2.119
  773   2HB   GLU  94          2HB       GLU  94  11.446  -3.083  -2.703
  774   1HG   GLU  94          1HG       GLU  94  12.225  -1.272  -1.309
  775   2HG   GLU  94          2HG       GLU  94  13.230  -2.340  -0.351
  776    HE2  GLU  94           HE       GLU  94  13.262  -0.252  -2.776
  777    H    LEU  95           H        LEU  95   8.996  -4.262   0.756
  778    HA   LEU  95           HA       LEU  95   7.058  -3.983  -1.281
  779   1HB   LEU  95          1HB       LEU  95   7.163  -5.095   1.210
  780   2HB   LEU  95          2HB       LEU  95   6.207  -3.657   1.517
  781    HG   LEU  95           HG       LEU  95   5.579  -6.010  -0.245
  782   1HD1  LEU  95          1HD1      LEU  95   4.789  -6.167   2.008
  783   2HD1  LEU  95          2HD1      LEU  95   4.093  -4.529   1.940
  784   3HD1  LEU  95          3HD1      LEU  95   3.393  -5.836   0.955
  785   1HD2  LEU  95          1HD2      LEU  95   3.585  -4.661  -1.065
  786   2HD2  LEU  95          2HD2      LEU  95   4.472  -3.213  -0.528
  787   3HD2  LEU  95          3HD2      LEU  95   5.167  -4.272  -1.782
  788    H    THR  96           H        THR  96   7.346  -1.981  -2.334
  789    HA   THR  96           HA       THR  96   7.186   0.416  -0.687
  790    HB   THR  96           HB       THR  96   8.761  -0.151  -2.788
  791    HG1  THR  96           HG1      THR  96   8.979   2.092  -2.693
  792   1HG2  THR  96          1HG2      THR  96   6.719   1.483  -4.250
  793   2HG2  THR  96          2HG2      THR  96   7.877   0.289  -4.886
  794   3HG2  THR  96          3HG2      THR  96   6.361  -0.256  -4.131
  795    H    PHE  97           H        PHE  97   5.698   2.201  -1.389
  796    HA   PHE  97           HA       PHE  97   3.152   1.029  -2.262
  797   1HB   PHE  97          1HB       PHE  97   2.102   2.536  -0.612
  798   2HB   PHE  97          2HB       PHE  97   3.369   1.653   0.215
  799    HD1  PHE  97           HD1      PHE  97   2.079   4.870  -0.568
  800    HD2  PHE  97           HD2      PHE  97   5.657   2.822   0.444
  801    HE1  PHE  97           HE1      PHE  97   3.114   7.036   0.164
  802    HE2  PHE  97           HE2      PHE  97   6.690   4.988   1.176
  803    HZ   PHE  97           HZ       PHE  97   5.407   7.070   1.027
  804    H    PHE  98           H        PHE  98   2.656   1.793  -4.261
  805    HA   PHE  98           HA       PHE  98   3.717   4.367  -5.055
  806   1HB   PHE  98          1HB       PHE  98   2.848   1.825  -6.226
  807   2HB   PHE  98          2HB       PHE  98   1.944   3.121  -6.983
  808    HD1  PHE  98           HD1      PHE  98   3.594   5.258  -7.519
  809    HD2  PHE  98           HD2      PHE  98   4.730   1.171  -7.364
  810    HE1  PHE  98           HE1      PHE  98   5.549   5.744  -9.017
  811    HE2  PHE  98           HE2      PHE  98   6.685   1.658  -8.861
  812    HZ   PHE  98           HZ       PHE  98   7.071   3.937  -9.670
  813    H    TYR  99           H        TYR  99   2.580   6.203  -4.666
  814    HA   TYR  99           HA       TYR  99  -0.240   6.020  -4.095
  815   1HB   TYR  99          1HB       TYR  99   0.679   8.720  -4.324
  816   2HB   TYR  99          2HB       TYR  99   0.534   7.812  -2.831
  817    HD1  TYR  99           HD1      TYR  99   2.484   6.887  -1.726
  818    HD2  TYR  99           HD2      TYR  99   2.860   8.893  -5.486
  819    HE1  TYR  99           HE1      TYR  99   5.005   7.001  -1.421
  820    HE2  TYR  99           HE2      TYR  99   5.380   9.001  -5.168
  821    HH   TYR  99           HH       TYR  99   6.870   7.836  -2.173
  822    H    ASP 100           H        ASP 100  -1.573   5.743  -5.845
  823    HA   ASP 100           HA       ASP 100  -0.966   7.385  -8.169
  824   1HB   ASP 100          1HB       ASP 100  -1.450   4.701  -8.062
  825   2HB   ASP 100          2HB       ASP 100  -3.096   5.270  -8.252
  826    HD2  ASP 100           HD       ASP 100  -1.235   7.299 -10.599
  827    H    ASN 101           H        ASN 101  -1.989   9.344  -7.328
  828    HA   ASN 101           HA       ASN 101  -4.746   9.089  -6.526
  829   1HB   ASN 101          1HB       ASN 101  -3.201  11.703  -6.755
  830   2HB   ASN 101          2HB       ASN 101  -4.536  11.330  -5.683
