*HEADER    PROTEIN BINDING                         08-FEB-06   2FYJ              
*TITLE     NMR SOLUTION STRUCTURE OF CALCIUM-LOADED LRP DOUBLE MODULE            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LOW-DENSITY LIPOPROTEIN RECEPTOR-RELATED PROTEIN           
*COMPND   3 1;                                                                   
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 SYNONYM: LRP, ALPHA-2-MACROGLOBULIN RECEPTOR;                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: LRP1;                                                          
*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: PT7                                       
*KEYWDS    DOUBLE MODULE, COMPLEMENT TYPE REPEAT, CALCIUM, BETA-2                
*KEYWDS   2 HAIRPIN, LOOP-STRUCTURES                                             
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    G.A.JENSEN, O.M.ANDERSEN, A.M.BONVIN, I.BJERRUM-BOHR,                 
*AUTHOR   2 M.ETZERODT, C.O'SHEA, F.M.POULSEN, B.B.KRAGELUND                     
*REVDAT   1   10-OCT-06 2FYJ    0                                                


REMARK pseudo calcium constraints
assign (resid   22 and name O    )(resid   25 and name OD1  )   4.94  3.14  1.00
assign (resid   22 and name O    )(resid   27 and name O    )   6.98  3.20  1.00
assign (resid   22 and name O    )(resid   29 and name OD1  )   4.94  3.14  1.00
assign (resid   22 and name O    )(resid   35 and name OD1  )   4.94  3.14  1.00
assign (resid   22 and name O    )(resid   36 and name OE1  )   4.94  3.14  1.00
assign (resid   25 and name OD1  )(resid   27 and name O    )   4.94  3.14  1.00
assign (resid   25 and name OD1  )(resid   29 and name OD1  )   4.94  3.14  1.00
assign (resid   25 and name OD1  )(resid   35 and name OD1  )   6.98  3.20  1.00
assign (resid   25 and name OD1  )(resid   36 and name OE1  )   4.94  3.14  1.00
assign (resid   27 and name O    )(resid   29 and name OD1  )   4.94  3.14  1.00
assign (resid   27 and name O    )(resid   35 and name OD1  )   4.94  3.14  1.00
assign (resid   27 and name O    )(resid   36 and name OE1  )   4.94  3.14  1.00
assign (resid   29 and name OD1  )(resid   35 and name OD1  )   4.94  3.14  1.00
assign (resid   29 and name OD1  )(resid   36 and name OE1  )   6.98  3.20  1.00
assign (resid   35 and name OD1  )(resid   36 and name OE1  )   4.94  3.14  1.00
assign (resid   63 and name O    )(resid   66 and name OD1  )   4.94  3.14  1.00
assign (resid   63 and name O    )(resid   68 and name O    )   6.98  3.20  1.00
assign (resid   63 and name O    )(resid   70 and name OD1  )   4.94  3.14  1.00
assign (resid   63 and name O    )(resid   76 and name OD1  )   4.94  3.14  1.00
assign (resid   63 and name O    )(resid   77 and name OE1  )   4.94  3.14  1.00
assign (resid   66 and name OD1  )(resid   68 and name O    )   4.94  3.14  1.00
assign (resid   66 and name OD1  )(resid   70 and name OD1  )   4.94  3.14  1.00
assign (resid   66 and name OD1  )(resid   76 and name OD1  )   6.98  3.20  1.00
assign (resid   66 and name OD1  )(resid   77 and name OE1  )   4.94  3.14  1.00
assign (resid   68 and name O    )(resid   70 and name OD1  )   4.94  3.14  1.00
assign (resid   68 and name O    )(resid   76 and name OD1  )   4.94  3.14  1.00
assign (resid   68 and name O    )(resid   77 and name OE1  )   4.94  3.14  1.00
assign (resid   70 and name OD1  )(resid   76 and name OD1  )   4.94  3.14  1.00
assign (resid   70 and name OD1  )(resid   77 and name OE1  )   6.98  3.20  1.00
assign (resid   76 and name OD1  )(resid   77 and name OE1  )   4.94  3.14  1.00
REMARK unambigous NOE constraints CR56
ASSIGN (RESID   2 AND NAME HA   ) (RESID   3 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID   2 AND NAME HB#  ) (RESID   3 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   3 AND NAME HA   ) (RESID   3 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID   3 AND NAME HG#  ) (RESID   4 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   3 AND NAME HG#  ) (RESID  14 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   4 AND NAME HA   ) (RESID   5 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID   4 AND NAME HB   ) (RESID   5 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   4 AND NAME HB   ) (RESID  11 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   4 AND NAME HG2# ) (RESID   5 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID   5 AND NAME HN   ) (RESID  11 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HA   ) (RESID   6 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HA   ) (RESID  17 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID   6 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID   9 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID   9 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID  11 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID  12 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID  17 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HB#  ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HB#  ) (RESID   7 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HB#  ) (RESID   7 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HB#  ) (RESID   9 AND NAME HE21 )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HB#  ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HG#  ) (RESID   9 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HG#  ) (RESID   9 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HG#  ) (RESID   9 AND NAME HE21 )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HG#  ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID   9 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID   9 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID   9 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID   9 AND NAME HE21 )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID  10 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HD#  ) (RESID  17 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   8 AND NAME HA   ) (RESID   8 AND NAME HD22 )  4.0 2.2 1.0
ASSIGN (RESID   8 AND NAME HA   ) (RESID   9 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID   8 AND NAME HA   ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   8 AND NAME HA   ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   8 AND NAME HB#  ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   8 AND NAME HD21 ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID   8 AND NAME HD22 ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID   9 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID  10 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID  20 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID  20 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID   9 AND NAME HN   ) (RESID  20 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HN   ) (RESID  20 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID   9 AND NAME HA   ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HA   ) (RESID  10 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID   9 AND NAME HA   ) (RESID  20 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID   9 AND NAME HB#  ) (RESID   9 AND NAME HE21 )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HB#  ) (RESID   9 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HB#  ) (RESID  10 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HB#  ) (RESID  17 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HB#  ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HB#  ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HB#  ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HG#  ) (RESID  10 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HG#  ) (RESID  10 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HG#  ) (RESID  11 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID   9 AND NAME HG#  ) (RESID  17 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HG#  ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HE21 ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HE21 ) (RESID  19 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID   9 AND NAME HE22 ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HN   ) (RESID  17 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HN   ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HN   ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  10 AND NAME HN   ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HN   ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HN   ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HN   ) (RESID  20 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HA   ) (RESID  11 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  18 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  20 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  20 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  20 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  10 AND NAME HB#  ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  11 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  12 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  18 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  18 AND NAME HG1# )  3.0 1.2 0.3
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  18 AND NAME HD#  )  3.0 1.2 0.7
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  20 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  20 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  20 AND NAME HD#  )  3.0 1.2 0.7
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  23 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  23 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  10 AND NAME HD#  ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  13 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  18 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  35 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HE#  ) (RESID  39 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HZ   ) (RESID  13 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HZ   ) (RESID  35 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  10 AND NAME HZ   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  11 AND NAME HN   ) (RESID  11 AND NAME HA   )  2.4 0.6 0.3
ASSIGN (RESID  11 AND NAME HN   ) (RESID  17 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  11 AND NAME HN   ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  11 AND NAME HN   ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  11 AND NAME HA   ) (RESID  12 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  11 AND NAME HA   ) (RESID  16 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  11 AND NAME HA   ) (RESID  17 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  11 AND NAME HB#  ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HN   ) (RESID  12 AND NAME HA   )  2.4 0.6 0.3
ASSIGN (RESID  12 AND NAME HN   ) (RESID  16 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HN   ) (RESID  16 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HN   ) (RESID  16 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HN   ) (RESID  17 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HN   ) (RESID  17 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HA   ) (RESID  13 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  13 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  14 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  15 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  16 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  17 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  30 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  13 AND NAME HN   ) (RESID  14 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  13 AND NAME HA   ) (RESID  14 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  13 AND NAME HA   ) (RESID  14 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  13 AND NAME HA   ) (RESID  14 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  13 AND NAME HA   ) (RESID  15 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  13 AND NAME HB#  ) (RESID  14 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  13 AND NAME HB#  ) (RESID  14 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  13 AND NAME HB#  ) (RESID  15 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  13 AND NAME HB#  ) (RESID  15 AND NAME HA#  )  4.0 2.2 1.5
ASSIGN (RESID  13 AND NAME HB#  ) (RESID  16 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  13 AND NAME HB#  ) (RESID  16 AND NAME HD#  )  3.0 1.2 0.8
ASSIGN (RESID  14 AND NAME HN   ) (RESID  15 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  14 AND NAME HN   ) (RESID  15 AND NAME HA#  )  4.0 2.2 1.0
ASSIGN (RESID  14 AND NAME HN   ) (RESID  16 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  15 AND NAME HN   ) (RESID  16 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  16 AND NAME HN   ) (RESID  16 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HN   ) (RESID  16 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HN   ) (RESID  17 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HN   ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  16 AND NAME HA   ) (RESID  16 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HA   ) (RESID  17 AND NAME HN   )  2.4 0.6 0.3
ASSIGN (RESID  16 AND NAME HA   ) (RESID  17 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HG#  ) (RESID  17 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HG#  ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  16 AND NAME HD#  ) (RESID  17 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HD#  ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  17 AND NAME HN   ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  17 AND NAME HN   ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  17 AND NAME HN   ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  17 AND NAME HA   ) (RESID  18 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  17 AND NAME HA   ) (RESID  18 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  17 AND NAME HA   ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  17 AND NAME HB#  ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  18 AND NAME HN   ) (RESID  18 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  18 AND NAME HN   ) (RESID  18 AND NAME HD#  )  3.0 1.2 0.7
ASSIGN (RESID  18 AND NAME HB   ) (RESID  29 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  18 AND NAME HG2# ) (RESID  22 AND NAME HE3  )  4.0 2.2 1.5
ASSIGN (RESID  18 AND NAME HG2# ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  18 AND NAME HG2# ) (RESID  29 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  18 AND NAME HG1# ) (RESID  22 AND NAME HE3  )  4.0 2.2 1.0
ASSIGN (RESID  18 AND NAME HG1# ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  22 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  22 AND NAME HB#  )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  22 AND NAME HE3  )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  22 AND NAME HE1  )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  23 AND NAME HG2# )  3.0 1.2 0.7
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  29 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  29 AND NAME HB#  )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  30 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.4
ASSIGN (RESID  19 AND NAME HA   ) (RESID  20 AND NAME HN   )  2.4 0.6 0.3
ASSIGN (RESID  19 AND NAME HA   ) (RESID  20 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  19 AND NAME HB#  ) (RESID  20 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  19 AND NAME HB#  ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  19 AND NAME HB#  ) (RESID  22 AND NAME HD1  )  4.0 2.2 1.0
ASSIGN (RESID  19 AND NAME HB#  ) (RESID  22 AND NAME HE1  )  4.0 2.2 1.0
ASSIGN (RESID  19 AND NAME HB#  ) (RESID  22 AND NAME HZ2  )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HB   )  3.0 1.2 0.3
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  20 AND NAME HN   ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  20 AND NAME HA   ) (RESID  20 AND NAME HD#  )  3.0 1.2 0.7
ASSIGN (RESID  20 AND NAME HA   ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HA   ) (RESID  23 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HA   ) (RESID  23 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  20 AND NAME HB   ) (RESID  21 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HB   ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HB   ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  20 AND NAME HB   ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  20 AND NAME HG2# ) (RESID  21 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  20 AND NAME HG2# ) (RESID  21 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  20 AND NAME HG1# ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  21 AND NAME HA   ) (RESID  22 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  21 AND NAME HA   ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  21 AND NAME HB#  ) (RESID  22 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  21 AND NAME HB#  ) (RESID  22 AND NAME HD1  )  4.0 2.2 1.0
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HD1  )  3.0 1.2 0.3
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HE1  )  4.0 2.2 1.0
ASSIGN (RESID  22 AND NAME HN   ) (RESID  23 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  22 AND NAME HN   ) (RESID  23 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  22 AND NAME HN   ) (RESID  48 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  22 AND NAME HN   ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  22 AND NAME HA   ) (RESID  22 AND NAME HD1  )  4.0 2.2 1.0
ASSIGN (RESID  22 AND NAME HA   ) (RESID  23 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  22 AND NAME HB#  ) (RESID  23 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  22 AND NAME HE3  ) (RESID  29 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  23 AND NAME HN   ) (RESID  24 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HN   ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  23 AND NAME HA   ) (RESID  24 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  23 AND NAME HA   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HB   ) (RESID  24 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HB   ) (RESID  35 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HB   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HG2# ) (RESID  24 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  23 AND NAME HG2# ) (RESID  35 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  23 AND NAME HG2# ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  23 AND NAME HG2# ) (RESID  48 AND NAME HD*  )  3.0 1.2 0.8
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HA   )  2.4 0.6 0.3
ASSIGN (RESID  24 AND NAME HN   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HN   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HA   ) (RESID  40 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HB#  ) (RESID  40 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HB#  ) (RESID  40 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  25 AND NAME HN   ) (RESID  26 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  25 AND NAME HN   ) (RESID  26 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  25 AND NAME HN   ) (RESID  26 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  25 AND NAME HN   ) (RESID  27 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  25 AND NAME HN   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HG   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HN   ) (RESID  27 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HN   ) (RESID  27 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HN   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HA   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HB#  ) (RESID  27 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HB#  ) (RESID  27 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HB#  ) (RESID  57 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HB#  ) (RESID  58 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HG   ) (RESID  27 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HG   ) (RESID  42 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HG   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  27 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  42 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  42 AND NAME HD#  )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  42 AND NAME HE#  )  3.0 1.2 0.8
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  57 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  57 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  57 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  57 AND NAME HG#  )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  57 AND NAME HD#  )  4.0 2.2 1.5
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  58 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  29 AND NAME HN   ) (RESID  30 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  29 AND NAME HA   ) (RESID  30 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  30 AND NAME HN   ) (RESID  31 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HN   ) (RESID  31 AND NAME HA#  )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HN   ) (RESID  32 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  31 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  32 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  33 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  33 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  33 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  34 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  35 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  31 AND NAME HN   ) (RESID  32 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  31 AND NAME HN   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  32 AND NAME HN   ) (RESID  33 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  32 AND NAME HN   ) (RESID  33 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  32 AND NAME HN   ) (RESID  33 AND NAME HG#  )  4.5 2.7 1.5
ASSIGN (RESID  32 AND NAME HN   ) (RESID  34 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  32 AND NAME HN   ) (RESID  35 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  32 AND NAME HN   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  32 AND NAME HN   ) (RESID  36 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  33 AND NAME HN   ) (RESID  34 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  33 AND NAME HA   ) (RESID  35 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  33 AND NAME HG#  ) (RESID  34 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  33 AND NAME HG#  ) (RESID  35 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  34 AND NAME HN   ) (RESID  35 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  34 AND NAME HN   ) (RESID  35 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  34 AND NAME HN   ) (RESID  36 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  34 AND NAME HA   ) (RESID  36 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  34 AND NAME HB#  ) (RESID  36 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  35 AND NAME HN   ) (RESID  36 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  35 AND NAME HA   ) (RESID  36 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  35 AND NAME HA   ) (RESID  37 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  36 AND NAME HN   ) (RESID  36 AND NAME HG#  )  3.0 1.2 0.3
ASSIGN (RESID  36 AND NAME HN   ) (RESID  37 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  36 AND NAME HA   ) (RESID  37 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  36 AND NAME HG#  ) (RESID  37 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  37 AND NAME HN   ) (RESID  40 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  37 AND NAME HA   ) (RESID  40 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  38 AND NAME HA   ) (RESID  40 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  38 AND NAME HB#  ) (RESID  39 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  38 AND NAME HB#  ) (RESID  39 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  38 AND NAME HB#  ) (RESID  40 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  39 AND NAME HN   ) (RESID  40 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HN   ) (RESID  41 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HN   ) (RESID  41 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  40 AND NAME HN   ) (RESID  42 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HN   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HA   ) (RESID  41 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  40 AND NAME HA   ) (RESID  42 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HB#  ) (RESID  41 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HB#  ) (RESID  41 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  40 AND NAME HB#  ) (RESID  42 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  40 AND NAME HB#  ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  41 AND NAME HN   ) (RESID  42 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  41 AND NAME HA   ) (RESID  42 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  41 AND NAME HA   ) (RESID  42 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  41 AND NAME HB#  ) (RESID  42 AND NAME HD#  )  4.0 2.2 1.5
ASSIGN (RESID  42 AND NAME HN   ) (RESID  42 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  42 AND NAME HN   ) (RESID  43 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  42 AND NAME HB#  ) (RESID  43 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  42 AND NAME HB#  ) (RESID  44 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  42 AND NAME HD#  ) (RESID  43 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  42 AND NAME HD#  ) (RESID  44 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  42 AND NAME HD#  ) (RESID  45 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  43 AND NAME HA   ) (RESID  44 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  43 AND NAME HA   ) (RESID  45 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  44 AND NAME HN   ) (RESID  45 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  44 AND NAME HA   ) (RESID  45 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  44 AND NAME HA   ) (RESID  45 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  44 AND NAME HB   ) (RESID  45 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  44 AND NAME HG2# ) (RESID  45 AND NAME HN   )  3.0 1.2 0.8
ASSIGN (RESID  44 AND NAME HG2# ) (RESID  46 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  44 AND NAME HG2# ) (RESID  46 AND NAME HD#  )  4.0 2.2 1.5
ASSIGN (RESID  44 AND NAME HG2# ) (RESID  46 AND NAME HE#  )  4.0 2.2 1.5
ASSIGN (RESID  45 AND NAME HN   ) (RESID  58 AND NAME HB#  )  4.5 2.7 1.5
ASSIGN (RESID  45 AND NAME HA   ) (RESID  46 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  46 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  46 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  47 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  50 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  50 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  50 AND NAME HE22 )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  58 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  45 AND NAME HB#  ) (RESID  58 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HN   ) (RESID  47 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HN   ) (RESID  50 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HN   ) (RESID  50 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HB#  ) (RESID  47 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HB#  ) (RESID  48 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HB#  ) (RESID  49 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HB#  ) (RESID  50 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  46 AND NAME HB#  ) (RESID  50 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HB#  ) (RESID  50 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  47 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  48 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  48 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  48 AND NAME HG   )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  49 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  46 AND NAME HD#  ) (RESID  50 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HE#  ) (RESID  48 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HE#  ) (RESID  48 AND NAME HG   )  4.0 2.2 1.0
ASSIGN (RESID  46 AND NAME HE#  ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  46 AND NAME HE#  ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  47 AND NAME HA   ) (RESID  48 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  47 AND NAME HA   ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  47 AND NAME HB#  ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HN   ) (RESID  48 AND NAME HG   )  4.0 2.2 1.0
ASSIGN (RESID  48 AND NAME HN   ) (RESID  48 AND NAME HD*  )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HN   ) (RESID  49 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  48 AND NAME HN   ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HG   )  3.0 1.2 0.3
ASSIGN (RESID  48 AND NAME HA   ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HB#  ) (RESID  49 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  48 AND NAME HB#  ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HD*  ) (RESID  49 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HD*  ) (RESID  49 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  48 AND NAME HD*  ) (RESID  49 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  49 AND NAME HN   ) (RESID  50 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  49 AND NAME HN   ) (RESID  50 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  49 AND NAME HN   ) (RESID  50 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  49 AND NAME HA   ) (RESID  50 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  49 AND NAME HA   ) (RESID  61 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID  49 AND NAME HA   ) (RESID  61 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  49 AND NAME HA   ) (RESID  61 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  49 AND NAME HB   ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  49 AND NAME HG2# ) (RESID  50 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  49 AND NAME HG2# ) (RESID  61 AND NAME HB   )  4.0 2.2 1.5
ASSIGN (RESID  49 AND NAME HG2# ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  50 AND NAME HN   ) (RESID  50 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HN   ) (RESID  51 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HN   ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HN   ) (RESID  61 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HN   ) (RESID  61 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HN   ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  50 AND NAME HN   ) (RESID  61 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  50 AND NAME HA   ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HA   ) (RESID  61 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  50 AND NAME HA   ) (RESID  61 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HA   ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  50 AND NAME HA   ) (RESID  61 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HA   ) (RESID  61 AND NAME HD#  )  4.5 2.7 1.5
ASSIGN (RESID  50 AND NAME HB#  ) (RESID  59 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HB#  ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HG#  ) (RESID  51 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HG#  ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HG#  ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  50 AND NAME HE21 ) (RESID  58 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  50 AND NAME HE22 ) (RESID  58 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  52 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  59 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HN   ) (RESID  59 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  61 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HN   ) (RESID  61 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  51 AND NAME HN   ) (RESID  61 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  61 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  51 AND NAME HA   ) (RESID  52 AND NAME HN   )  2.4 0.6 0.3
ASSIGN (RESID  51 AND NAME HA   ) (RESID  59 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  53 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  59 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  59 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  59 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  59 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  59 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  60 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  61 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  61 AND NAME HB   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  61 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  51 AND NAME HB#  ) (RESID  64 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  52 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  53 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  59 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  59 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  59 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  59 AND NAME HD#  )  3.0 1.2 0.7
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  61 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  61 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  64 AND NAME HD#  )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  76 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HD#  ) (RESID  76 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  53 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  53 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  53 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  54 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  59 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  59 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  59 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  64 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  76 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  76 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HE#  ) (RESID  76 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  51 AND NAME HZ   ) (RESID  53 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HZ   ) (RESID  76 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  51 AND NAME HZ   ) (RESID  76 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HB   )  3.0 1.2 0.3
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HG2# )  3.0 1.2 0.8
ASSIGN (RESID  52 AND NAME HN   ) (RESID  53 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  52 AND NAME HN   ) (RESID  58 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  52 AND NAME HN   ) (RESID  59 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  52 AND NAME HA   ) (RESID  53 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  52 AND NAME HA   ) (RESID  53 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  52 AND NAME HB   ) (RESID  53 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  52 AND NAME HB   ) (RESID  59 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  52 AND NAME HG2# ) (RESID  53 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  52 AND NAME HG2# ) (RESID  56 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  52 AND NAME HG2# ) (RESID  56 AND NAME HA#  )  4.5 2.7 1.5
ASSIGN (RESID  52 AND NAME HG2# ) (RESID  57 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  52 AND NAME HG2# ) (RESID  58 AND NAME HA   )  4.0 2.2 1.5
ASSIGN (RESID  53 AND NAME HN   ) (RESID  54 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HN   ) (RESID  57 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HN   ) (RESID  57 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HN   ) (RESID  57 AND NAME HG#  )  4.5 2.7 1.5
ASSIGN (RESID  53 AND NAME HN   ) (RESID  58 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HN   ) (RESID  59 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HN   ) (RESID  59 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HA   ) (RESID  57 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HA   ) (RESID  57 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HA   ) (RESID  59 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  53 AND NAME HB#  ) (RESID  54 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HB#  ) (RESID  54 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HB#  ) (RESID  55 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HB#  ) (RESID  56 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  53 AND NAME HB#  ) (RESID  57 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  53 AND NAME HB#  ) (RESID  57 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HD22 )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HN   ) (RESID  55 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  56 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HN   ) (RESID  75 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  75 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  75 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HA   ) (RESID  54 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HA   ) (RESID  54 AND NAME HD22 )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HA   ) (RESID  56 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HB#  ) (RESID  75 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HD21 ) (RESID  75 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  54 AND NAME HD22 ) (RESID  75 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HA   )  2.4 0.6 0.3
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HN   ) (RESID  56 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  55 AND NAME HN   ) (RESID  57 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HN   ) (RESID  57 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HN   ) (RESID  73 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  55 AND NAME HA   ) (RESID  55 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HA   ) (RESID  55 AND NAME HD22 )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HB#  ) (RESID  57 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HD21 ) (RESID  57 AND NAME HD#  )  4.5 2.7 1.5
ASSIGN (RESID  55 AND NAME HD21 ) (RESID  73 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  55 AND NAME HD21 ) (RESID  73 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  55 AND NAME HD22 ) (RESID  73 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  56 AND NAME HN   ) (RESID  57 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  56 AND NAME HN   ) (RESID  57 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  56 AND NAME HN   ) (RESID  57 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  56 AND NAME HN   ) (RESID  57 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  56 AND NAME HA#  ) (RESID  57 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  57 AND NAME HN   ) (RESID  57 AND NAME HB#  )  2.4 0.6 0.3
ASSIGN (RESID  57 AND NAME HN   ) (RESID  57 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  57 AND NAME HN   ) (RESID  57 AND NAME HD#  )  3.0 1.2 0.3