  831   1HD2  ASN 101          1HD2      ASN 101  -1.605  12.196  -5.420
  832   2HD2  ASN 101          2HD2      ASN 101  -0.952  11.180  -4.180
  833    H    SER 102           H        SER 102  -5.911  11.451  -7.397
  834    HA   SER 102           HA       SER 102  -6.097  10.962 -10.203
  835   1HB   SER 102          1HB       SER 102  -7.656  13.239  -9.480
  836   2HB   SER 102          2HB       SER 102  -8.220  11.612  -9.810
  837    HG   SER 102           HG       SER 102  -8.888  12.191  -7.707
  838    H    LEU 103           H        LEU 103  -3.744  12.421  -8.605
  839    HA   LEU 103           HA       LEU 103  -3.764  14.947 -10.050
  840   1HB   LEU 103          1HB       LEU 103  -3.237  14.881  -7.642
  841   2HB   LEU 103          2HB       LEU 103  -1.850  13.863  -7.979
  842    HG   LEU 103           HG       LEU 103  -1.430  16.044  -9.639
  843   1HD1  LEU 103          1HD1      LEU 103  -1.734  17.615  -7.271
  844   2HD1  LEU 103          2HD1      LEU 103  -2.442  17.863  -8.885
  845   3HD1  LEU 103          3HD1      LEU 103  -3.303  16.879  -7.677
  846   1HD2  LEU 103          1HD2      LEU 103  -0.264  14.854  -7.251
  847   2HD2  LEU 103          2HD2      LEU 103   0.522  15.568  -8.681
  848   3HD2  LEU 103          3HD2      LEU 103   0.009  16.611  -7.332
  849    H    VAL 104           H        VAL 104  -3.137  11.829 -10.834
  850    HA   VAL 104           HA       VAL 104  -1.070  12.661 -12.720
  851    HB   VAL 104           HB       VAL 104  -0.856  10.623 -10.594
  852   1HG1  VAL 104          1HG1      VAL 104   0.626   9.170 -11.963
  853   2HG1  VAL 104          2HG1      VAL 104  -1.075   9.123 -12.487
  854   3HG1  VAL 104          3HG1      VAL 104   0.118  10.064 -13.415
  855   1HG2  VAL 104          1HG2      VAL 104   0.660  12.797 -11.671
  856   2HG2  VAL 104          2HG2      VAL 104   0.990  11.814 -10.224
  857   3HG2  VAL 104          3HG2      VAL 104   1.633  11.313 -11.807
  858    H    GLU 105           H        GLU 105  -4.149  11.830 -12.342
  859    HA   GLU 105           HA       GLU 105  -4.219  10.575 -14.902
  860   1HB   GLU 105          1HB       GLU 105  -4.672   9.034 -12.414
  861   2HB   GLU 105          2HB       GLU 105  -5.983   8.891 -13.569
  862   1HG   GLU 105          1HG       GLU 105  -4.073   8.482 -15.339
  863   2HG   GLU 105          2HG       GLU 105  -3.060   8.166 -13.943
  864    HE2  GLU 105           HE       GLU 105  -4.228   6.331 -15.996
  865    H    GLY 106           H        GLY 106  -5.859  11.826 -11.972
  866   1HA   GLY 106          1HA       GLY 106  -7.479  13.477 -11.999
  867   2HA   GLY 106          2HA       GLY 106  -7.817  13.150 -13.687
  868    H    MET 107           H        MET 107  -8.017  10.207 -13.399
  869    HA   MET 107           HA       MET 107 -10.695  10.196 -12.339
  870   1HB   MET 107          1HB       MET 107 -10.936   8.139 -13.605
  871   2HB   MET 107          2HB       MET 107  -9.974   9.200 -14.614
  872   1HG   MET 107          1HG       MET 107  -7.993   7.958 -13.140
  873   2HG   MET 107          2HG       MET 107  -9.186   6.677 -13.228
  874   1HE   MET 107          1HE       MET 107  -7.190   8.904 -16.658
  875   2HE   MET 107          2HE       MET 107  -7.367   9.381 -14.952
  876   3HE   MET 107          3HE       MET 107  -6.159   8.156 -15.414
  877    H    ARG 108           H        ARG 108  -7.893  10.060 -10.805
  878    HA   ARG 108           HA       ARG 108  -8.637   7.719  -9.243
  879   1HB   ARG 108          1HB       ARG 108  -5.944   9.015  -9.813
  880   2HB   ARG 108          2HB       ARG 108  -6.148   7.999  -8.401
  881   1HG   ARG 108          1HG       ARG 108  -6.344   7.233 -11.326
  882   2HG   ARG 108          2HG       ARG 108  -5.391   6.484 -10.060
  883   1HD   ARG 108          1HD       ARG 108  -7.747   5.936  -8.968
  884   2HD   ARG 108          2HD       ARG 108  -8.371   6.235 -10.577
  885    HE   ARG 108           HE       ARG 108  -6.090   4.459 -10.699
  886   1HH1  ARG 108          2HH2      ARG 108  -9.536   4.517  -9.873
  887   2HH1  ARG 108          1HH2      ARG 108  -9.772   2.835 -10.212
  888   1HH2  ARG 108          1HH       ARG 108  -7.916   1.515 -10.959