ASSIGN (RESID  57 AND NAME HN   ) (RESID  58 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  57 AND NAME HN   ) (RESID  58 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  57 AND NAME HA   ) (RESID  57 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  57 AND NAME HA   ) (RESID  58 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  57 AND NAME HA   ) (RESID  58 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  57 AND NAME HG#  ) (RESID  58 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  57 AND NAME HG#  ) (RESID  58 AND NAME HB#  )  4.5 2.7 1.5
ASSIGN (RESID  57 AND NAME HD#  ) (RESID  58 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  58 AND NAME HN   ) (RESID  59 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  58 AND NAME HN   ) (RESID  59 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  58 AND NAME HA   ) (RESID  59 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  58 AND NAME HA   ) (RESID  59 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  58 AND NAME HB#  ) (RESID  59 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  59 AND NAME HN   ) (RESID  59 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  59 AND NAME HN   ) (RESID  59 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HA   ) (RESID  60 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  59 AND NAME HB   ) (RESID  60 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  59 AND NAME HB   ) (RESID  63 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  59 AND NAME HB   ) (RESID  63 AND NAME HE3  )  4.0 2.2 1.0
ASSIGN (RESID  59 AND NAME HG2# ) (RESID  63 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  59 AND NAME HG2# ) (RESID  63 AND NAME HE3  )  3.0 1.2 0.8
ASSIGN (RESID  59 AND NAME HG2# ) (RESID  70 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  59 AND NAME HG2# ) (RESID  71 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  59 AND NAME HG1# ) (RESID  60 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  59 AND NAME HG1# ) (RESID  63 AND NAME HE3  )  4.0 2.2 1.0
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  60 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  63 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  63 AND NAME HA   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  63 AND NAME HB#  )  3.0 1.2 0.7
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  63 AND NAME HD1  )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  63 AND NAME HE3  )  3.0 1.2 0.7
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  64 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  64 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  70 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  70 AND NAME HB#  )  3.0 1.2 0.7
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  71 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  76 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  76 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  59 AND NAME HD#  ) (RESID  76 AND NAME HB#  )  4.0 2.2 1.4
ASSIGN (RESID  60 AND NAME HN   ) (RESID  61 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  60 AND NAME HN   ) (RESID  63 AND NAME HE3  )  4.0 2.2 1.0
ASSIGN (RESID  60 AND NAME HN   ) (RESID  63 AND NAME HZ3  )  4.5 2.7 1.5
ASSIGN (RESID  60 AND NAME HA   ) (RESID  61 AND NAME HB   )  4.5 2.7 1.5
ASSIGN (RESID  60 AND NAME HA   ) (RESID  61 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  60 AND NAME HA   ) (RESID  62 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  60 AND NAME HB#  ) (RESID  62 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  60 AND NAME HB#  ) (RESID  63 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  60 AND NAME HB#  ) (RESID  63 AND NAME HD1  )  4.5 2.7 1.5
ASSIGN (RESID  60 AND NAME HB#  ) (RESID  63 AND NAME HE1  )  4.5 2.7 1.5
ASSIGN (RESID  60 AND NAME HB#  ) (RESID  63 AND NAME HZ2  )  4.0 2.2 1.0
ASSIGN (RESID  61 AND NAME HN   ) (RESID  61 AND NAME HB   )  2.4 0.6 0.3
ASSIGN (RESID  61 AND NAME HN   ) (RESID  61 AND NAME HG2# )  2.4 0.6 0.8
ASSIGN (RESID  61 AND NAME HN   ) (RESID  61 AND NAME HG1# )  4.0 2.2 1.0
ASSIGN (RESID  61 AND NAME HN   ) (RESID  61 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  61 AND NAME HN   ) (RESID  62 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  61 AND NAME HA   ) (RESID  61 AND NAME HD#  )  3.0 1.2 0.7
ASSIGN (RESID  61 AND NAME HA   ) (RESID  62 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  61 AND NAME HA   ) (RESID  63 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  61 AND NAME HA   ) (RESID  64 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  61 AND NAME HB   ) (RESID  62 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  61 AND NAME HG2# ) (RESID  62 AND NAME HN   )  3.0 1.2 0.8
ASSIGN (RESID  61 AND NAME HG2# ) (RESID  62 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  61 AND NAME HG2# ) (RESID  62 AND NAME HD21 )  4.0 2.2 1.5
ASSIGN (RESID  61 AND NAME HG2# ) (RESID  62 AND NAME HD22 )  4.0 2.2 1.5
ASSIGN (RESID  61 AND NAME HG2# ) (RESID  63 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  61 AND NAME HG1# ) (RESID  62 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  61 AND NAME HD#  ) (RESID  62 AND NAME HN   )  4.0 2.2 1.4
ASSIGN (RESID  61 AND NAME HD#  ) (RESID  64 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  62 AND NAME HN   ) (RESID  62 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  62 AND NAME HN   ) (RESID  62 AND NAME HD22 )  4.5 2.7 1.5
ASSIGN (RESID  62 AND NAME HN   ) (RESID  63 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  62 AND NAME HN   ) (RESID  63 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  62 AND NAME HN   ) (RESID  63 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  62 AND NAME HN   ) (RESID  63 AND NAME HD1  )  4.0 2.2 1.0
ASSIGN (RESID  62 AND NAME HN   ) (RESID  64 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  62 AND NAME HA   ) (RESID  63 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  62 AND NAME HA   ) (RESID  64 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  62 AND NAME HB#  ) (RESID  63 AND NAME HD1  )  4.5 2.7 1.5
ASSIGN (RESID  63 AND NAME HN   ) (RESID  63 AND NAME HD1  )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HN   ) (RESID  64 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HN   ) (RESID  64 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HN   ) (RESID  64 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HA   ) (RESID  63 AND NAME HD1  )  4.5 2.7 1.5
ASSIGN (RESID  63 AND NAME HA   ) (RESID  63 AND NAME HE3  )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HB#  ) (RESID  64 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HD1  ) (RESID  64 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  63 AND NAME HE3  ) (RESID  70 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HN   ) (RESID  64 AND NAME HB#  )  2.4 0.6 0.3
ASSIGN (RESID  64 AND NAME HN   ) (RESID  64 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HN   ) (RESID  64 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HN   ) (RESID  65 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HA   ) (RESID  64 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HA   ) (RESID  65 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  64 AND NAME HA   ) (RESID  76 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HB#  ) (RESID  76 AND NAME HB#  )  4.5 2.7 1.5
ASSIGN (RESID  64 AND NAME HG#  ) (RESID  65 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HD#  ) (RESID  65 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  64 AND NAME HD#  ) (RESID  76 AND NAME HA   )  4.5 2.7 1.5
ASSIGN (RESID  65 AND NAME HN   ) (RESID  66 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  65 AND NAME HA   ) (RESID  66 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  65 AND NAME HB#  ) (RESID  66 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  66 AND NAME HN   ) (RESID  67 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  66 AND NAME HN   ) (RESID  67 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  66 AND NAME HN   ) (RESID  68 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  67 AND NAME HN   ) (RESID  67 AND NAME HA   )  2.4 0.6 0.3
ASSIGN (RESID  67 AND NAME HN   ) (RESID  67 AND NAME HD22 )  4.5 2.7 1.5
ASSIGN (RESID  67 AND NAME HN   ) (RESID  68 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  67 AND NAME HA   ) (RESID  67 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  67 AND NAME HA   ) (RESID  67 AND NAME HD22 )  4.0 2.2 1.0
ASSIGN (RESID  68 AND NAME HN   ) (RESID  68 AND NAME HB#  )  2.4 0.6 0.3
ASSIGN (RESID  70 AND NAME HN   ) (RESID  71 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  70 AND NAME HB#  ) (RESID  71 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  71 AND NAME HN   ) (RESID  72 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  71 AND NAME HN   ) (RESID  72 AND NAME HA#  )  4.5 2.7 1.5
ASSIGN (RESID  71 AND NAME HN   ) (RESID  75 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  71 AND NAME HN   ) (RESID  76 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  71 AND NAME HB#  ) (RESID  72 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  71 AND NAME HB#  ) (RESID  73 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  71 AND NAME HB#  ) (RESID  74 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  72 AND NAME HN   ) (RESID  73 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  72 AND NAME HN   ) (RESID  74 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  72 AND NAME HA#  ) (RESID  74 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  73 AND NAME HN   ) (RESID  74 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  73 AND NAME HN   ) (RESID  75 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  74 AND NAME HN   ) (RESID  74 AND NAME HA   )  2.4 0.6 0.3
ASSIGN (RESID  74 AND NAME HN   ) (RESID  74 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  74 AND NAME HN   ) (RESID  75 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  74 AND NAME HN   ) (RESID  75 AND NAME HB#  )  4.5 2.7 1.5
ASSIGN (RESID  74 AND NAME HA   ) (RESID  74 AND NAME HD21 )  4.0 2.2 1.0
ASSIGN (RESID  74 AND NAME HA   ) (RESID  74 AND NAME HD22 )  4.0 2.2 1.0
ASSIGN (RESID  74 AND NAME HA   ) (RESID  75 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  75 AND NAME HN   ) (RESID  76 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  75 AND NAME HN   ) (RESID  77 AND NAME HN   )  4.5 2.7 1.5
ASSIGN (RESID  75 AND NAME HN   ) (RESID  78 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  75 AND NAME HA   ) (RESID  76 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  75 AND NAME HA   ) (RESID  77 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  75 AND NAME HB#  ) (RESID  77 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  75 AND NAME HB#  ) (RESID  78 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  75 AND NAME HB#  ) (RESID  78 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  76 AND NAME HN   ) (RESID  77 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  76 AND NAME HN   ) (RESID  78 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  76 AND NAME HB#  ) (RESID  77 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  77 AND NAME HN   ) (RESID  77 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  77 AND NAME HN   ) (RESID  78 AND NAME HN   )  2.4 0.6 0.3
ASSIGN (RESID  77 AND NAME HN   ) (RESID  78 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  77 AND NAME HA   ) (RESID  78 AND NAME HN   )  3.0 1.2 0.3
ASSIGN (RESID  77 AND NAME HG#  ) (RESID  78 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  82 AND NAME HA   ) (RESID  82 AND NAME HD2  )  4.0 2.2 1.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    SER   1          1HT       SER   1  34.029  -3.103  -6.014
    2   2H    SER   1          2HT       SER   1  34.306  -4.757  -6.267
    3   3H    SER   1          3HT       SER   1  35.010  -3.613  -7.298
    4    HA   SER   1           HA       SER   1  36.570  -4.574  -5.678
    5   1HB   SER   1          2HB       SER   1  36.032  -1.609  -5.360
    6   2HB   SER   1          1HB       SER   1  37.571  -2.430  -5.091
    7    HG   SER   1           HG       SER   1  37.598  -1.550  -7.135
    8    H    ALA   2           H        ALA   2  36.713  -5.433  -3.710
    9    HA   ALA   2           HA       ALA   2  34.763  -4.953  -1.691
   10   1HB   ALA   2          1HB       ALA   2  36.129  -6.434  -0.299
   11   2HB   ALA   2          2HB       ALA   2  37.419  -6.377  -1.503
   12   3HB   ALA   2          3HB       ALA   2  35.871  -7.118  -1.905
   13    H    ARG   3           H        ARG   3  34.753  -3.465  -0.135
   14    HA   ARG   3           HA       ARG   3  35.358  -1.772   1.247
   15   1HB   ARG   3          2HB       ARG   3  37.127  -2.970   2.213
   16   2HB   ARG   3          1HB       ARG   3  38.058  -2.981   0.726
   17   1HG   ARG   3          2HG       ARG   3  38.443  -0.537   1.016
   18   2HG   ARG   3          1HG       ARG   3  37.635  -0.645   2.581
   19   1HD   ARG   3          2HD       ARG   3  40.218  -0.800   2.494
   20   2HD   ARG   3          1HD       ARG   3  39.330  -1.931   3.515
   21    HE   ARG   3           HE       ARG   3  39.614  -3.592   1.745
   22   1HH1  ARG   3          1HH1      ARG   3  41.701  -0.776   1.586
   23   2HH1  ARG   3          2HH1      ARG   3  42.965  -1.631   0.754
   24   1HH2  ARG   3          1HH2      ARG   3  41.286  -4.679   0.644
   25   2HH2  ARG   3          2HH2      ARG   3  42.726  -3.819   0.200
   26    H    THR   4           H        THR   4  38.072  -1.638  -1.036
   27    HA   THR   4           HA       THR   4  37.019   0.542  -2.544
   28    HB   THR   4           HB       THR   4  39.416   1.231  -0.822
   29    HG1  THR   4           HG1      THR   4  36.682   1.454  -0.256
   30   1HG2  THR   4          1HG2      THR   4  38.939   3.516  -1.569
   31   2HG2  THR   4          2HG2      THR   4  37.559   2.933  -2.502
   32   3HG2  THR   4          3HG2      THR   4  39.194   2.440  -2.943
   33    H    CYS   5           H        CYS   5  40.159  -0.339  -1.354
   34    HA   CYS   5           HA       CYS   5  41.249  -0.682  -4.023
   35   1HB   CYS   5          2HB       CYS   5  42.308   0.488  -1.911
   36   2HB   CYS   5          1HB       CYS   5  42.718  -1.150  -1.435
   37    HA   PRO   6           HA       PRO   6  40.645  -5.075  -4.316
   38   1HB   PRO   6          2HB       PRO   6  43.569  -5.175  -4.938
   39   2HB   PRO   6          1HB       PRO   6  42.210  -5.906  -5.799
   40   1HG   PRO   6          2HG       PRO   6  43.348  -3.721  -6.746
   41   2HG   PRO   6          1HG       PRO   6  41.581  -3.889  -6.783
   42   1HD   PRO   6          2HD       PRO   6  43.299  -2.260  -4.962
   43   2HD   PRO   6          1HD       PRO   6  41.698  -1.887  -5.633
   44    HA   PRO   7           HA       PRO   7  41.668  -7.253  -0.644
   45   1HB   PRO   7          2HB       PRO   7  42.767  -9.616  -1.703
   46   2HB   PRO   7          1HB       PRO   7  41.069  -9.316  -1.328
   47   1HG   PRO   7          2HG       PRO   7  42.494  -9.139  -3.937
   48   2HG   PRO   7          1HG       PRO   7  40.838  -9.668  -3.589
   49   1HD   PRO   7          2HD       PRO   7  41.312  -7.264  -4.658
   50   2HD   PRO   7          1HD       PRO   7  40.038  -7.486  -3.439
   51    H    ASN   8           H        ASN   8  44.259  -7.837  -3.036
   52    HA   ASN   8           HA       ASN   8  46.265  -7.874  -0.934
   53   1HB   ASN   8          2HB       ASN   8  46.172  -9.367  -3.076
   54   2HB   ASN   8          1HB       ASN   8  46.872  -7.965  -3.877
   55   1HD2  ASN   8          1HD2      ASN   8  48.992  -7.335  -3.349
   56   2HD2  ASN   8          2HD2      ASN   8  50.069  -8.393  -2.511
   57    H    GLN   9           H        GLN   9  44.772  -5.433  -1.490
   58    HA   GLN   9           HA       GLN   9  46.953  -3.635  -2.220
   59   1HB   GLN   9          2HB       GLN   9  44.640  -4.154  -3.805
   60   2HB   GLN   9          1HB       GLN   9  44.516  -2.521  -3.176
   61   1HG   GLN   9          2HG       GLN   9  45.585  -2.374  -5.265
   62   2HG   GLN   9          1HG       GLN   9  46.821  -2.106  -4.039
   63   1HE2  GLN   9          1HE2      GLN   9  45.540  -5.270  -4.797
   64   2HE2  GLN   9          2HE2      GLN   9  46.966  -5.888  -5.535
   65    H    PHE  10           H        PHE  10  46.837  -1.626  -1.266
   66    HA   PHE  10           HA       PHE  10  45.059  -1.541   1.062
   67   1HB   PHE  10          2HB       PHE  10  47.223  -1.841   1.895
   68   2HB   PHE  10          1HB       PHE  10  47.938  -0.776   0.692
   69    HD1  PHE  10           HD1      PHE  10  45.758  -0.795   3.702
   70    HD2  PHE  10           HD2      PHE  10  48.332   1.457   1.165
   71    HE1  PHE  10           HE1      PHE  10  45.683   1.094   5.296
   72    HE2  PHE  10           HE2      PHE  10  48.272   3.331   2.746
   73    HZ   PHE  10           HZ       PHE  10  46.933   3.173   4.798
   74    H    SER  11           H        SER  11  43.912   0.203   1.404
   75    HA   SER  11           HA       SER  11  44.082   2.433  -0.412
   76   1HB   SER  11          2HB       SER  11  41.738   2.901   0.516
   77   2HB   SER  11          1HB       SER  11  41.909   1.445  -0.469
   78    HG   SER  11           HG       SER  11  41.748   1.667   2.346
   79    H    CYS  12           H        CYS  12  45.371   3.927   0.402
   80    HA   CYS  12           HA       CYS  12  46.196   4.117   3.047
   81   1HB   CYS  12          2HB       CYS  12  47.502   4.984   1.171
   82   2HB   CYS  12          1HB       CYS  12  46.277   6.223   0.880
   83    H    ALA  13           H        ALA  13  45.128   7.089   1.821
   84    HA   ALA  13           HA       ALA  13  43.446   7.720   4.021
   85   1HB   ALA  13          1HB       ALA  13  43.960   9.088   1.377
   86   2HB   ALA  13          2HB       ALA  13  44.701   9.462   2.936
   87   3HB   ALA  13          3HB       ALA  13  42.983   9.781   2.675
   88    H    SER  14           H        SER  14  42.623   5.353   2.749
   89    HA   SER  14           HA       SER  14  40.863   4.211   1.947
   90   1HB   SER  14          2HB       SER  14  39.319   6.801   2.182
   91   2HB   SER  14          1HB       SER  14  38.637   5.180   2.036
   92    HG   SER  14           HG       SER  14  39.559   6.471   4.236
   93    H    GLY  15           H        GLY  15  41.138   7.420   0.434
   94   1HA   GLY  15          2HA       GLY  15  39.941   6.475  -2.021
   95   2HA   GLY  15          1HA       GLY  15  40.594   8.080  -1.725
   96    H    ARG  16           H        ARG  16  43.156   6.723  -0.751
   97    HA   ARG  16           HA       ARG  16  44.346   6.546  -3.400
   98   1HB   ARG  16          2HB       ARG  16  45.290   7.964  -1.527
   99   2HB   ARG  16          1HB       ARG  16  45.718   6.466  -0.712
  100   1HG   ARG  16          2HG       ARG  16  47.205   5.860  -2.487
  101   2HG   ARG  16          1HG       ARG  16  46.678   7.241  -3.452
  102   1HD   ARG  16          2HD       ARG  16  47.618   8.780  -1.862
  103   2HD   ARG  16          1HD       ARG  16  48.009   7.460  -0.758
  104    HE   ARG  16           HE       ARG  16  49.387   8.113  -3.255
  105   1HH1  ARG  16          1HH1      ARG  16  49.122   6.172  -0.379
  106   2HH1  ARG  16          2HH1      ARG  16  50.642   5.352  -0.609
  107   1HH2  ARG  16          1HH2      ARG  16  51.397   7.029  -3.592
  108   2HH2  ARG  16          2HH2      ARG  16  51.920   5.823  -2.447
  109    H    CYS  17           H        CYS  17  45.332   4.663  -4.177
  110    HA   CYS  17           HA       CYS  17  44.689   2.227  -2.683
  111   1HB   CYS  17          2HB       CYS  17  42.843   2.721  -4.208
  112   2HB   CYS  17          1HB       CYS  17  43.958   2.840  -5.557
  113    H    ILE  18           H        ILE  18  46.611   1.407  -2.337
  114    HA   ILE  18           HA       ILE  18  48.588   1.257  -4.527
  115    HB   ILE  18           HB       ILE  18  50.326   1.879  -3.007
  116   1HG1  ILE  18          2HG1      ILE  18  48.299   1.617  -0.780
  117   2HG1  ILE  18          1HG1      ILE  18  49.522   0.405  -1.160
  118   1HG2  ILE  18          1HG2      ILE  18  48.861   3.774  -3.646
  119   2HG2  ILE  18          2HG2      ILE  18  49.569   3.999  -2.048
  120   3HG2  ILE  18          3HG2      ILE  18  47.888   3.479  -2.198
  121   1HD1  ILE  18          1HD1      ILE  18  50.296   1.674   0.681
  122   2HD1  ILE  18          2HD1      ILE  18  49.953   3.190  -0.146
  123   3HD1  ILE  18          3HD1      ILE  18  51.254   2.150  -0.724
  124    HA   PRO  19           HA       PRO  19  48.821  -3.070  -3.317
  125   1HB   PRO  19          2HB       PRO  19  51.744  -3.092  -3.435
  126   2HB   PRO  19          1HB       PRO  19  50.577  -3.907  -4.481
  127   1HG   PRO  19          2HG       PRO  19  52.089  -1.824  -5.322
  128   2HG   PRO  19          1HG       PRO  19  50.458  -2.137  -5.943
  129   1HD   PRO  19          2HD       PRO  19  51.361  -0.131  -3.910
  130   2HD   PRO  19          1HD       PRO  19  50.158   0.040  -5.208
  131    H    ILE  20           H        ILE  20  49.169  -4.359  -1.466
  132    HA   ILE  20           HA       ILE  20  49.865  -2.858   0.891
  133    HB   ILE  20           HB       ILE  20  49.263  -5.790   0.742
  134   1HG1  ILE  20          2HG1      ILE  20  47.462  -3.392   0.991
  135   2HG1  ILE  20          1HG1      ILE  20  47.334  -4.731  -0.142
  136   1HG2  ILE  20          1HG2      ILE  20  49.219  -3.820   3.025
  137   2HG2  ILE  20          2HG2      ILE  20  50.360  -5.145   2.796
  138   3HG2  ILE  20          3HG2      ILE  20  48.661  -5.491   3.129
  139   1HD1  ILE  20          1HD1      ILE  20  46.757  -4.787   2.810
  140   2HD1  ILE  20          2HD1      ILE  20  46.757  -6.209   1.763
  141   3HD1  ILE  20          3HD1      ILE  20  45.596  -4.910   1.484
  142    H    SER  21           H        SER  21  51.704  -2.654   1.677
  143    HA   SER  21           HA       SER  21  53.675  -4.063   2.589
  144   1HB   SER  21          2HB       SER  21  53.846  -5.363   0.413
  145   2HB   SER  21          1HB       SER  21  54.353  -3.867  -0.371
  146    HG   SER  21           HG       SER  21  56.273  -4.095   0.461
  147    H    TRP  22           H        TRP  22  52.653  -1.726   0.429
  148    HA   TRP  22           HA       TRP  22  54.825   0.161   0.799
  149   1HB   TRP  22          2HB       TRP  22  52.069   0.527  -0.385
  150   2HB   TRP  22          1HB       TRP  22  53.362   1.710  -0.464
  151    HD1  TRP  22           HD1      TRP  22  53.247  -2.058  -1.444
  152    HE1  TRP  22           HE1      TRP  22  54.100  -2.242  -3.852
  153    HE3  TRP  22           HE3      TRP  22  54.104   2.892  -2.389
  154    HZ2  TRP  22           HZ2      TRP  22  55.037  -0.531  -5.891
  155    HZ3  TRP  22           HZ3      TRP  22  54.986   3.534  -4.600
  156    HH2  TRP  22           HH2      TRP  22  55.438   1.858  -6.311
  157    H    THR  23           H        THR  23  52.288  -0.865   2.662
  158    HA   THR  23           HA       THR  23  51.136   1.471   3.670
  159    HB   THR  23           HB       THR  23  50.405   0.099   5.562
  160    HG1  THR  23           HG1      THR  23  51.806  -1.368   6.185
  161   1HG2  THR  23          1HG2      THR  23  49.242  -1.663   4.344
  162   2HG2  THR  23          2HG2      THR  23  50.352  -1.479   2.987
  163   3HG2  THR  23          3HG2      THR  23  49.248  -0.170   3.406
  164    H    CYS  24           H        CYS  24  53.475  -0.595   5.196
  165    HA   CYS  24           HA       CYS  24  54.511   1.553   6.795
  166   1HB   CYS  24          2HB       CYS  24  55.089  -1.408   6.746
  167   2HB   CYS  24          1HB       CYS  24  55.818  -0.266   7.875
  168    H    ASP  25           H        ASP  25  55.566   2.798   5.227
  169    HA   ASP  25           HA       ASP  25  57.775   1.462   3.787
  170   1HB   ASP  25          2HB       ASP  25  55.881   2.008   2.305
  171   2HB   ASP  25          1HB       ASP  25  55.992   3.694   2.789
  172    H    LEU  26           H        LEU  26  56.729   4.075   5.731
  173    HA   LEU  26           HA       LEU  26  57.836   5.656   6.872
  174   1HB   LEU  26          2HB       LEU  26  60.238   4.441   5.552
  175   2HB   LEU  26          1HB       LEU  26  60.367   5.977   6.387
  176    HG   LEU  26           HG       LEU  26  59.407   3.412   7.662
  177   1HD1  LEU  26          1HD1      LEU  26  61.574   3.450   8.823
  178   2HD1  LEU  26          2HD1      LEU  26  62.073   4.809   7.816
  179   3HD1  LEU  26          3HD1      LEU  26  61.748   3.239   7.083
  180   1HD2  LEU  26          1HD2      LEU  26  59.648   4.650   9.752
  181   2HD2  LEU  26          2HD2      LEU  26  58.485   5.435   8.685
  182   3HD2  LEU  26          3HD2      LEU  26  60.110   6.098   8.852
  183    H    ASP  27           H        ASP  27  56.439   6.932   5.664
  184    HA   ASP  27           HA       ASP  27  56.144   9.043   4.885
  185   1HB   ASP  27          2HB       ASP  27  59.095   8.815   4.535
  186   2HB   ASP  27          1HB       ASP  27  58.245  10.166   3.793
  187    H    ASP  28           H        ASP  28  58.360   7.377   2.599
  188    HA   ASP  28           HA       ASP  28  57.913   9.171   0.571
  189   1HB   ASP  28          2HB       ASP  28  59.665   7.258   0.793
  190   2HB   ASP  28          1HB       ASP  28  58.503   6.334  -0.160
  191    H    ASP  29           H        ASP  29  56.137   6.038   0.919
  192    HA   ASP  29           HA       ASP  29  54.705   6.399  -1.464
  193   1HB   ASP  29          2HB       ASP  29  54.762   4.195  -0.617
  194   2HB   ASP  29          1HB       ASP  29  54.141   4.707   0.951
  195    H    CYS  30           H        CYS  30  53.268   6.587   1.772
  196    HA   CYS  30           HA       CYS  30  51.413   8.567   0.642
  197   1HB   CYS  30          2HB       CYS  30  50.690   6.174   1.629
  198   2HB   CYS  30          1HB       CYS  30  50.641   7.116   3.115
  199    H    GLY  31           H        GLY  31  52.723   7.631   3.879
  200   1HA   GLY  31          2HA       GLY  31  54.353   9.714   4.315
  201   2HA   GLY  31          1HA       GLY  31  52.786  10.463   4.565
  202    H    ASP  32           H        ASP  32  51.373   8.651   6.003
  203    HA   ASP  32           HA       ASP  32  52.452   7.687   8.330
  204   1HB   ASP  32          2HB       ASP  32  53.667   9.540   8.977
  205   2HB   ASP  32          1HB       ASP  32  52.564  10.666   8.198
  206    H    ARG  33           H        ARG  33  50.086   9.847   6.976
  207    HA   ARG  33           HA       ARG  33  48.322  10.359   8.943
  208   1HB   ARG  33          2HB       ARG  33  47.565   9.631   6.116
  209   2HB   ARG  33          1HB       ARG  33  46.600  10.587   7.229
  210   1HG   ARG  33          2HG       ARG  33  49.333  11.399   6.255
  211   2HG   ARG  33          1HG       ARG  33  47.820  11.904   5.504
  212   1HD   ARG  33          2HD       ARG  33  48.523  13.662   6.952
  213   2HD   ARG  33          1HD       ARG  33  47.141  12.871   7.704
  214    HE   ARG  33           HE       ARG  33  49.511  11.709   8.691
  215   1HH1  ARG  33          1HH1      ARG  33  47.780  14.757   8.810
  216   2HH1  ARG  33          2HH1      ARG  33  48.319  15.142  10.422
  217   1HH2  ARG  33          1HH2      ARG  33  50.257  12.213  10.767
  218   2HH2  ARG  33          2HH2      ARG  33  49.743  13.702  11.522
  219    H    SER  34           H        SER  34  47.858   7.575   6.758
  220    HA   SER  34           HA       SER  34  46.619   6.165   9.021
  221   1HB   SER  34          2HB       SER  34  45.103   5.105   7.247
  222   2HB   SER  34          1HB       SER  34  44.763   6.772   7.704
  223    HG   SER  34           HG       SER  34  45.004   6.018   5.320
  224    H    ASP  35           H        ASP  35  48.681   6.130   6.287
  225    HA   ASP  35           HA       ASP  35  48.853   3.355   5.866
  226   1HB   ASP  35          2HB       ASP  35  51.027   4.002   4.688
  227   2HB   ASP  35          1HB       ASP  35  49.539   4.712   4.068
  228    H    GLU  36           H        GLU  36  50.528   5.539   7.970
  229    HA   GLU  36           HA       GLU  36  52.256   3.347   8.888
  230   1HB   GLU  36          2HB       GLU  36  52.502   6.326   9.347
  231   2HB   GLU  36          1HB       GLU  36  53.630   5.116   9.933
  232   1HG   GLU  36          2HG       GLU  36  53.064   5.462   7.008
  233   2HG   GLU  36          1HG       GLU  36  54.254   6.448   7.852
  234    H    SER  37           H        SER  37  49.447   4.954   9.690
  235    HA   SER  37           HA       SER  37  49.903   4.644  12.575
  236   1HB   SER  37          2HB       SER  37  47.965   6.420  11.092
  237   2HB   SER  37          1HB       SER  37  48.015   6.249  12.845
  238    HG   SER  37           HG       SER  37  49.920   7.396  11.106
  239    H    ALA  38           H        ALA  38  48.567   2.869  10.200
  240    HA   ALA  38           HA       ALA  38  46.419   1.927  11.986
  241   1HB   ALA  38          1HB       ALA  38  45.431   3.141  10.117
  242   2HB   ALA  38          2HB       ALA  38  45.016   1.428  10.058
  243   3HB   ALA  38          3HB       ALA  38  46.255   2.074   8.983
  244    H    SER  39           H        SER  39  49.272   1.033  11.300
  245    HA   SER  39           HA       SER  39  48.767  -1.755  11.434
  246   1HB   SER  39          2HB       SER  39  49.901  -2.344   9.253
  247   2HB   SER  39          1HB       SER  39  48.312  -1.599   9.073
  248    HG   SER  39           HG       SER  39  50.861  -0.465   8.621
  249    H    CYS  40           H        CYS  40  51.082   0.736  10.553
  250    HA   CYS  40           HA       CYS  40  53.398  -0.742  10.927
  251   1HB   CYS  40          2HB       CYS  40  52.969   2.234  11.039
  252   2HB   CYS  40          1HB       CYS  40  54.513   1.418  10.780
  253    H    ALA  41           H        ALA  41  54.077  -1.629  12.646
  254    HA   ALA  41           HA       ALA  41  54.792   0.033  14.922
  255   1HB   ALA  41          1HB       ALA  41  53.333  -2.606  15.199
  256   2HB   ALA  41          2HB       ALA  41  52.724  -1.022  15.681
  257   3HB   ALA  41          3HB       ALA  41  54.102  -1.733  16.522
  258    H    TYR  42           H        TYR  42  56.341  -0.674  12.844
  259    HA   TYR  42           HA       TYR  42  57.409  -3.365  13.197
  260   1HB   TYR  42          2HB       TYR  42  58.429  -2.947  10.952
  261   2HB   TYR  42          1HB       TYR  42  56.671  -2.870  10.985
  262    HD1  TYR  42           HD1      TYR  42  55.520  -0.876  10.445
  263    HD2  TYR  42           HD2      TYR  42  59.755  -0.834  10.761
  264    HE1  TYR  42           HE1      TYR  42  55.574   1.334   9.381
  265    HE2  TYR  42           HE2      TYR  42  59.818   1.386   9.704
  266    HH   TYR  42           HH       TYR  42  56.837   3.147   8.949
  267    HA   PRO  43           HA       PRO  43  61.561  -1.749  13.836
  268   1HB   PRO  43          2HB       PRO  43  62.597  -3.990  14.861
  269   2HB   PRO  43          1HB       PRO  43  61.488  -2.994  15.812
  270   1HG   PRO  43          2HG       PRO  43  61.042  -5.630  14.558
  271   2HG   PRO  43          1HG       PRO  43  60.194  -4.874  15.916
  272   1HD   PRO  43          2HD       PRO  43  59.419  -4.958  13.124
  273   2HD   PRO  43          1HD       PRO  43  58.509  -4.310  14.504
  274    H    THR  44           H        THR  44  60.298  -3.297  11.383
  275    HA   THR  44           HA       THR  44  62.808  -4.269  10.237
  276    HB   THR  44           HB       THR  44  61.739  -6.211  11.330
  277    HG1  THR  44           HG1      THR  44  61.946  -6.116   8.510
  278   1HG2  THR  44          1HG2      THR  44  59.450  -5.691   9.419
  279   2HG2  THR  44          2HG2      THR  44  59.398  -5.519  11.174
  280   3HG2  THR  44          3HG2      THR  44  59.623  -7.112  10.449
  281    H    CYS  45           H        CYS  45  60.876  -2.014   9.731
  282    HA   CYS  45           HA       CYS  45  59.888  -0.908   8.019
  283   1HB   CYS  45          2HB       CYS  45  61.086  -2.940   6.143
  284   2HB   CYS  45          1HB       CYS  45  60.603  -1.281   5.772
  285    H    PHE  46           H        PHE  46  59.666  -3.984   6.346
  286    HA   PHE  46           HA       PHE  46  57.112  -4.652   7.355
  287   1HB   PHE  46          2HB       PHE  46  56.829  -2.608   5.654
  288   2HB   PHE  46          1HB       PHE  46  56.835  -3.930   4.486
  289    HD1  PHE  46           HD1      PHE  46  55.505  -3.920   7.937
  290    HD2  PHE  46           HD2      PHE  46  54.610  -4.027   3.784
  291    HE1  PHE  46           HE1      PHE  46  53.155  -4.376   8.473
  292    HE2  PHE  46           HE2      PHE  46  52.251  -4.485   4.304
  293    HZ   PHE  46           HZ       PHE  46  51.516  -4.662   6.652
  294    HA   PRO  47           HA       PRO  47  58.952  -8.304   5.663
  295   1HB   PRO  47          2HB       PRO  47  57.447 -10.092   6.967
  296   2HB   PRO  47          1HB       PRO  47  58.627  -9.083   7.815
  297   1HG   PRO  47          2HG       PRO  47  55.660  -8.777   7.618
  298   2HG   PRO  47          1HG       PRO  47  56.719  -8.549   9.020
  299   1HD   PRO  47          2HD       PRO  47  55.757  -6.500   7.441
  300   2HD   PRO  47          1HD       PRO  47  57.224  -6.402   8.436
  301    H    LEU  48           H        LEU  48  56.684  -6.938   4.155
  302    HA   LEU  48           HA       LEU  48  55.409  -9.316   3.026
  303   1HB   LEU  48          2HB       LEU  48  54.845  -6.371   2.639
  304   2HB   LEU  48          1HB       LEU  48  54.134  -7.609   1.620
  305    HG   LEU  48           HG       LEU  48  53.693  -7.184   4.566
  306   1HD1  LEU  48          1HD1      LEU  48  51.361  -6.972   3.887
  307   2HD1  LEU  48          2HD1      LEU  48  51.820  -7.245   2.206
  308   3HD1  LEU  48          3HD1      LEU  48  52.376  -5.797   3.048
  309   1HD2  LEU  48          1HD2      LEU  48  52.269  -9.183   4.513
  310   2HD2  LEU  48          2HD2      LEU  48  53.960  -9.573   4.201
  311   3HD2  LEU  48          3HD2      LEU  48  52.810  -9.515   2.866
  312    H    THR  49           H        THR  49  56.824  -6.348   1.658
  313    HA   THR  49           HA       THR  49  58.772  -7.742   0.166
  314    HB   THR  49           HB       THR  49  57.026  -8.508  -1.244
  315    HG1  THR  49           HG1      THR  49  58.178  -6.219  -2.475
  316   1HG2  THR  49          1HG2      THR  49  56.009  -5.676  -1.493
  317   2HG2  THR  49          2HG2      THR  49  55.261  -6.946  -0.525
  318   3HG2  THR  49          3HG2      THR  49  55.339  -7.105  -2.281
  319    H    GLN  50           H        GLN  50  60.104  -6.216   1.033
  320    HA   GLN  50           HA       GLN  50  60.056  -3.517  -0.036
  321   1HB   GLN  50          2HB       GLN  50  59.756  -4.155   2.908
  322   2HB   GLN  50          1HB       GLN  50  60.355  -2.606   2.338
  323   1HG   GLN  50          2HG       GLN  50  57.696  -3.704   1.500
  324   2HG   GLN  50          1HG       GLN  50  57.912  -2.747   2.966
  325   1HE2  GLN  50          1HE2      GLN  50  58.391  -0.573   2.800
  326   2HE2  GLN  50          2HE2      GLN  50  58.222   0.319   1.325
  327    H    PHE  51           H        PHE  51  62.075  -2.329   0.669
  328    HA   PHE  51           HA       PHE  51  64.227  -4.201   1.429
  329   1HB   PHE  51          2HB       PHE  51  64.437  -3.411  -0.931
  330   2HB   PHE  51          1HB       PHE  51  64.502  -1.754  -0.343
  331    HD1  PHE  51           HD1      PHE  51  66.609  -0.801  -0.135
  332    HD2  PHE  51           HD2      PHE  51  66.213  -5.019   0.257
  333    HE1  PHE  51           HE1      PHE  51  69.030  -0.992   0.152
  334    HE2  PHE  51           HE2      PHE  51  68.647  -5.219   0.528
  335    HZ   PHE  51           HZ       PHE  51  70.062  -3.200   0.476
  336    H    THR  52           H        THR  52  65.884  -3.315   2.782
  337    HA   THR  52           HA       THR  52  64.930  -1.034   4.359
  338    HB   THR  52           HB       THR  52  66.940  -3.149   5.172
  339    HG1  THR  52           HG1      THR  52  64.300  -2.964   6.174
  340   1HG2  THR  52          1HG2      THR  52  65.445  -1.084   6.786
  341   2HG2  THR  52          2HG2      THR  52  67.157  -1.022   6.371
  342   3HG2  THR  52          3HG2      THR  52  66.550  -2.295   7.431
  343    H    CYS  53           H        CYS  53  65.807   0.700   3.417
  344    HA   CYS  53           HA       CYS  53  68.293   1.004   2.235
  345   1HB   CYS  53          2HB       CYS  53  66.487   2.647   2.145
  346   2HB   CYS  53          1HB       CYS  53  66.731   3.010   3.849
  347    H    ASN  54           H        ASN  54  70.331   1.623   2.963
  348    HA   ASN  54           HA       ASN  54  70.914   0.543   5.573
  349   1HB   ASN  54          2HB       ASN  54  72.623   1.423   3.261
  350   2HB   ASN  54          1HB       ASN  54  73.327   0.998   4.818
  351   1HD2  ASN  54          1HD2      ASN  54  71.341  -0.222   2.174
  352   2HD2  ASN  54          2HD2      ASN  54  71.721  -1.888   2.429
  353    H    ASN  55           H        ASN  55  70.497   3.676   4.241
  354    HA   ASN  55           HA       ASN  55  71.968   5.123   6.161
  355   1HB   ASN  55          2HB       ASN  55  71.105   6.065   4.026
  356   2HB   ASN  55          1HB       ASN  55  69.474   5.973   4.674
  357   1HD2  ASN  55          1HD2      ASN  55  72.586   7.524   4.967
  358   2HD2  ASN  55          2HD2      ASN  55  72.029   8.908   5.838
  359    H    GLY  56           H        GLY  56  69.262   3.179   6.481
  360   1HA   GLY  56          2HA       GLY  56  68.455   2.756   8.745
  361   2HA   GLY  56          1HA       GLY  56  68.540   4.491   9.027
  362    H    ARG  57           H        ARG  57  67.477   4.206   5.988
  363    HA   ARG  57           HA       ARG  57  64.712   4.688   6.751
  364   1HB   ARG  57          2HB       ARG  57  65.749   4.647   3.932
  365   2HB   ARG  57          1HB       ARG  57  64.429   5.592   4.608
  366   1HG   ARG  57          2HG       ARG  57  65.840   7.179   5.487
  367   2HG   ARG  57          1HG       ARG  57  67.222   6.079   5.539
  368   1HD   ARG  57          2HD       ARG  57  67.210   6.066   3.046
  369   2HD   ARG  57          1HD       ARG  57  65.977   7.326   3.092
  370    HE   ARG  57           HE       ARG  57  68.017   8.321   4.610
  371   1HH1  ARG  57          1HH1      ARG  57  67.778   7.087   1.341
  372   2HH1  ARG  57          2HH1      ARG  57  69.074   8.070   0.739
  373   1HH2  ARG  57          1HH2      ARG  57  69.726   9.631   3.798
  374   2HH2  ARG  57          2HH2      ARG  57  70.178   9.503   2.127
  375    H    CYS  58           H        CYS  58  62.972   3.587   5.524
  376    HA   CYS  58           HA       CYS  58  63.769   0.964   4.467
  377   1HB   CYS  58          2HB       CYS  58  61.101   1.892   5.570
  378   2HB   CYS  58          1HB       CYS  58  61.450   0.275   4.953
  379    H    ILE  59           H        ILE  59  63.033   0.421   2.384
  380    HA   ILE  59           HA       ILE  59  61.582   2.528   0.981
  381    HB   ILE  59           HB       ILE  59  63.090   2.333  -0.989
  382   1HG1  ILE  59          2HG1      ILE  59  65.017   1.051   0.957
  383   2HG1  ILE  59          1HG1      ILE  59  64.132   0.169  -0.286
  384   1HG2  ILE  59          1HG2      ILE  59  64.848   3.800  -0.069
  385   2HG2  ILE  59          2HG2      ILE  59  64.292   3.404   1.557
  386   3HG2  ILE  59          3HG2      ILE  59  63.224   4.261   0.447
  387   1HD1  ILE  59          1HD1      ILE  59  65.234   1.384  -2.031
  388   2HD1  ILE  59          2HD1      ILE  59  66.455   0.747  -0.921
  389   3HD1  ILE  59          3HD1      ILE  59  66.003   2.448  -0.849
  390    H    ASN  60           H        ASN  60  60.771   1.849  -1.149
  391    HA   ASN  60           HA       ASN  60  59.501  -0.672  -0.961
  392   1HB   ASN  60          2HB       ASN  60  58.502   1.290  -2.101
  393   2HB   ASN  60          1HB       ASN  60  59.704   1.133  -3.379
  394   1HD2  ASN  60          1HD2      ASN  60  56.984  -0.383  -1.818
  395   2HD2  ASN  60          2HD2      ASN  60  56.539  -1.390  -3.153
  396    H    ILE  61           H        ILE  61  59.748  -2.535  -2.172
  397    HA   ILE  61           HA       ILE  61  62.469  -3.284  -2.463
  398    HB   ILE  61           HB       ILE  61  60.588  -4.742  -1.643
  399   1HG1  ILE  61          2HG1      ILE  61  61.507  -6.803  -2.620
  400   2HG1  ILE  61          1HG1      ILE  61  62.272  -5.866  -3.900
  401   1HG2  ILE  61          1HG2      ILE  61  59.307  -5.970  -3.355
  402   2HG2  ILE  61          2HG2      ILE  61  60.001  -4.932  -4.599
  403   3HG2  ILE  61          3HG2      ILE  61  58.953  -4.244  -3.359
  404   1HD1  ILE  61          1HD1      ILE  61  63.881  -6.505  -2.208
  405   2HD1  ILE  61          2HD1      ILE  61  62.910  -5.721  -0.964
  406   3HD1  ILE  61          3HD1      ILE  61  63.671  -4.755  -2.226
  407    H    ASN  62           H        ASN  62  60.480  -1.756  -4.695
  408    HA   ASN  62           HA       ASN  62  61.551  -3.258  -6.985
  409   1HB   ASN  62          2HB       ASN  62  59.030  -2.878  -6.630
  410   2HB   ASN  62          1HB       ASN  62  59.338  -1.219  -7.124
  411   1HD2  ASN  62          1HD2      ASN  62  59.392  -4.559  -8.143
  412   2HD2  ASN  62          2HD2      ASN  62  59.375  -4.240  -9.839
  413    H    TRP  63           H        TRP  63  63.125  -1.267  -5.505
  414    HA   TRP  63           HA       TRP  63  63.435   0.784  -7.599
  415   1HB   TRP  63          2HB       TRP  63  64.321   0.861  -4.708
  416   2HB   TRP  63          1HB       TRP  63  64.649   2.121  -5.889
  417    HD1  TRP  63           HD1      TRP  63  61.198   0.735  -6.216
  418    HE1  TRP  63           HE1      TRP  63  59.483   2.376  -5.232
  419    HE3  TRP  63           HE3      TRP  63  64.406   3.907  -3.818
  420    HZ2  TRP  63           HZ2      TRP  63  59.488   4.708  -3.643
  421    HZ3  TRP  63           HZ3      TRP  63  63.472   5.820  -2.582
  422    HH2  TRP  63           HH2      TRP  63  61.061   6.211  -2.497
  423    H    ARG  64           H        ARG  64  64.531  -2.094  -6.994
  424    HA   ARG  64           HA       ARG  64  67.330  -2.001  -7.062
  425   1HB   ARG  64          2HB       ARG  64  65.715  -3.993  -8.661
  426   2HB   ARG  64          1HB       ARG  64  67.289  -4.227  -7.922
  427   1HG   ARG  64          2HG       ARG  64  64.721  -3.863  -6.397
  428   2HG   ARG  64          1HG       ARG  64  65.449  -5.421  -6.781
  429   1HD   ARG  64          2HD       ARG  64  66.834  -3.260  -5.203
  430   2HD   ARG  64          1HD       ARG  64  65.903  -4.560  -4.468
  431    HE   ARG  64           HE       ARG  64  67.911  -5.576  -6.207
  432   1HH1  ARG  64          1HH1      ARG  64  67.419  -4.185  -3.029
  433   2HH1  ARG  64          2HH1      ARG  64  68.874  -4.859  -2.369
  434   1HH2  ARG  64          1HH2      ARG  64  69.821  -6.498  -5.298
  435   2HH2  ARG  64          2HH2      ARG  64  70.209  -6.173  -3.636
  436    H    CYS  65           H        CYS  65  68.485  -0.737  -8.483
  437    HA   CYS  65           HA       CYS  65  67.599  -0.759 -11.290
  438   1HB   CYS  65          2HB       CYS  65  67.681   1.480 -10.044
  439   2HB   CYS  65          1HB       CYS  65  69.432   1.320 -10.125
  440    H    ASP  66           H        ASP  66  70.646  -0.133  -9.629
  441    HA   ASP  66           HA       ASP  66  72.261  -1.110 -11.740
  442   1HB   ASP  66          2HB       ASP  66  74.118  -0.751 -10.269
  443   2HB   ASP  66          1HB       ASP  66  72.957   0.524  -9.914
  444    H    ASN  67           H        ASN  67  71.226  -2.430  -8.683
  445    HA   ASN  67           HA       ASN  67  71.250  -5.129  -9.345
  446   1HB   ASN  67          2HB       ASN  67  73.631  -5.121  -9.491
  447   2HB   ASN  67          1HB       ASN  67  73.788  -4.064  -8.095
  448   1HD2  ASN  67          1HD2      ASN  67  73.711  -4.920  -6.048
  449   2HD2  ASN  67          2HD2      ASN  67  73.781  -6.620  -5.739
  450    H    ASP  68           H        ASP  68  71.799  -2.617  -6.947
  451    HA   ASP  68           HA       ASP  68  70.109  -4.136  -5.077
  452   1HB   ASP  68          2HB       ASP  68  72.458  -3.344  -4.353
  453   2HB   ASP  68          1HB       ASP  68  71.733  -1.739  -4.266
  454    H    ASN  69           H        ASN  69  69.391  -1.778  -3.497
  455    HA   ASN  69           HA       ASN  69  67.201  -1.056  -5.349
  456   1HB   ASN  69          2HB       ASN  69  66.854  -2.668  -3.333
  457   2HB   ASN  69          1HB       ASN  69  66.885  -1.196  -2.375
  458   1HD2  ASN  69          1HD2      ASN  69  65.240   0.305  -2.623
  459   2HD2  ASN  69          2HD2      ASN  69  63.717  -0.130  -3.323
  460    H    ASP  70           H        ASP  70  67.241   0.987  -5.909
  461    HA   ASP  70           HA       ASP  70  68.735   3.072  -5.110
  462   1HB   ASP  70          2HB       ASP  70  66.070   2.850  -6.357
  463   2HB   ASP  70          1HB       ASP  70  66.481   4.430  -5.706
  464    H    CYS  71           H        CYS  71  69.051   4.149  -3.303
  465    HA   CYS  71           HA       CYS  71  66.684   5.074  -1.849
  466   1HB   CYS  71          2HB       CYS  71  67.599   3.152  -0.584
  467   2HB   CYS  71          1HB       CYS  71  69.142   3.996  -0.453
  468    H    GLY  72           H        GLY  72  70.255   5.356  -1.820
  469   1HA   GLY  72          2HA       GLY  72  71.252   7.373  -2.727
  470   2HA   GLY  72          1HA       GLY  72  69.867   8.265  -2.124
  471    H    ASP  73           H        ASP  73  72.488   6.190  -0.909
  472    HA   ASP  73           HA       ASP  73  73.493   8.346   0.674
  473   1HB   ASP  73          2HB       ASP  73  73.433   6.975   2.830
  474   2HB   ASP  73          1HB       ASP  73  71.921   7.716   2.315
  475    H    ASN  74           H        ASN  74  73.792   4.854   1.234
  476    HA   ASN  74           HA       ASN  74  76.241   4.677  -0.244
  477   1HB   ASN  74          2HB       ASN  74  77.722   4.149   1.552
  478   2HB   ASN  74          1HB       ASN  74  76.938   5.662   1.967
  479   1HD2  ASN  74          1HD2      ASN  74  74.440   4.390   2.846
  480   2HD2  ASN  74          2HD2      ASN  74  74.820   3.636   4.352
  481    H    SER  75           H        SER  75  73.524   3.532   0.057
  482    HA   SER  75           HA       SER  75  73.950   0.807   0.929
  483   1HB   SER  75          2HB       SER  75  71.424   0.846   0.047
  484   2HB   SER  75          1HB       SER  75  71.874   1.463   1.637
  485    HG   SER  75           HG       SER  75  71.005   2.805  -0.614
  486    H    ASP  76           H        ASP  76  71.755   1.474  -1.531
  487    HA   ASP  76           HA       ASP  76  72.273  -0.646  -3.211
  488   1HB   ASP  76          2HB       ASP  76  70.941   0.849  -4.853
  489   2HB   ASP  76          1HB       ASP  76  70.172   0.374  -3.339
  490    H    GLU  77           H        GLU  77  73.025   2.730  -3.637
  491    HA   GLU  77           HA       GLU  77  75.424   2.604  -4.991
  492   1HB   GLU  77          2HB       GLU  77  74.830   2.970  -7.311
  493   2HB   GLU  77          1HB       GLU  77  74.093   1.465  -6.779
  494   1HG   GLU  77          2HG       GLU  77  71.948   2.473  -6.636
  495   2HG   GLU  77          1HG       GLU  77  72.618   4.088  -6.859
  496    H    ALA  78           H        ALA  78  72.434   4.069  -4.232
  497    HA   ALA  78           HA       ALA  78  72.158   6.011  -3.068
  498   1HB   ALA  78          1HB       ALA  78  74.817   6.935  -4.151
  499   2HB   ALA  78          2HB       ALA  78  74.538   6.206  -2.569
  500   3HB   ALA  78          3HB       ALA  78  73.826   7.771  -2.955
  501    H    GLY  79           H        GLY  79  71.641   5.289  -5.987
  502   1HA   GLY  79          2HA       GLY  79  69.729   6.770  -6.761
  503   2HA   GLY  79          1HA       GLY  79  70.940   8.037  -6.811
  504    H    CYS  80           H        CYS  80  69.647   5.226  -8.346
  505    HA   CYS  80           HA       CYS  80  71.513   5.014 -10.475
  506   1HB   CYS  80          2HB       CYS  80  69.769   3.303  -9.818
  507   2HB   CYS  80          1HB       CYS  80  68.559   4.349 -10.552
  508    H    SER  81           H        SER  81  72.011   6.939 -11.406
  509    HA   SER  81           HA       SER  81  69.797   8.736 -12.101
  510   1HB   SER  81          2HB       SER  81  72.738   9.382 -11.801
  511   2HB   SER  81          1HB       SER  81  71.422  10.541 -12.003
  512    HG   SER  81           HG       SER  81  71.636   8.712  -9.831
  513    H    HIS  82           HN       HIS  82  69.945   9.996 -14.038
  514    HA   HIS  82           HA       HIS  82  71.802   9.274 -16.103
  515   1HB   HIS  82          2HB       HIS  82  69.281   7.942 -15.996
  516   2HB   HIS  82          1HB       HIS  82  69.255   9.048 -17.367
  517    HD1  HIS  82           HD1      HIS  82  71.596   6.361 -15.984
  518    HD2  HIS  82           HD2      HIS  82  70.336   8.007 -19.587
  519    HE1  HIS  82           HE1      HIS  82  72.691   4.996 -17.811
  Start of MODEL    2
    1   1H    SER   1          1HT       SER   1  43.546  -0.885   2.590
    2   2H    SER   1          2HT       SER   1  44.009  -1.798   3.941
    3   3H    SER   1          3HT       SER   1  42.525  -2.093   3.191
    4    HA   SER   1           HA       SER   1  45.174  -2.493   1.954
    5   1HB   SER   1          2HB       SER   1  43.220  -4.623   2.823
    6   2HB   SER   1          1HB       SER   1  44.897  -4.830   2.312
    7    HG   SER   1           HG       SER   1  45.349  -4.665   4.356
    8    H    ALA   2           H        ALA   2  41.992  -4.062   1.618
    9    HA   ALA   2           HA       ALA   2  42.099  -3.363  -1.238
   10   1HB   ALA   2          1HB       ALA   2  42.450  -5.753  -0.819
   11   2HB   ALA   2          2HB       ALA   2  40.958  -5.454  -1.707
   12   3HB   ALA   2          3HB       ALA   2  40.896  -5.826   0.017
   13    H    ARG   3           H        ARG   3  40.389  -2.479  -2.168
   14    HA   ARG   3           HA       ARG   3  37.717  -2.831  -1.631
   15   1HB   ARG   3          2HB       ARG   3  37.002  -0.758  -0.555
   16   2HB   ARG   3          1HB       ARG   3  38.069  -1.658   0.511
   17   1HG   ARG   3          2HG       ARG   3  39.861  -0.157   0.126
   18   2HG   ARG   3          1HG       ARG   3  39.013   0.615  -1.216
   19   1HD   ARG   3          2HD       ARG   3  38.981   1.954   0.872
   20   2HD   ARG   3          1HD       ARG   3  37.376   1.538   0.272
   21    HE   ARG   3           HE       ARG   3  38.204  -0.398   2.139
   22   1HH1  ARG   3          1HH1      ARG   3  37.165   2.944   1.984
   23   2HH1  ARG   3          2HH1      ARG   3  36.508   2.947   3.590
   24   1HH2  ARG   3          1HH2      ARG   3  37.329  -0.401   4.256
   25   2HH2  ARG   3          2HH2      ARG   3  36.612   1.042   4.889
   26    H    THR   4           H        THR   4  40.302  -0.860  -2.790
   27    HA   THR   4           HA       THR   4  38.608   0.027  -5.029
   28    HB   THR   4           HB       THR   4  40.914   1.581  -3.828
   29    HG1  THR   4           HG1      THR   4  38.138   1.600  -3.285
   30   1HG2  THR   4          1HG2      THR   4  39.954   3.460  -5.120
   31   2HG2  THR   4          2HG2      THR   4  38.761   2.360  -5.809
   32   3HG2  THR   4          3HG2      THR   4  40.474   2.134  -6.162
   33    H    CYS   5           H        CYS   5  41.328  -1.684  -4.041
   34    HA   CYS   5           HA       CYS   5  42.593  -1.444  -6.677
   35   1HB   CYS   5          2HB       CYS   5  44.004  -1.577  -4.000
   36   2HB   CYS   5          1HB       CYS   5  44.790  -1.555  -5.575
   37    HA   PRO   6           HA       PRO   6  42.837  -5.874  -6.974
   38   1HB   PRO   6          2HB       PRO   6  45.708  -5.515  -7.648
   39   2HB   PRO   6          1HB       PRO   6  44.430  -6.320  -8.564
   40   1HG   PRO   6          2HG       PRO   6  45.353  -3.942  -9.319
   41   2HG   PRO   6          1HG       PRO   6  43.625  -4.329  -9.441
   42   1HD   PRO   6          2HD       PRO   6  45.058  -2.662  -7.412
   43   2HD   PRO   6          1HD       PRO   6  43.476  -2.399  -8.174
   44    HA   PRO   7           HA       PRO   7  44.346  -7.747  -3.337
   45   1HB   PRO   7          2HB       PRO   7  45.771  -9.771  -4.991
   46   2HB   PRO   7          1HB       PRO   7  44.590 -10.000  -3.696
   47   1HG   PRO   7          2HG       PRO   7  43.876 -10.335  -6.229
   48   2HG   PRO   7          1HG       PRO   7  42.784  -9.533  -5.086
   49   1HD   PRO   7          2HD       PRO   7  44.514  -8.339  -7.208
   50   2HD   PRO   7          1HD       PRO   7  42.874  -7.884  -6.703
   51    H    ASN   8           H        ASN   8  46.868  -7.423  -5.825
   52    HA   ASN   8           HA       ASN   8  48.895  -7.472  -3.731
   53   1HB   ASN   8          2HB       ASN   8  50.526  -7.816  -5.377
   54   2HB   ASN   8          1HB       ASN   8  49.155  -8.788  -5.888
   55   1HD2  ASN   8          1HD2      ASN   8  51.279  -6.247  -6.657
   56   2HD2  ASN   8          2HD2      ASN   8  50.633  -5.870  -8.210
   57    H    GLN   9           H        GLN   9  46.911  -5.276  -4.437
   58    HA   GLN   9           HA       GLN   9  48.838  -3.065  -4.519
   59   1HB   GLN   9          2HB       GLN   9  46.329  -3.457  -6.050
   60   2HB   GLN   9          1HB       GLN   9  46.527  -1.873  -5.309
   61   1HG   GLN   9          2HG       GLN   9  47.299  -2.068  -7.672
   62   2HG   GLN   9          1HG       GLN   9  48.484  -1.443  -6.529
   63   1HE2  GLN   9          1HE2      GLN   9  47.512  -4.261  -8.340
   64   2HE2  GLN   9          2HE2      GLN   9  49.030  -5.072  -8.286
   65    H    PHE  10           H        PHE  10  47.975  -1.141  -3.424
   66    HA   PHE  10           HA       PHE  10  46.262  -1.928  -1.188
   67   1HB   PHE  10          2HB       PHE  10  48.469  -1.677  -0.355
   68   2HB   PHE  10          1HB       PHE  10  48.702  -0.165  -1.227
   69    HD1  PHE  10           HD1      PHE  10  46.442  -1.647   1.348
   70    HD2  PHE  10           HD2      PHE  10  48.473   1.815  -0.061
   71    HE1  PHE  10           HE1      PHE  10  45.630  -0.380   3.301
   72    HE2  PHE  10           HE2      PHE  10  47.655   3.090   1.877
   73    HZ   PHE  10           HZ       PHE  10  46.236   1.991   3.561
   74    H    SER  11           H        SER  11  44.469  -0.938  -1.189
   75    HA   SER  11           HA       SER  11  44.160   1.641  -2.439
   76   1HB   SER  11          2HB       SER  11  41.660   1.109  -2.066
   77   2HB   SER  11          1HB       SER  11  42.515   0.215  -3.317
   78    HG   SER  11           HG       SER  11  42.862  -1.259  -1.263
   79    H    CYS  12           H        CYS  12  44.366   3.230  -1.227
   80    HA   CYS  12           HA       CYS  12  44.325   3.093   1.611
   81   1HB   CYS  12          2HB       CYS  12  45.827   4.556   0.245
   82   2HB   CYS  12          1HB       CYS  12  44.425   5.537  -0.158
   83    H    ALA  13           H        ALA  13  43.121   5.667   2.144
   84    HA   ALA  13           HA       ALA  13  40.505   4.823   2.693
   85   1HB   ALA  13          1HB       ALA  13  40.114   7.084   3.511
   86   2HB   ALA  13          2HB       ALA  13  41.600   7.630   2.729
   87   3HB   ALA  13          3HB       ALA  13  41.675   6.473   4.059
   88    H    SER  14           H        SER  14  39.628   4.140   0.789
   89    HA   SER  14           HA       SER  14  38.327   4.258  -1.065
   90   1HB   SER  14          2HB       SER  14  37.210   6.607   0.464
   91   2HB   SER  14          1HB       SER  14  36.361   5.626  -0.731
   92    HG   SER  14           HG       SER  14  35.977   5.063   1.526
   93    H    GLY  15           H        GLY  15  40.179   4.924  -2.425
   94   1HA   GLY  15          2HA       GLY  15  39.462   6.374  -4.513
   95   2HA   GLY  15          1HA       GLY  15  39.931   7.667  -3.421
   96    H    ARG  16           H        ARG  16  42.153   6.260  -2.225
   97    HA   ARG  16           HA       ARG  16  44.073   6.791  -4.324
   98   1HB   ARG  16          2HB       ARG  16  44.381   6.104  -1.401
   99   2HB   ARG  16          1HB       ARG  16  45.756   6.209  -2.487
  100   1HG   ARG  16          2HG       ARG  16  45.604   8.263  -1.306
  101   2HG   ARG  16          1HG       ARG  16  45.094   8.575  -2.965
  102   1HD   ARG  16          2HD       ARG  16  42.908   7.818  -1.189
  103   2HD   ARG  16          1HD       ARG  16  43.726   9.299  -0.697
  104    HE   ARG  16           HE       ARG  16  43.305   9.741  -3.307
  105   1HH1  ARG  16          1HH1      ARG  16  41.151   8.635  -0.761
  106   2HH1  ARG  16          2HH1      ARG  16  39.738   9.308  -1.503
  107   1HH2  ARG  16          1HH2      ARG  16  41.451  10.641  -4.260
  108   2HH2  ARG  16          2HH2      ARG  16  39.910  10.463  -3.474
  109    H    CYS  17           H        CYS  17  45.495   5.285  -5.196
  110    HA   CYS  17           HA       CYS  17  44.957   2.483  -4.633
  111   1HB   CYS  17          2HB       CYS  17  43.456   3.479  -6.550
  112   2HB   CYS  17          1HB       CYS  17  44.927   3.306  -7.508
  113    H    ILE  18           H        ILE  18  46.952   2.095  -3.973
  114    HA   ILE  18           HA       ILE  18  49.165   2.624  -5.848
  115    HB   ILE  18           HB       ILE  18  50.528   3.301  -4.064
  116   1HG1  ILE  18          2HG1      ILE  18  48.554   1.990  -2.184
  117   2HG1  ILE  18          1HG1      ILE  18  50.105   1.299  -2.667
  118   1HG2  ILE  18          1HG2      ILE  18  48.650   4.886  -4.391
  119   2HG2  ILE  18          2HG2      ILE  18  49.249   4.896  -2.731
  120   3HG2  ILE  18          3HG2      ILE  18  47.749   4.044  -3.124
  121   1HD1  ILE  18          1HD1      ILE  18  50.304   2.283  -0.490
  122   2HD1  ILE  18          2HD1      ILE  18  49.662   3.813  -1.093
  123   3HD1  ILE  18          3HD1      ILE  18  51.233   3.234  -1.653
  124    HA   PRO  19           HA       PRO  19  49.934  -1.777  -5.098
  125   1HB   PRO  19          2HB       PRO  19  52.806  -1.533  -4.817
  126   2HB   PRO  19          1HB       PRO  19  51.872  -2.152  -6.187
  127   1HG   PRO  19          2HG       PRO  19  53.287   0.182  -6.275
  128   2HG   PRO  19          1HG       PRO  19  51.834  -0.117  -7.244
  129   1HD   PRO  19          2HD       PRO  19  52.113   1.409  -4.674
  130   2HD   PRO  19          1HD       PRO  19  51.179   1.824  -6.131
  131    H    ILE  20           H        ILE  20  50.619  -3.371  -3.543
  132    HA   ILE  20           HA       ILE  20  50.042  -2.657  -0.914
  133    HB   ILE  20           HB       ILE  20  51.114  -5.110  -2.216
  134   1HG1  ILE  20          2HG1      ILE  20  48.702  -4.617  -2.190
  135   2HG1  ILE  20          1HG1      ILE  20  49.084  -6.106  -1.334
  136   1HG2  ILE  20          1HG2      ILE  20  51.215  -6.320  -0.097
  137   2HG2  ILE  20          2HG2      ILE  20  50.965  -4.806   0.772
  138   3HG2  ILE  20          3HG2      ILE  20  52.427  -5.043  -0.183
  139   1HD1  ILE  20          1HD1      ILE  20  48.492  -3.437  -0.077
  140   2HD1  ILE  20          2HD1      ILE  20  48.915  -4.910   0.797
  141   3HD1  ILE  20          3HD1      ILE  20  47.418  -4.835  -0.133
  142    H    SER  21           H        SER  21  53.144  -2.858  -2.505
  143    HA   SER  21           HA       SER  21  54.703  -3.099  -0.139
  144   1HB   SER  21          2HB       SER  21  55.560  -2.180  -2.891
  145   2HB   SER  21          1HB       SER  21  56.590  -2.871  -1.635
  146    HG   SER  21           HG       SER  21  55.112  -4.760  -1.805
  147    H    TRP  22           H        TRP  22  52.838  -0.640  -0.597
  148    HA   TRP  22           HA       TRP  22  54.882   1.453  -0.157
  149   1HB   TRP  22          2HB       TRP  22  52.279   1.693  -1.656
  150   2HB   TRP  22          1HB       TRP  22  53.356   3.035  -1.298
  151    HD1  TRP  22           HD1      TRP  22  53.954  -0.428  -2.921
  152    HE1  TRP  22           HE1      TRP  22  55.223  -0.054  -5.092
  153    HE3  TRP  22           HE3      TRP  22  54.250   4.652  -2.810
  154    HZ2  TRP  22           HZ2      TRP  22  56.258   2.116  -6.598
  155    HZ3  TRP  22           HZ3      TRP  22  55.399   5.810  -4.649
  156    HH2  TRP  22           HH2      TRP  22  56.383   4.570  -6.508
  157    H    THR  23           H        THR  23  53.020  -0.113   1.792
  158    HA   THR  23           HA       THR  23  51.314   1.963   2.797
  159    HB   THR  23           HB       THR  23  50.908   0.392   4.672
  160    HG1  THR  23           HG1      THR  23  53.224  -0.531   4.160
  161   1HG2  THR  23          1HG2      THR  23  49.589   0.198   2.598
  162   2HG2  THR  23          2HG2      THR  23  49.823  -1.369   3.373
  163   3HG2  THR  23          3HG2      THR  23  50.778  -0.936   1.954
  164    H    CYS  24           H        CYS  24  51.768   1.750   5.514
  165    HA   CYS  24           HA       CYS  24  53.365   3.535   6.463
  166   1HB   CYS  24          2HB       CYS  24  52.815   0.790   7.357
  167   2HB   CYS  24          1HB       CYS  24  54.031   1.702   8.253
  168    H    ASP  25           H        ASP  25  55.231   4.063   5.312
  169    HA   ASP  25           HA       ASP  25  57.502   2.574   6.334
  170   1HB   ASP  25          2HB       ASP  25  58.759   3.033   4.146
  171   2HB   ASP  25          1HB       ASP  25  57.623   1.699   4.172
  172    H    LEU  26           H        LEU  26  57.627   5.205   4.035
  173    HA   LEU  26           HA       LEU  26  58.209   7.104   6.178
  174   1HB   LEU  26          2HB       LEU  26  60.105   6.616   3.875
  175   2HB   LEU  26          1HB       LEU  26  60.276   7.857   5.098
  176    HG   LEU  26           HG       LEU  26  60.409   4.885   5.627
  177   1HD1  LEU  26          1HD1      LEU  26  62.789   5.238   5.935
  178   2HD1  LEU  26          2HD1      LEU  26  62.610   6.938   5.502
  179   3HD1  LEU  26          3HD1      LEU  26  62.301   5.684   4.300
  180   1HD2  LEU  26          1HD2      LEU  26  61.245   5.535   7.826
  181   2HD2  LEU  26          2HD2      LEU  26  59.614   6.155   7.553
  182   3HD2  LEU  26          3HD2      LEU  26  61.003   7.236   7.421
  183    H    ASP  27           H        ASP  27  56.522   6.419   3.441
  184    HA   ASP  27           HA       ASP  27  56.821   9.077   2.253
  185   1HB   ASP  27          2HB       ASP  27  56.813   6.918   0.852
  186   2HB   ASP  27          1HB       ASP  27  55.075   6.896   1.137
  187    H    ASP  28           H        ASP  28  54.694  10.025   1.376
  188    HA   ASP  28           HA       ASP  28  52.945  10.227   3.745
  189   1HB   ASP  28          2HB       ASP  28  54.616  12.068   3.548
  190   2HB   ASP  28          1HB       ASP  28  53.923  12.495   1.990
  191    H    ASP  29           H        ASP  29  52.712   8.918   0.933
  192    HA   ASP  29           HA       ASP  29  50.712  10.290  -0.487
  193   1HB   ASP  29          2HB       ASP  29  50.349   8.326  -1.724
  194   2HB   ASP  29          1HB       ASP  29  52.024   8.175  -1.208
  195    H    CYS  30           H        CYS  30  50.564   8.030   2.152
  196    HA   CYS  30           HA       CYS  30  47.997   9.199   2.916
  197   1HB   CYS  30          2HB       CYS  30  48.544   6.274   2.520
  198   2HB   CYS  30          1HB       CYS  30  47.363   6.805   3.717
  199    H    GLY  31           H        GLY  31  50.659   9.681   3.827
  200   1HA   GLY  31          2HA       GLY  31  51.179   8.291   6.273
  201   2HA   GLY  31          1HA       GLY  31  51.945   9.778   5.738
  202    H    ASP  32           H        ASP  32  48.651   8.847   6.574
  203    HA   ASP  32           HA       ASP  32  48.230  10.281   8.894
  204   1HB   ASP  32          2HB       ASP  32  48.736  12.352   7.767
  205   2HB   ASP  32          1HB       ASP  32  47.738  11.911   6.385
  206    H    ARG  33           H        ARG  33  46.991   9.450   5.730
  207    HA   ARG  33           HA       ARG  33  44.238   9.408   6.510
  208   1HB   ARG  33          2HB       ARG  33  45.567   8.291   4.040
  209   2HB   ARG  33          1HB       ARG  33  43.842   8.539   4.258
  210   1HG   ARG  33          2HG       ARG  33  45.843  10.772   4.370
  211   2HG   ARG  33          1HG       ARG  33  45.055  10.255   2.880
  212   1HD   ARG  33          2HD       ARG  33  43.493  11.772   3.419
  213   2HD   ARG  33          1HD       ARG  33  42.921  10.545   4.546
  214    HE   ARG  33           HE       ARG  33  44.653  11.807   6.101
  215   1HH1  ARG  33          1HH1      ARG  33  42.339  13.168   3.847
  216   2HH1  ARG  33          2HH1      ARG  33  42.150  14.643   4.734
  217   1HH2  ARG  33          1HH2      ARG  33  44.415  13.710   7.277
  218   2HH2  ARG  33          2HH2      ARG  33  43.340  14.961   6.703
  219    H    SER  34           H        SER  34  45.189   7.845   8.349
  220    HA   SER  34           HA       SER  34  44.545   5.959   9.428
  221   1HB   SER  34          2HB       SER  34  43.293   5.099   6.819
  222   2HB   SER  34          1HB       SER  34  43.000   4.380   8.402
  223    HG   SER  34           HG       SER  34  42.623   7.036   8.523
  224    H    ASP  35           H        ASP  35  46.220   5.616   6.371
  225    HA   ASP  35           HA       ASP  35  46.956   2.918   6.560
  226   1HB   ASP  35          2HB       ASP  35  47.275   4.159   4.499
  227   2HB   ASP  35          1HB       ASP  35  48.473   5.194   5.275
  228    H    GLU  36           H        GLU  36  48.113   5.641   8.271
  229    HA   GLU  36           HA       GLU  36  50.569   4.253   9.082
  230   1HB   GLU  36          2HB       GLU  36  49.703   7.137   9.369
  231   2HB   GLU  36          1HB       GLU  36  51.220   6.495   9.979
  232   1HG   GLU  36          2HG       GLU  36  50.435   6.393   7.082
  233   2HG   GLU  36          1HG       GLU  36  51.334   7.730   7.793
  234    H    SER  37           H        SER  37  47.757   3.814   9.998
  235    HA   SER  37           HA       SER  37  48.509   3.607  12.808
  236   1HB   SER  37          2HB       SER  37  45.788   4.582  11.897
  237   2HB   SER  37          1HB       SER  37  46.290   4.308  13.565
  238    HG   SER  37           HG       SER  37  48.089   5.904  12.546
  239    H    ALA  38           H        ALA  38  48.065   2.001  10.195
  240    HA   ALA  38           HA       ALA  38  46.597  -0.184  11.469
  241   1HB   ALA  38          1HB       ALA  38  44.977   1.042  10.102
  242   2HB   ALA  38          2HB       ALA  38  45.253  -0.588   9.493
  243   3HB   ALA  38          3HB       ALA  38  45.996   0.791   8.686
  244    H    SER  39           H        SER  39  48.885   0.886   9.012
  245    HA   SER  39           HA       SER  39  49.457  -1.923   8.356
  246   1HB   SER  39          2HB       SER  39  50.427   0.526   6.873
  247   2HB   SER  39          1HB       SER  39  50.389  -1.141   6.297
  248    HG   SER  39           HG       SER  39  48.611   0.623   5.818
  249    H    CYS  40           H        CYS  40  50.744   0.796   9.969
  250    HA   CYS  40           HA       CYS  40  53.478   0.407   9.703
  251   1HB   CYS  40          2HB       CYS  40  51.852   1.597  11.939
  252   2HB   CYS  40          1HB       CYS  40  53.610   1.614  11.928
  253    H    ALA  41           H        ALA  41  54.097  -1.670   9.821
  254    HA   ALA  41           HA       ALA  41  54.555  -2.655  12.523
  255   1HB   ALA  41          1HB       ALA  41  53.422  -4.397  10.329
  256   2HB   ALA  41          2HB       ALA  41  52.532  -3.824  11.739
  257   3HB   ALA  41          3HB       ALA  41  53.889  -4.926  11.945
  258    H    TYR  42           H        TYR  42  56.296  -1.313  10.873
  259    HA   TYR  42           HA       TYR  42  57.946  -3.402   9.638
  260   1HB   TYR  42          2HB       TYR  42  58.920  -1.524   8.250
  261   2HB   TYR  42          1HB       TYR  42  57.235  -1.901   7.925
  262    HD1  TYR  42           HD1      TYR  42  59.517   0.680   8.354
  263    HD2  TYR  42           HD2      TYR  42  55.526  -0.395   9.372
  264    HE1  TYR  42           HE1      TYR  42  58.952   3.055   8.634
  265    HE2  TYR  42           HE2      TYR  42  54.953   1.977   9.649
  266    HH   TYR  42           HH       TYR  42  56.848   4.476   8.549
  267    HA   PRO  43           HA       PRO  43  60.826  -1.964  12.883
  268   1HB   PRO  43          2HB       PRO  43  61.504  -4.728  13.299
  269   2HB   PRO  43          1HB       PRO  43  60.676  -3.636  14.410
  270   1HG   PRO  43          2HG       PRO  43  59.498  -5.818  13.219
  271   2HG   PRO  43          1HG       PRO  43  58.612  -4.407  13.823
  272   1HD   PRO  43          2HD       PRO  43  59.429  -5.081  11.021
  273   2HD   PRO  43          1HD       PRO  43  57.914  -4.364  11.615
  274    H    THR  44           H        THR  44  60.895  -3.972  10.117
  275    HA   THR  44           HA       THR  44  63.738  -3.359   9.695
  276    HB   THR  44           HB       THR  44  63.520  -5.739  10.290
  277    HG1  THR  44           HG1      THR  44  64.188  -5.080   7.616
  278   1HG2  THR  44          1HG2      THR  44  62.303  -7.284   8.807
  279   2HG2  THR  44          2HG2      THR  44  61.687  -5.904   7.899
  280   3HG2  THR  44          3HG2      THR  44  61.221  -6.124   9.585
  281    H    CYS  45           H        CYS  45  61.138  -2.162   8.882
  282    HA   CYS  45           HA       CYS  45  60.046  -1.304   7.102
  283   1HB   CYS  45          2HB       CYS  45  62.597  -1.877   5.592
  284   2HB   CYS  45          1HB       CYS  45  61.339  -0.732   5.133
  285    H    PHE  46           H        PHE  46  58.968  -3.530   7.458
  286    HA   PHE  46           HA       PHE  46  58.176  -4.466   4.920
  287   1HB   PHE  46          2HB       PHE  46  60.324  -5.714   5.128
  288   2HB   PHE  46          1HB       PHE  46  59.724  -6.456   6.600
  289    HD1  PHE  46           HD1      PHE  46  56.906  -7.090   5.731
  290    HD2  PHE  46           HD2      PHE  46  60.638  -7.526   3.719
  291    HE1  PHE  46           HE1      PHE  46  55.970  -8.928   4.418
  292    HE2  PHE  46           HE2      PHE  46  59.703  -9.375   2.395
  293    HZ   PHE  46           HZ       PHE  46  57.371 -10.087   2.746
  294    HA   PRO  47           HA       PRO  47  55.008  -5.709   7.847
  295   1HB   PRO  47          2HB       PRO  47  53.048  -4.081   6.995
  296   2HB   PRO  47          1HB       PRO  47  54.278  -3.539   8.139
  297   1HG   PRO  47          2HG       PRO  47  53.915  -2.836   5.308
  298   2HG   PRO  47          1HG       PRO  47  54.789  -1.972   6.580
  299   1HD   PRO  47          2HD       PRO  47  55.848  -3.728   4.546
  300   2HD   PRO  47          1HD       PRO  47  56.735  -2.776   5.753
  301    H    LEU  48           H        LEU  48  55.449  -5.577   4.478
  302    HA   LEU  48           HA       LEU  48  53.456  -7.618   3.961
  303   1HB   LEU  48          2HB       LEU  48  53.298  -4.872   2.727
  304   2HB   LEU  48          1HB       LEU  48  52.443  -6.276   2.105
  305    HG   LEU  48           HG       LEU  48  52.114  -5.447   4.958
  306   1HD1  LEU  48          1HD1      LEU  48  50.564  -4.375   2.591
  307   2HD1  LEU  48          2HD1      LEU  48  51.635  -3.445   3.638
  308   3HD1  LEU  48          3HD1      LEU  48  50.145  -4.128   4.284
  309   1HD2  LEU  48          1HD2      LEU  48  49.918  -6.531   4.645
  310   2HD2  LEU  48          2HD2      LEU  48  51.268  -7.620   4.322
  311   3HD2  LEU  48          3HD2      LEU  48  50.367  -6.912   2.982
  312    H    THR  49           H        THR  49  55.604  -5.290   2.316
  313    HA   THR  49           HA       THR  49  57.210  -7.311   1.136
  314    HB   THR  49           HB       THR  49  56.526  -6.307  -1.270
  315    HG1  THR  49           HG1      THR  49  53.945  -6.783  -0.385
  316   1HG2  THR  49          1HG2      THR  49  55.327  -8.393  -1.709
  317   2HG2  THR  49          2HG2      THR  49  55.192  -8.685   0.026
  318   3HG2  THR  49          3HG2      THR  49  56.778  -8.683  -0.746
  319    H    GLN  50           H        GLN  50  58.704  -5.811   2.195
  320    HA   GLN  50           HA       GLN  50  59.413  -3.631   0.403
  321   1HB   GLN  50          2HB       GLN  50  59.209  -3.160   3.377
  322   2HB   GLN  50          1HB       GLN  50  59.622  -1.984   2.140
  323   1HG   GLN  50          2HG       GLN  50  57.304  -2.358   1.203
  324   2HG   GLN  50          1HG       GLN  50  56.954  -3.236   2.692
  325   1HE2  GLN  50          1HE2      GLN  50  57.462  -0.161   1.248
  326   2HE2  GLN  50          2HE2      GLN  50  57.063   0.805   2.624
  327    H    PHE  51           H        PHE  51  61.509  -2.591   1.296
  328    HA   PHE  51           HA       PHE  51  63.251  -4.617   2.520
  329   1HB   PHE  51          2HB       PHE  51  63.522  -4.595   0.022
  330   2HB   PHE  51          1HB       PHE  51  63.971  -2.901   0.124
  331    HD1  PHE  51           HD1      PHE  51  66.183  -2.268   0.581
  332    HD2  PHE  51           HD2      PHE  51  64.984  -6.310   1.122
  333    HE1  PHE  51           HE1      PHE  51  68.534  -2.921   0.852
  334    HE2  PHE  51           HE2      PHE  51  67.338  -6.977   1.398
  335    HZ   PHE  51           HZ       PHE  51  69.120  -5.276   1.259
  336    H    THR  52           H        THR  52  65.084  -3.633   3.651
  337    HA   THR  52           HA       THR  52  64.539  -0.816   4.247
  338    HB   THR  52           HB       THR  52  64.398  -2.331   6.211
  339    HG1  THR  52           HG1      THR  52  64.942  -0.236   6.694
  340   1HG2  THR  52          1HG2      THR  52  67.365  -2.705   5.803
  341   2HG2  THR  52          2HG2      THR  52  66.135  -3.949   5.569
  342   3HG2  THR  52          3HG2      THR  52  66.420  -3.284   7.177
  343    H    CYS  53           H        CYS  53  65.757   0.491   3.131
  344    HA   CYS  53           HA       CYS  53  68.262  -0.068   2.013
  345   1HB   CYS  53          2HB       CYS  53  66.648   1.920   1.624
  346   2HB   CYS  53          1HB       CYS  53  67.460   2.658   3.003
  347    H    ASN  54           H        ASN  54  70.249  -0.301   2.948
  348    HA   ASN  54           HA       ASN  54  70.435  -0.559   5.720
  349   1HB   ASN  54          2HB       ASN  54  72.650  -1.191   5.447
  350   2HB   ASN  54          1HB       ASN  54  71.940  -1.580   3.889
  351   1HD2  ASN  54          1HD2      ASN  54  71.928   1.046   2.779
  352   2HD2  ASN  54          2HD2      ASN  54  73.573   1.513   2.521
  353    H    ASN  55           H        ASN  55  70.644   2.299   3.881
  354    HA   ASN  55           HA       ASN  55  72.182   3.701   5.861
  355   1HB   ASN  55          2HB       ASN  55  72.331   4.126   3.358
  356   2HB   ASN  55          1HB       ASN  55  70.774   4.932   3.500
  357   1HD2  ASN  55          1HD2      ASN  55  71.946   6.785   2.682
  358   2HD2  ASN  55          2HD2      ASN  55  72.833   7.771   3.791
  359    H    GLY  56           H        GLY  56  69.262   2.546   6.084
  360   1HA   GLY  56          2HA       GLY  56  68.151   3.056   8.158
  361   2HA   GLY  56          1HA       GLY  56  68.513   4.751   7.888
  362    H    ARG  57           H        ARG  57  67.479   3.449   5.003
  363    HA   ARG  57           HA       ARG  57  64.902   4.781   5.404
  364   1HB   ARG  57          2HB       ARG  57  66.214   3.979   2.805
  365   2HB   ARG  57          1HB       ARG  57  64.710   4.867   2.963
  366   1HG   ARG  57          2HG       ARG  57  66.210   6.540   2.498
  367   2HG   ARG  57          1HG       ARG  57  66.163   6.581   4.262
  368   1HD   ARG  57          2HD       ARG  57  68.237   5.582   4.470
  369   2HD   ARG  57          1HD       ARG  57  68.179   4.888   2.851
  370    HE   ARG  57           HE       ARG  57  68.655   7.749   3.435
  371   1HH1  ARG  57          1HH1      ARG  57  68.941   4.945   1.376
  372   2HH1  ARG  57          2HH1      ARG  57  70.133   5.656   0.326
  373   1HH2  ARG  57          1HH2      ARG  57  70.167   8.730   2.025
  374   2HH2  ARG  57          2HH2      ARG  57  70.814   7.816   0.689
  375    H    CYS  58           H        CYS  58  62.986   3.863   4.436
  376    HA   CYS  58           HA       CYS  58  63.083   0.938   4.150
  377   1HB   CYS  58          2HB       CYS  58  60.680   2.716   4.637
  378   2HB   CYS  58          1HB       CYS  58  60.673   0.957   4.567
  379    H    ILE  59           H        ILE  59  62.981   0.229   2.094
  380    HA   ILE  59           HA       ILE  59  61.783   2.043   0.129
  381    HB   ILE  59           HB       ILE  59  63.198   1.126  -1.606
  382   1HG1  ILE  59          2HG1      ILE  59  64.605  -0.450   0.562
  383   2HG1  ILE  59          1HG1      ILE  59  63.458  -1.144  -0.581
  384   1HG2  ILE  59          1HG2      ILE  59  65.348   2.040  -0.889
  385   2HG2  ILE  59          2HG2      ILE  59  64.792   2.032   0.784
  386   3HG2  ILE  59          3HG2      ILE  59  64.002   3.073  -0.401
  387   1HD1  ILE  59          1HD1      ILE  59  66.071   0.172  -1.285
  388   2HD1  ILE  59          2HD1      ILE  59  64.922  -0.515  -2.434
  389   3HD1  ILE  59          3HD1      ILE  59  65.742  -1.560  -1.273
  390    H    ASN  60           H        ASN  60  61.023   0.760  -1.900
  391    HA   ASN  60           HA       ASN  60  59.132  -1.199  -0.977
  392   1HB   ASN  60          2HB       ASN  60  59.768  -0.427  -3.836
  393   2HB   ASN  60          1HB       ASN  60  58.322  -1.249  -3.266
  394   1HD2  ASN  60          1HD2      ASN  60  57.906   0.422  -0.953
  395   2HD2  ASN  60          2HD2      ASN  60  57.407   1.969  -1.536
  396    H    ILE  61           H        ILE  61  58.968  -3.376  -1.894
  397    HA   ILE  61           HA       ILE  61  61.518  -4.685  -1.837
  398    HB   ILE  61           HB       ILE  61  59.088  -5.450  -1.025
  399   1HG1  ILE  61          2HG1      ILE  61  61.244  -6.573  -0.517
  400   2HG1  ILE  61          1HG1      ILE  61  59.915  -7.693  -0.753
  401   1HG2  ILE  61          1HG2      ILE  61  58.140  -7.149  -2.488
  402   2HG2  ILE  61          2HG2      ILE  61  59.344  -6.764  -3.719
  403   3HG2  ILE  61          3HG2      ILE  61  58.141  -5.559  -3.255
  404   1HD1  ILE  61          1HD1      ILE  61  61.944  -8.521  -1.745
  405   2HD1  ILE  61          2HD1      ILE  61  62.077  -7.068  -2.737
  406   3HD1  ILE  61          3HD1      ILE  61  60.740  -8.192  -2.991
  407    H    ASN  62           H        ASN  62  59.558  -3.351  -4.232
  408    HA   ASN  62           HA       ASN  62  60.438  -5.153  -6.348
  409   1HB   ASN  62          2HB       ASN  62  58.816  -3.865  -7.748
  410   2HB   ASN  62          1HB       ASN  62  58.087  -4.625  -6.336
  411   1HD2  ASN  62          1HD2      ASN  62  59.028  -1.617  -7.805
  412   2HD2  ASN  62          2HD2      ASN  62  58.152  -0.592  -6.721
  413    H    TRP  63           H        TRP  63  62.447  -3.462  -5.190
  414    HA   TRP  63           HA       TRP  63  62.955  -1.572  -7.391
  415   1HB   TRP  63          2HB       TRP  63  63.963  -1.680  -4.552
  416   2HB   TRP  63          1HB       TRP  63  64.753  -0.696  -5.777
  417    HD1  TRP  63           HD1      TRP  63  60.931  -0.923  -5.729
  418    HE1  TRP  63           HE1      TRP  63  59.979   1.375  -5.051
  419    HE3  TRP  63           HE3      TRP  63  65.293   1.426  -4.441
  420    HZ2  TRP  63           HZ2      TRP  63  60.947   3.838  -4.112
  421    HZ3  TRP  63           HZ3      TRP  63  65.187   3.760  -3.669
  422    HH2  TRP  63           HH2      TRP  63  63.059   4.941  -3.508
  423    H    ARG  64           H        ARG  64  63.546  -4.635  -6.619
  424    HA   ARG  64           HA       ARG  64  66.314  -4.967  -7.168
  425   1HB   ARG  64          2HB       ARG  64  64.263  -7.018  -7.965
  426   2HB   ARG  64          1HB       ARG  64  65.883  -7.264  -7.344
  427   1HG   ARG  64          2HG       ARG  64  63.723  -6.119  -5.621
  428   2HG   ARG  64          1HG       ARG  64  63.891  -7.858  -5.857
  429   1HD   ARG  64          2HD       ARG  64  66.001  -5.999  -4.770
  430   2HD   ARG  64          1HD       ARG  64  65.014  -7.112  -3.824
  431    HE   ARG  64           HE       ARG  64  66.659  -8.265  -5.937
  432   1HH1  ARG  64          1HH1      ARG  64  66.161  -7.632  -2.548
  433   2HH1  ARG  64          2HH1      ARG  64  67.453  -8.657  -2.019
  434   1HH2  ARG  64          1HH2      ARG  64  68.341  -9.679  -5.258
  435   2HH2  ARG  64          2HH2      ARG  64  68.676  -9.852  -3.563
  436    H    CYS  65           H        CYS  65  66.911  -3.794  -9.034
  437    HA   CYS  65           HA       CYS  65  65.415  -4.312 -11.480
  438   1HB   CYS  65          2HB       CYS  65  67.749  -2.478 -10.927
  439   2HB   CYS  65          1HB       CYS  65  66.973  -2.647 -12.499
  440    H    ASP  66           H        ASP  66  68.065  -5.548  -9.848
  441    HA   ASP  66           HA       ASP  66  68.699  -7.366 -11.939
  442   1HB   ASP  66          2HB       ASP  66  71.144  -6.668 -12.065
  443   2HB   ASP  66          1HB       ASP  66  69.995  -5.624 -12.892
  444    H    ASN  67           H        ASN  67  70.746  -6.021  -9.324
  445    HA   ASN  67           HA       ASN  67  71.099  -8.695  -8.333
  446   1HB   ASN  67          2HB       ASN  67  73.088  -7.373  -8.523
  447   2HB   ASN  67          1HB       ASN  67  72.379  -6.073  -7.576
  448   1HD2  ASN  67          1HD2      ASN  67  72.555  -6.097  -5.424
  449   2HD2  ASN  67          2HD2      ASN  67  73.335  -7.355  -4.521
  450    H    ASP  68           H        ASP  68  70.683  -5.712  -6.385
  451    HA   ASP  68           HA       ASP  68  68.663  -7.207  -4.827
  452   1HB   ASP  68          2HB       ASP  68  71.049  -6.807  -3.788
  453   2HB   ASP  68          1HB       ASP  68  70.443  -5.176  -3.514
  454    H    ASN  69           H        ASN  69  68.448  -4.723  -3.075
  455    HA   ASN  69           HA       ASN  69  66.362  -3.576  -4.808
  456   1HB   ASN  69          2HB       ASN  69  66.531  -4.303  -1.972
  457   2HB   ASN  69          1HB       ASN  69  65.811  -2.722  -2.252
  458   1HD2  ASN  69          1HD2      ASN  69  64.712  -5.332  -1.339
  459   2HD2  ASN  69          2HD2      ASN  69  63.364  -5.628  -2.383
  460    H    ASP  70           H        ASP  70  66.636  -1.668  -5.566
  461    HA   ASP  70           HA       ASP  70  69.047  -0.405  -5.489
  462   1HB   ASP  70          2HB       ASP  70  67.191  -0.244  -7.206
  463   2HB   ASP  70          1HB       ASP  70  66.507   1.028  -6.191
  464    H    CYS  71           H        CYS  71  69.998   1.141  -4.503
  465    HA   CYS  71           HA       CYS  71  68.585   3.070  -2.844
  466   1HB   CYS  71          2HB       CYS  71  70.596   1.101  -1.820
  467   2HB   CYS  71          1HB       CYS  71  70.520   2.711  -1.116
  468    H    GLY  72           H        GLY  72  71.808   1.909  -3.792
  469   1HA   GLY  72          2HA       GLY  72  73.425   3.166  -4.975
  470   2HA   GLY  72          1HA       GLY  72  72.537   4.633  -4.591
  471    H    ASP  73           H        ASP  73  72.627   2.887  -1.816
  472    HA   ASP  73           HA       ASP  73  74.903   4.466  -0.814
  473   1HB   ASP  73          2HB       ASP  73  72.679   3.152   0.775
  474   2HB   ASP  73          1HB       ASP  73  73.872   4.290   1.381
  475    H    ASN  74           H        ASN  74  75.231   1.950  -2.190
  476    HA   ASN  74           HA       ASN  74  76.450   0.034  -2.055
  477   1HB   ASN  74          2HB       ASN  74  77.281   1.287   0.563
  478   2HB   ASN  74          1HB       ASN  74  77.905  -0.268   0.032
  479   1HD2  ASN  74          1HD2      ASN  74  77.208   2.483  -2.059
  480   2HD2  ASN  74          2HD2      ASN  74  78.845   2.763  -2.528
  481    H    SER  75           H        SER  75  73.703   0.306  -0.938
  482    HA   SER  75           HA       SER  75  73.537  -1.658   1.164
  483   1HB   SER  75          2HB       SER  75  72.020   0.388   0.875
  484   2HB   SER  75          1HB       SER  75  71.268  -0.505  -0.447
  485    HG   SER  75           HG       SER  75  70.888  -2.203   1.166
  486    H    ASP  76           H        ASP  76  71.899  -1.307  -1.830
  487    HA   ASP  76           HA       ASP  76  71.505  -4.070  -2.362
  488   1HB   ASP  76          2HB       ASP  76  70.747  -3.072  -4.601
  489   2HB   ASP  76          1HB       ASP  76  69.877  -2.537  -3.167
  490    H    GLU  77           H        GLU  77  73.268  -1.521  -4.015
  491    HA   GLU  77           HA       GLU  77  75.685  -2.469  -4.559
  492   1HB   GLU  77          2HB       GLU  77  75.741  -3.861  -6.457
  493   2HB   GLU  77          1HB       GLU  77  74.484  -4.558  -5.452
  494   1HG   GLU  77          2HG       GLU  77  73.989  -2.740  -7.804
  495   2HG   GLU  77          1HG       GLU  77  73.943  -4.499  -7.867
  496    H    ALA  78           H        ALA  78  72.854  -0.897  -5.589
  497    HA   ALA  78           HA       ALA  78  72.452   1.046  -6.697
  498   1HB   ALA  78          1HB       ALA  78  75.448   1.374  -6.792
  499   2HB   ALA  78          2HB       ALA  78  74.395   1.948  -5.499
  500   3HB   ALA  78          3HB       ALA  78  74.248   2.623  -7.121
  501    H    GLY  79           H        GLY  79  72.322  -1.269  -8.108
  502   1HA   GLY  79          2HA       GLY  79  73.814  -0.896 -10.599
  503   2HA   GLY  79          1HA       GLY  79  72.828  -2.285 -10.174
  504    H    CYS  80           H        CYS  80  70.650  -0.284  -9.343
  505    HA   CYS  80           HA       CYS  80  69.435  -0.284 -11.980
  506   1HB   CYS  80          2HB       CYS  80  68.204  -1.132  -9.992
  507   2HB   CYS  80          1HB       CYS  80  68.215   0.496  -9.325
  508    H    SER  81           H        SER  81  69.890   2.118  -9.359
  509    HA   SER  81           HA       SER  81  69.210   4.279 -11.123
  510   1HB   SER  81          2HB       SER  81  70.356   4.221  -8.328
  511   2HB   SER  81          1HB       SER  81  69.995   5.714  -9.194
  512    HG   SER  81           HG       SER  81  68.290   3.882  -8.004
  513    H    HIS  82           HN       HIS  82  70.511   4.760 -12.748
  514    HA   HIS  82           HA       HIS  82  73.279   5.470 -12.131
  515   1HB   HIS  82          2HB       HIS  82  73.399   3.240 -13.139
  516   2HB   HIS  82          1HB       HIS  82  72.415   3.778 -14.494
  517    HD1  HIS  82           HD1      HIS  82  73.621   5.824 -15.931
  518    HD2  HIS  82           HD2      HIS  82  76.052   3.408 -13.582
  519    HE1  HIS  82           HE1      HIS  82  75.974   6.096 -16.828
  Start of MODEL    3
    1   1H    SER   1          1HT       SER   1  39.336  -9.083   3.480
    2   2H    SER   1          2HT       SER   1  38.741  -9.801   2.068
    3   3H    SER   1          3HT       SER   1  37.824  -8.626   2.871
    4    HA   SER   1           HA       SER   1  40.437  -8.187   1.560
    5   1HB   SER   1          2HB       SER   1  37.685  -7.218   0.741
    6   2HB   SER   1          1HB       SER   1  39.196  -7.002  -0.146
    7    HG   SER   1           HG       SER   1  38.141  -8.735  -1.052
    8    H    ALA   2           H        ALA   2  40.625  -5.700   1.180
    9    HA   ALA   2           HA       ALA   2  40.374  -4.429   3.756
   10   1HB   ALA   2          1HB       ALA   2  42.411  -4.136   2.435
   11   2HB   ALA   2          2HB       ALA   2  41.626  -2.592   2.756
   12   3HB   ALA   2          3HB       ALA   2  41.472  -3.343   1.169
   13    H    ARG   3           H        ARG   3  39.863  -2.728   0.779
   14    HA   ARG   3           HA       ARG   3  37.026  -2.586   1.020
   15   1HB   ARG   3          2HB       ARG   3  36.750  -0.221   1.410
   16   2HB   ARG   3          1HB       ARG   3  37.640  -0.927   2.745
   17   1HG   ARG   3          2HG       ARG   3  39.051   0.464   0.491
   18   2HG   ARG   3          1HG       ARG   3  38.370   1.360   1.849
   19   1HD   ARG   3          2HD       ARG   3  39.728  -0.427   3.251
   20   2HD   ARG   3          1HD       ARG   3  40.680  -0.524   1.769
   21    HE   ARG   3           HE       ARG   3  40.214   2.151   2.814
   22   1HH1  ARG   3          1HH1      ARG   3  42.410  -0.556   2.559
   23   2HH1  ARG   3          2HH1      ARG   3  43.785   0.346   3.097
   24   1HH2  ARG   3          1HH2      ARG   3  42.027   3.343   3.559
   25   2HH2  ARG   3          2HH2      ARG   3  43.567   2.557   3.678
   26    H    THR   4           H        THR   4  39.999  -1.780  -0.514
   27    HA   THR   4           HA       THR   4  38.687  -1.823  -3.093
   28    HB   THR   4           HB       THR   4  40.551   0.484  -2.474
   29    HG1  THR   4           HG1      THR   4  37.803   0.227  -1.981
   30   1HG2  THR   4          1HG2      THR   4  39.540   1.468  -4.479
   31   2HG2  THR   4          2HG2      THR   4  38.509   0.048  -4.659
   32   3HG2  THR   4          3HG2      THR   4  40.258  -0.103  -4.833
   33    H    CYS   5           H        CYS   5  40.386  -1.958  -4.837
   34    HA   CYS   5           HA       CYS   5  42.361  -2.566  -5.752
   35   1HB   CYS   5          2HB       CYS   5  43.406  -2.111  -2.962
   36   2HB   CYS   5          1HB       CYS   5  44.434  -2.624  -4.298
   37    HA   PRO   6           HA       PRO   6  42.327  -6.936  -5.253
   38   1HB   PRO   6          2HB       PRO   6  44.267  -7.583  -6.995
   39   2HB   PRO   6          1HB       PRO   6  42.736  -6.881  -7.535
   40   1HG   PRO   6          2HG       PRO   6  45.395  -5.566  -7.143
   41   2HG   PRO   6          1HG       PRO   6  44.234  -5.369  -8.468
   42   1HD   PRO   6          2HD       PRO   6  44.464  -3.626  -6.370
   43   2HD   PRO   6          1HD       PRO   6  42.973  -3.863  -7.300
   44    HA   PRO   7           HA       PRO   7  45.598  -8.528  -2.608
   45   1HB   PRO   7          2HB       PRO   7  46.614 -10.662  -4.063
   46   2HB   PRO   7          1HB       PRO   7  45.205 -10.729  -2.998
   47   1HG   PRO   7          2HG       PRO   7  45.319 -10.435  -5.973
   48   2HG   PRO   7          1HG       PRO   7  44.190 -11.370  -4.975
   49   1HD   PRO   7          2HD       PRO   7  43.475  -9.017  -6.041
   50   2HD   PRO   7          1HD       PRO   7  42.930  -9.504  -4.422
   51    H    ASN   8           H        ASN   8  47.832  -8.495  -2.317
   52    HA   ASN   8           HA       ASN   8  49.966  -7.791  -2.612
   53   1HB   ASN   8          2HB       ASN   8  49.699  -9.376  -4.694
   54   2HB   ASN   8          1HB       ASN   8  49.706  -7.865  -5.594
   55   1HD2  ASN   8          1HD2      ASN   8  51.602  -6.627  -5.660
   56   2HD2  ASN   8          2HD2      ASN   8  53.133  -7.273  -5.187
   57    H    GLN   9           H        GLN   9  47.476  -6.060  -2.934
   58    HA   GLN   9           HA       GLN   9  48.868  -3.653  -3.840
   59   1HB   GLN   9          2HB       GLN   9  46.591  -4.854  -5.108
   60   2HB   GLN   9          1HB       GLN   9  46.091  -3.342  -4.375
   61   1HG   GLN   9          2HG       GLN   9  46.696  -2.898  -6.624
   62   2HG   GLN   9          1HG       GLN   9  47.936  -2.204  -5.582
   63   1HE2  GLN   9          1HE2      GLN   9  47.762  -5.628  -6.177
   64   2HE2  GLN   9          2HE2      GLN   9  49.165  -5.737  -7.166
   65    H    PHE  10           H        PHE  10  47.830  -1.705  -3.010
   66    HA   PHE  10           HA       PHE  10  46.226  -2.138  -0.600
   67   1HB   PHE  10          2HB       PHE  10  48.474  -1.800   0.215
   68   2HB   PHE  10          1HB       PHE  10  48.703  -0.415  -0.844
   69    HD1  PHE  10           HD1      PHE  10  48.712   1.618   0.217
   70    HD2  PHE  10           HD2      PHE  10  46.226  -1.487   1.738
   71    HE1  PHE  10           HE1      PHE  10  47.904   3.126   1.980
   72    HE2  PHE  10           HE2      PHE  10  45.423   0.018   3.507
   73    HZ   PHE  10           HZ       PHE  10  46.259   2.335   3.623
   74    H    SER  11           H        SER  11  44.829  -0.436  -0.139
   75    HA   SER  11           HA       SER  11  44.205   1.186  -2.445
   76   1HB   SER  11          2HB       SER  11  41.911   1.190  -1.023
   77   2HB   SER  11          1HB       SER  11  42.297  -0.021  -2.247
   78    HG   SER  11           HG       SER  11  42.609  -1.480  -0.740
   79    H    CYS  12           H        CYS  12  45.037   3.107  -2.140
   80    HA   CYS  12           HA       CYS  12  45.237   4.418   0.344
   81   1HB   CYS  12          2HB       CYS  12  46.655   5.010  -1.583
   82   2HB   CYS  12          1HB       CYS  12  45.235   5.603  -2.438
   83    H    ALA  13           H        ALA  13  44.025   6.134   1.145
   84    HA   ALA  13           HA       ALA  13  41.542   5.753   1.779
   85   1HB   ALA  13          1HB       ALA  13  42.459   8.518   1.048
   86   2HB   ALA  13          2HB       ALA  13  42.889   7.663   2.532
   87   3HB   ALA  13          3HB       ALA  13  41.207   8.087   2.215
   88    H    SER  14           H        SER  14  40.191   4.813   0.411
   89    HA   SER  14           HA       SER  14  38.561   4.556  -1.142
   90   1HB   SER  14          2HB       SER  14  37.977   7.378  -0.237
   91   2HB   SER  14          1HB       SER  14  36.825   6.255  -0.964
   92    HG   SER  14           HG       SER  14  37.060   6.473   1.497
   93    H    GLY  15           H        GLY  15  40.189   4.544  -2.932
   94   1HA   GLY  15          2HA       GLY  15  39.116   5.355  -5.197
   95   2HA   GLY  15          1HA       GLY  15  39.857   6.860  -4.685
   96    H    ARG  16           H        ARG  16  42.248   5.692  -3.567
   97    HA   ARG  16           HA       ARG  16  43.562   5.456  -6.160
   98   1HB   ARG  16          2HB       ARG  16  44.701   6.099  -3.436
   99   2HB   ARG  16          1HB       ARG  16  45.656   5.969  -4.906
  100   1HG   ARG  16          2HG       ARG  16  45.307   8.264  -4.615
  101   2HG   ARG  16          1HG       ARG  16  44.148   7.790  -5.857
  102   1HD   ARG  16          2HD       ARG  16  42.548   7.462  -3.810
  103   2HD   ARG  16          1HD       ARG  16  43.675   8.559  -3.015
  104    HE   ARG  16           HE       ARG  16  43.070   9.806  -5.365
  105   1HH1  ARG  16          1HH1      ARG  16  41.210   8.580  -2.661
  106   2HH1  ARG  16          2HH1      ARG  16  39.881   9.659  -2.920
  107   1HH2  ARG  16          1HH2      ARG  16  41.328  11.242  -5.719
  108   2HH2  ARG  16          2HH2      ARG  16  39.959  11.201  -4.646
  109    H    CYS  17           H        CYS  17  45.464   3.998  -6.321
  110    HA   CYS  17           HA       CYS  17  45.125   1.532  -4.803
  111   1HB   CYS  17          2HB       CYS  17  43.769   1.729  -7.122
  112   2HB   CYS  17          1HB       CYS  17  45.333   1.228  -7.759
  113    H    ILE  18           H        ILE  18  47.070   1.019  -4.146
  114    HA   ILE  18           HA       ILE  18  49.377   1.654  -5.861
  115    HB   ILE  18           HB       ILE  18  50.635   2.336  -3.915
  116   1HG1  ILE  18          2HG1      ILE  18  48.873   2.537  -1.805
  117   2HG1  ILE  18          1HG1      ILE  18  48.475   0.971  -2.499
  118   1HG2  ILE  18          1HG2      ILE  18  47.889   3.576  -3.765
  119   2HG2  ILE  18          2HG2      ILE  18  49.164   4.055  -4.893
  120   3HG2  ILE  18          3HG2      ILE  18  49.386   4.285  -3.156
  121   1HD1  ILE  18          1HD1      ILE  18  50.819   0.297  -2.283
  122   2HD1  ILE  18          2HD1      ILE  18  50.105   0.739  -0.732
  123   3HD1  ILE  18          3HD1      ILE  18  51.188   1.860  -1.555
  124    HA   PRO  19           HA       PRO  19  50.438  -2.619  -5.000
  125   1HB   PRO  19          2HB       PRO  19  53.283  -1.976  -5.042
  126   2HB   PRO  19          1HB       PRO  19  52.339  -2.955  -6.172
  127   1HG   PRO  19          2HG       PRO  19  53.368  -0.518  -6.806
  128   2HG   PRO  19          1HG       PRO  19  51.899  -1.178  -7.543
  129   1HD   PRO  19          2HD       PRO  19  52.184   0.878  -5.389
  130   2HD   PRO  19          1HD       PRO  19  51.004   0.789  -6.714
  131    H    ILE  20           H        ILE  20  50.481  -3.598  -3.054
  132    HA   ILE  20           HA       ILE  20  50.656  -2.023  -0.733
  133    HB   ILE  20           HB       ILE  20  49.334  -4.130  -1.061
  134   1HG1  ILE  20          2HG1      ILE  20  50.979  -3.975   1.461
  135   2HG1  ILE  20          1HG1      ILE  20  49.561  -2.992   1.114
  136   1HG2  ILE  20          1HG2      ILE  20  50.405  -6.254  -0.424
  137   2HG2  ILE  20          2HG2      ILE  20  51.963  -5.432  -0.389
  138   3HG2  ILE  20          3HG2      ILE  20  51.078  -5.578  -1.907
  139   1HD1  ILE  20          1HD1      ILE  20  49.604  -5.984   1.391
  140   2HD1  ILE  20          2HD1      ILE  20  48.183  -4.999   1.056
  141   3HD1  ILE  20          3HD1      ILE  20  49.022  -4.835   2.596
  142    H    SER  21           H        SER  21  52.058  -2.273   1.094
  143    HA   SER  21           HA       SER  21  54.062  -2.444   2.170
  144   1HB   SER  21          2HB       SER  21  54.329  -4.589   0.664
  145   2HB   SER  21          1HB       SER  21  55.463  -3.573  -0.221
  146    HG   SER  21           HG       SER  21  56.087  -3.226   2.280
  147    H    TRP  22           H        TRP  22  53.175  -0.645  -0.295
  148    HA   TRP  22           HA       TRP  22  55.590   1.027  -0.249
  149   1HB   TRP  22          2HB       TRP  22  52.934   1.303  -1.653
  150   2HB   TRP  22          1HB       TRP  22  54.142   2.581  -1.654
  151    HD1  TRP  22           HD1      TRP  22  55.361  -0.990  -1.968
  152    HE1  TRP  22           HE1      TRP  22  56.229  -1.371  -4.352
  153    HE3  TRP  22           HE3      TRP  22  53.749   3.355  -4.110
  154    HZ2  TRP  22           HZ2      TRP  22  56.247  -0.002  -6.831
  155    HZ3  TRP  22           HZ3      TRP  22  54.239   3.748  -6.498
  156    HH2  TRP  22           HH2      TRP  22  55.457   2.103  -7.824
  157    H    THR  23           H        THR  23  53.428   0.444   2.010
  158    HA   THR  23           HA       THR  23  52.529   3.203   2.376
  159    HB   THR  23           HB       THR  23  50.607   2.022   1.885
  160    HG1  THR  23           HG1      THR  23  50.761   3.013   4.199
  161   1HG2  THR  23          1HG2      THR  23  51.425  -0.220   1.839
  162   2HG2  THR  23          2HG2      THR  23  50.013  -0.185   2.895
  163   3HG2  THR  23          3HG2      THR  23  51.632  -0.248   3.587
  164    H    CYS  24           H        CYS  24  51.860   0.961   4.849
  165    HA   CYS  24           HA       CYS  24  53.079   2.594   6.805
  166   1HB   CYS  24          2HB       CYS  24  51.805  -0.120   7.073
  167   2HB   CYS  24          1HB       CYS  24  52.060   1.046   8.369
  168    H    ASP  25           H        ASP  25  55.235   1.855   5.372
  169    HA   ASP  25           HA       ASP  25  56.729   0.213   7.189
  170   1HB   ASP  25          2HB       ASP  25  57.446  -1.395   5.339
  171   2HB   ASP  25          1HB       ASP  25  55.880  -1.647   6.088
  172    H    LEU  26           H        LEU  26  56.942   2.880   6.285
  173    HA   LEU  26           HA       LEU  26  58.680   4.314   6.071
  174   1HB   LEU  26          2HB       LEU  26  60.404   1.855   5.708
  175   2HB   LEU  26          1HB       LEU  26  60.998   3.482   5.974
  176    HG   LEU  26           HG       LEU  26  59.378   1.855   7.947
  177   1HD1  LEU  26          1HD1      LEU  26  61.462   1.841   9.248
  178   2HD1  LEU  26          2HD1      LEU  26  62.290   2.632   7.908
  179   3HD1  LEU  26          3HD1      LEU  26  61.635   1.010   7.703
  180   1HD2  LEU  26          1HD2      LEU  26  60.671   4.564   8.257
  181   2HD2  LEU  26          2HD2      LEU  26  59.807   3.663   9.505
  182   3HD2  LEU  26          3HD2      LEU  26  58.940   4.270   8.095
  183    H    ASP  27           H        ASP  27  57.157   3.077   3.781
  184    HA   ASP  27           HA       ASP  27  58.921   4.029   1.617
  185   1HB   ASP  27          2HB       ASP  27  57.798   1.640   1.617
  186   2HB   ASP  27          1HB       ASP  27  56.363   2.534   1.125
  187    H    ASP  28           H        ASP  28  56.770   4.689  -0.231
  188    HA   ASP  28           HA       ASP  28  55.123   6.523   1.315
  189   1HB   ASP  28          2HB       ASP  28  55.786   8.543   0.238
  190   2HB   ASP  28          1HB       ASP  28  57.241   7.770   0.844
  191    H    ASP  29           H        ASP  29  53.148   6.314   0.660
  192    HA   ASP  29           HA       ASP  29  52.643   6.763  -2.164
  193   1HB   ASP  29          2HB       ASP  29  50.815   5.172  -2.299
  194   2HB   ASP  29          1HB       ASP  29  52.297   4.345  -1.859
  195    H    CYS  30           H        CYS  30  50.251   6.165   0.324
  196    HA   CYS  30           HA       CYS  30  50.047   8.796   1.261
  197   1HB   CYS  30          2HB       CYS  30  47.654   9.154   0.386
  198   2HB   CYS  30          1HB       CYS  30  48.997   9.547  -0.686
  199    H    GLY  31           H        GLY  31  48.765   5.592   0.825
  200   1HA   GLY  31          2HA       GLY  31  47.651   4.205   2.256
  201   2HA   GLY  31          1HA       GLY  31  48.252   5.235   3.547
  202    H    ASP  32           H        ASP  32  47.014   6.822   4.362
  203    HA   ASP  32           HA       ASP  32  44.300   7.217   3.325
  204   1HB   ASP  32          2HB       ASP  32  44.907   6.174   6.098
  205   2HB   ASP  32          1HB       ASP  32  43.390   6.972   5.701
  206    H    ARG  33           H        ARG  33  46.704   8.763   3.419
  207    HA   ARG  33           HA       ARG  33  47.561  10.786   3.989
  208   1HB   ARG  33          2HB       ARG  33  45.185  11.599   3.688
  209   2HB   ARG  33          1HB       ARG  33  44.953  11.360   5.416
  210   1HG   ARG  33          2HG       ARG  33  46.780  12.952   5.852
  211   2HG   ARG  33          1HG       ARG  33  46.917  13.229   4.116
  212   1HD   ARG  33          2HD       ARG  33  44.476  13.754   5.805
  213   2HD   ARG  33          1HD       ARG  33  45.592  14.978   5.203
  214    HE   ARG  33           HE       ARG  33  44.408  13.345   3.142
  215   1HH1  ARG  33          1HH1      ARG  33  44.025  16.197   5.113
  216   2HH1  ARG  33          2HH1      ARG  33  42.957  16.993   4.005
  217   1HH2  ARG  33          1HH2      ARG  33  43.001  14.375   1.651
  218   2HH2  ARG  33          2HH2      ARG  33  42.372  15.947   2.017
  219    H    SER  34           H        SER  34  47.402   8.343   5.610
  220    HA   SER  34           HA       SER  34  48.753   9.307   7.971
  221   1HB   SER  34          2HB       SER  34  46.276   7.558   8.180
  222   2HB   SER  34          1HB       SER  34  47.348   7.976   9.517
  223    HG   SER  34           HG       SER  34  46.585  10.208   8.249
  224    H    ASP  35           H        ASP  35  49.248   7.902   5.472
  225    HA   ASP  35           HA       ASP  35  49.339   5.131   5.612
  226   1HB   ASP  35          2HB       ASP  35  51.275   5.393   3.962
  227   2HB   ASP  35          1HB       ASP  35  49.741   6.138   3.520
  228    H    GLU  36           H        GLU  36  51.401   7.410   7.122
  229    HA   GLU  36           HA       GLU  36  53.304   5.282   7.769
  230   1HB   GLU  36          2HB       GLU  36  53.587   8.169   7.312
  231   2HB   GLU  36          1HB       GLU  36  54.539   7.530   8.649
  232   1HG   GLU  36          2HG       GLU  36  54.571   6.568   5.803
  233   2HG   GLU  36          1HG       GLU  36  55.839   7.485   6.623
  234    H    SER  37           H        SER  37  52.478   4.285   9.457
  235    HA   SER  37           HA       SER  37  52.465   3.759  11.656
  236   1HB   SER  37          2HB       SER  37  54.563   5.030  11.745
  237   2HB   SER  37          1HB       SER  37  53.658   6.512  12.040
  238    HG   SER  37           HG       SER  37  52.784   5.249  13.932
  239    H    ALA  38           H        ALA  38  50.382   5.857  10.356
  240    HA   ALA  38           HA       ALA  38  49.062   6.366  12.931
  241   1HB   ALA  38          1HB       ALA  38  48.684   7.897  10.367
  242   2HB   ALA  38          2HB       ALA  38  49.704   8.402  11.714
  243   3HB   ALA  38          3HB       ALA  38  47.959   8.267  11.931
  244    H    SER  39           H        SER  39  48.834   4.630  10.042
  245    HA   SER  39           HA       SER  39  45.968   4.162  10.472
  246   1HB   SER  39          2HB       SER  39  46.119   3.089   8.169
  247   2HB   SER  39          1HB       SER  39  46.366   4.836   8.221
  248    HG   SER  39           HG       SER  39  47.951   3.217   7.081
  249    H    CYS  40           H        CYS  40  48.977   2.429   9.708
  250    HA   CYS  40           HA       CYS  40  47.744  -0.069  10.545
  251   1HB   CYS  40          2HB       CYS  40  50.526   0.310   9.450
  252   2HB   CYS  40          1HB       CYS  40  49.581  -1.173   9.514
  253    H    ALA  41           H        ALA  41  48.284  -1.125  12.375
  254    HA   ALA  41           HA       ALA  41  49.955   0.089  14.334
  255   1HB   ALA  41          1HB       ALA  41  49.590  -1.960  15.610
  256   2HB   ALA  41          2HB       ALA  41  48.876  -2.726  14.191
  257   3HB   ALA  41          3HB       ALA  41  48.081  -1.344  14.942
  258    H    TYR  42           H        TYR  42  51.895   0.429  13.391
  259    HA   TYR  42           HA       TYR  42  53.401  -0.916  11.677
  260   1HB   TYR  42          2HB       TYR  42  53.865   1.080  13.637
  261   2HB   TYR  42          1HB       TYR  42  55.224  -0.039  13.674
  262    HD1  TYR  42           HD1      TYR  42  56.988   0.425  12.294
  263    HD2  TYR  42           HD2      TYR  42  53.096   1.692  11.147
  264    HE1  TYR  42           HE1      TYR  42  57.933   1.473  10.289
  265    HE2  TYR  42           HE2      TYR  42  54.017   2.746   9.134
  266    HH   TYR  42           HH       TYR  42  56.255   3.679   8.389
  267    HA   PRO  43           HA       PRO  43  54.959  -4.582  13.767
  268   1HB   PRO  43          2HB       PRO  43  54.959  -6.171  11.614
  269   2HB   PRO  43          1HB       PRO  43  53.466  -5.873  12.517
  270   1HG   PRO  43          2HG       PRO  43  54.367  -4.747   9.910
  271   2HG   PRO  43          1HG       PRO  43  52.732  -5.155  10.450
  272   1HD   PRO  43          2HD       PRO  43  53.885  -2.595  10.423
  273   2HD   PRO  43          1HD       PRO  43  52.394  -3.061  11.261
  274    H    THR  44           H        THR  44  55.770  -2.417  11.416
  275    HA   THR  44           HA       THR  44  57.688  -1.553  10.659
  276    HB   THR  44           HB       THR  44  59.092  -3.503  12.475
  277    HG1  THR  44           HG1      THR  44  58.045  -2.175  13.834
  278   1HG2  THR  44          1HG2      THR  44  61.006  -2.060  12.171
  279   2HG2  THR  44          2HG2      THR  44  60.050  -0.959  11.173
  280   3HG2  THR  44          3HG2      THR  44  60.414  -2.586  10.587
  281    H    CYS  45           H        CYS  45  57.323  -2.263   8.597
  282    HA   CYS  45           HA       CYS  45  58.303  -2.824   6.629
  283   1HB   CYS  45          2HB       CYS  45  60.429  -4.223   8.249
  284   2HB   CYS  45          1HB       CYS  45  60.537  -3.726   6.566
  285    H    PHE  46           H        PHE  46  57.850  -4.327   5.203
  286    HA   PHE  46           HA       PHE  46  57.711  -7.122   6.020
  287   1HB   PHE  46          2HB       PHE  46  55.443  -6.797   4.405
  288   2HB   PHE  46          1HB       PHE  46  55.481  -7.210   6.112
  289    HD1  PHE  46           HD1      PHE  46  55.546  -5.196   7.775
  290    HD2  PHE  46           HD2      PHE  46  54.370  -4.893   3.694
  291    HE1  PHE  46           HE1      PHE  46  54.329  -3.122   8.287
  292    HE2  PHE  46           HE2      PHE  46  53.159  -2.816   4.186
  293    HZ   PHE  46           HZ       PHE  46  53.125  -1.926   6.490
  294    HA   PRO  47           HA       PRO  47  59.510  -7.565   2.028
  295   1HB   PRO  47          2HB       PRO  47  58.956 -10.405   2.145
  296   2HB   PRO  47          1HB       PRO  47  60.496  -9.568   2.345
  297   1HG   PRO  47          2HG       PRO  47  59.235 -10.856   4.384
  298   2HG   PRO  47          1HG       PRO  47  60.285  -9.447   4.624
  299   1HD   PRO  47          2HD       PRO  47  57.290  -9.582   4.509
  300   2HD   PRO  47          1HD       PRO  47  58.336  -8.681   5.631
  301    H    LEU  48           H        LEU  48  56.653  -6.891   1.989
  302    HA   LEU  48           HA       LEU  48  55.356  -8.690   0.163
  303   1HB   LEU  48          2HB       LEU  48  54.687  -5.780   0.662
  304   2HB   LEU  48          1HB       LEU  48  53.646  -6.990  -0.062
  305    HG   LEU  48           HG       LEU  48  54.575  -7.010   2.816
  306   1HD1  LEU  48          1HD1      LEU  48  52.258  -6.410   3.336
  307   2HD1  LEU  48          2HD1      LEU  48  51.905  -6.273   1.613
  308   3HD1  LEU  48          3HD1      LEU  48  53.044  -5.159   2.374
  309   1HD2  LEU  48          1HD2      LEU  48  54.143  -9.245   1.909
  310   2HD2  LEU  48          2HD2      LEU  48  52.545  -8.721   1.385
  311   3HD2  LEU  48          3HD2      LEU  48  52.932  -8.779   3.104
  312    H    THR  49           H        THR  49  57.085  -5.628  -0.080
  313    HA   THR  49           HA       THR  49  58.061  -6.302  -2.689
  314    HB   THR  49           HB       THR  49  55.755  -5.396  -3.165
  315    HG1  THR  49           HG1      THR  49  57.136  -5.217  -4.852
  316   1HG2  THR  49          1HG2      THR  49  56.941  -2.795  -2.191
  317   2HG2  THR  49          2HG2      THR  49  55.647  -3.701  -1.400
  318   3HG2  THR  49          3HG2      THR  49  55.381  -2.983  -2.991
  319    H    GLN  50           H        GLN  50  59.424  -5.953  -0.401
  320    HA   GLN  50           HA       GLN  50  60.600  -3.274  -0.584
  321   1HB   GLN  50          2HB       GLN  50  60.083  -4.864   1.938
  322   2HB   GLN  50          1HB       GLN  50  61.021  -3.380   1.863
  323   1HG   GLN  50          2HG       GLN  50  58.845  -2.386   0.843
  324   2HG   GLN  50          1HG       GLN  50  58.085  -3.786   1.608
  325   1HE2  GLN  50          1HE2      GLN  50  59.527  -0.717   2.083
  326   2HE2  GLN  50          2HE2      GLN  50  59.279  -0.618   3.792
  327    H    PHE  51           H        PHE  51  62.745  -3.169   0.384
  328    HA   PHE  51           HA       PHE  51  64.204  -5.717   0.505
  329   1HB   PHE  51          2HB       PHE  51  64.762  -4.588  -1.626
  330   2HB   PHE  51          1HB       PHE  51  65.192  -3.129  -0.743
  331    HD1  PHE  51           HD1      PHE  51  67.370  -2.805  -0.006
  332    HD2  PHE  51           HD2      PHE  51  66.106  -6.709  -1.122
  333    HE1  PHE  51           HE1      PHE  51  69.689  -3.608   0.200
  334    HE2  PHE  51           HE2      PHE  51  68.417  -7.525  -0.915
  335    HZ   PHE  51           HZ       PHE  51  70.209  -5.969  -0.255
  336    H    THR  52           H        THR  52  66.151  -5.491   1.942
  337    HA   THR  52           HA       THR  52  65.501  -3.582   4.070
  338    HB   THR  52           HB       THR  52  67.140  -6.114   4.304
  339    HG1  THR  52           HG1      THR  52  64.586  -5.942   5.413
  340   1HG2  THR  52          1HG2      THR  52  67.590  -4.458   6.049
  341   2HG2  THR  52          2HG2      THR  52  66.715  -5.839   6.709
  342   3HG2  THR  52          3HG2      THR  52  65.862  -4.332   6.384
  343    H    CYS  53           H        CYS  53  66.656  -1.804   3.505
  344    HA   CYS  53           HA       CYS  53  69.287  -1.651   2.613
  345   1HB   CYS  53          2HB       CYS  53  67.491   0.200   3.046
  346   2HB   CYS  53          1HB       CYS  53  68.229   0.277   4.643
  347    H    ASN  54           H        ASN  54  71.183  -2.160   3.537
  348    HA   ASN  54           HA       ASN  54  71.214  -3.668   5.889
  349   1HB   ASN  54          2HB       ASN  54  73.398  -4.122   5.403
  350   2HB   ASN  54          1HB       ASN  54  72.895  -3.492   3.840
  351   1HD2  ASN  54          1HD2      ASN  54  73.344  -1.239   3.407
  352   2HD2  ASN  54          2HD2      ASN  54  74.738  -0.504   4.122
  353    H    ASN  55           H        ASN  55  71.696  -0.237   5.420
  354    HA   ASN  55           HA       ASN  55  72.807   0.159   8.017
  355   1HB   ASN  55          2HB       ASN  55  71.964   1.991   5.809
  356   2HB   ASN  55          1HB       ASN  55  72.302   2.644   7.411
  357   1HD2  ASN  55          1HD2      ASN  55  74.090   3.782   6.611
  358   2HD2  ASN  55          2HD2      ASN  55  75.571   2.985   6.225
  359    H    GLY  56           H        GLY  56  69.921  -0.953   7.557
  360   1HA   GLY  56          2HA       GLY  56  68.632  -1.172   9.578
  361   2HA   GLY  56          1HA       GLY  56  68.975   0.510   9.935
  362    H    ARG  57           H        ARG  57  68.277   0.670   6.794
  363    HA   ARG  57           HA       ARG  57  65.529   1.464   7.371
  364   1HB   ARG  57          2HB       ARG  57  67.070   1.733   4.792
  365   2HB   ARG  57          1HB       ARG  57  65.564   2.532   5.206
  366   1HG   ARG  57          2HG       ARG  57  66.574   4.059   6.554
  367   2HG   ARG  57          1HG       ARG  57  67.938   2.990   6.927
  368   1HD   ARG  57          2HD       ARG  57  68.581   3.207   4.491
  369   2HD   ARG  57          1HD       ARG  57  67.401   4.516   4.392
  370    HE   ARG  57           HE       ARG  57  68.770   5.591   6.215
  371   1HH1  ARG  57          1HH1      ARG  57  70.152   3.341   3.911
  372   2HH1  ARG  57          2HH1      ARG  57  71.762   3.994   4.030
  373   1HH2  ARG  57          1HH2      ARG  57  70.913   6.445   6.380
  374   2HH2  ARG  57          2HH2      ARG  57  72.191   5.733   5.430
  375    H    CYS  58           H        CYS  58  63.733   0.708   6.167
  376    HA   CYS  58           HA       CYS  58  64.223  -1.655   4.495
  377   1HB   CYS  58          2HB       CYS  58  61.539  -0.695   5.487
  378   2HB   CYS  58          1HB       CYS  58  61.987  -2.305   4.928
  379    H    ILE  59           H        ILE  59  64.166  -1.295   2.342
  380    HA   ILE  59           HA       ILE  59  62.953   1.233   1.487
  381    HB   ILE  59           HB       ILE  59  64.447   1.235  -0.449
  382   1HG1  ILE  59          2HG1      ILE  59  65.878  -1.096   0.825
  383   2HG1  ILE  59          1HG1      ILE  59  64.705  -1.291  -0.476
  384   1HG2  ILE  59          1HG2      ILE  59  65.125   2.416   1.564
  385   2HG2  ILE  59          2HG2      ILE  59  66.532   1.735   0.741
  386   3HG2  ILE  59          3HG2      ILE  59  65.884   0.950   2.182
  387   1HD1  ILE  59          1HD1      ILE  59  66.996  -1.292  -1.294
  388   2HD1  ILE  59          2HD1      ILE  59  67.235   0.323  -0.628
  389   3HD1  ILE  59          3HD1      ILE  59  66.076   0.070  -1.936
  390    H    ASN  60           H        ASN  60  62.413   1.124  -0.983
  391    HA   ASN  60           HA       ASN  60  60.432  -0.922  -1.323
  392   1HB   ASN  60          2HB       ASN  60  60.428   1.546  -2.157
  393   2HB   ASN  60          1HB       ASN  60  61.378   0.925  -3.503
  394   1HD2  ASN  60          1HD2      ASN  60  58.307   1.205  -2.070
  395   2HD2  ASN  60          2HD2      ASN  60  57.405   0.373  -3.301
  396    H    ILE  61           H        ILE  61  60.448  -2.661  -2.799
  397    HA   ILE  61           HA       ILE  61  63.053  -3.685  -3.374
  398    HB   ILE  61           HB       ILE  61  60.953  -5.069  -2.826
  399   1HG1  ILE  61          2HG1      ILE  61  62.770  -5.844  -5.122
  400   2HG1  ILE  61          1HG1      ILE  61  63.149  -6.008  -3.412
  401   1HG2  ILE  61          1HG2      ILE  61  59.742  -5.894  -4.820
  402   2HG2  ILE  61          2HG2      ILE  61  60.584  -4.694  -5.800
  403   3HG2  ILE  61          3HG2      ILE  61  59.477  -4.176  -4.532
  404   1HD1  ILE  61          1HD1      ILE  61  61.352  -7.628  -3.161
  405   2HD1  ILE  61          2HD1      ILE  61  62.504  -8.134  -4.398
  406   3HD1  ILE  61          3HD1      ILE  61  60.949  -7.450  -4.868
  407    H    ASN  62           H        ASN  62  60.850  -1.711  -5.038
  408    HA   ASN  62           HA       ASN  62  61.643  -2.532  -7.707
  409   1HB   ASN  62          2HB       ASN  62  59.294  -1.679  -6.852
  410   2HB   ASN  62          1HB       ASN  62  59.986  -0.095  -7.168
  411   1HD2  ASN  62          1HD2      ASN  62  61.548  -0.927  -9.457
  412   2HD2  ASN  62          2HD2      ASN  62  60.426  -1.226 -10.736
  413    H    TRP  63           H        TRP  63  63.523  -1.233  -5.727
  414    HA   TRP  63           HA       TRP  63  64.317   1.065  -7.376
  415   1HB   TRP  63          2HB       TRP  63  65.102   0.328  -4.552
  416   2HB   TRP  63          1HB       TRP  63  65.831   1.646  -5.457
  417    HD1  TRP  63           HD1      TRP  63  62.185   1.514  -6.118
  418    HE1  TRP  63           HE1      TRP  63  60.963   3.319  -4.743
  419    HE3  TRP  63           HE3      TRP  63  65.977   2.804  -2.955
  420    HZ2  TRP  63           HZ2      TRP  63  61.545   5.058  -2.603
  421    HZ3  TRP  63           HZ3      TRP  63  65.567   4.549  -1.262
  422    HH2  TRP  63           HH2      TRP  63  63.394   5.653  -1.092
  423    H    ARG  64           H        ARG  64  64.795  -2.102  -7.351
  424    HA   ARG  64           HA       ARG  64  67.640  -2.206  -7.866
  425   1HB   ARG  64          2HB       ARG  64  65.622  -4.099  -9.090
  426   2HB   ARG  64          1HB       ARG  64  67.287  -4.418  -8.651
  427   1HG   ARG  64          2HG       ARG  64  65.118  -3.928  -6.638
  428   2HG   ARG  64          1HG       ARG  64  65.533  -5.524  -7.249
  429   1HD   ARG  64          2HD       ARG  64  67.428  -3.663  -5.818
  430   2HD   ARG  64          1HD       ARG  64  66.568  -5.000  -5.067
  431    HE   ARG  64           HE       ARG  64  69.020  -5.155  -6.372
  432   1HH1  ARG  64          1HH1      ARG  64  65.967  -6.887  -6.393
  433   2HH1  ARG  64          2HH1      ARG  64  66.699  -8.416  -6.740
  434   1HH2  ARG  64          1HH2      ARG  64  69.993  -7.152  -6.795
  435   2HH2  ARG  64          2HH2      ARG  64  68.995  -8.570  -6.971
  436    H    CYS  65           H        CYS  65  68.333  -0.862  -9.543
  437    HA   CYS  65           HA       CYS  65  66.483  -0.563 -11.806
  438   1HB   CYS  65          2HB       CYS  65  68.472   1.395 -10.690
  439   2HB   CYS  65          1HB       CYS  65  67.606   1.638 -12.200
  440    H    ASP  66           H        ASP  66  69.873   0.278 -11.511
  441    HA   ASP  66           HA       ASP  66  70.238  -0.452 -14.277
  442   1HB   ASP  66          2HB       ASP  66  72.504   0.553 -13.957
  443   2HB   ASP  66          1HB       ASP  66  71.177   1.638 -13.561
  444    H    ASN  67           H        ASN  67  71.664  -1.441 -11.174
  445    HA   ASN  67           HA       ASN  67  72.362  -3.959 -12.456
  446   1HB   ASN  67          2HB       ASN  67  74.118  -2.414 -10.547
  447   2HB   ASN  67          1HB       ASN  67  74.426  -4.070 -11.057
  448   1HD2  ASN  67          1HD2      ASN  67  74.388  -0.727 -12.005
  449   2HD2  ASN  67          2HD2      ASN  67  75.282  -0.933 -13.471
  450    H    ASP  68           H        ASP  68  72.232  -2.392  -9.242
  451    HA   ASP  68           HA       ASP  68  70.453  -4.596  -8.456
  452   1HB   ASP  68          2HB       ASP  68  72.887  -4.713  -7.495
  453   2HB   ASP  68          1HB       ASP  68  72.330  -3.420  -6.433
  454    H    ASN  69           H        ASN  69  70.847  -2.840  -5.741
  455    HA   ASN  69           HA       ASN  69  68.253  -1.563  -6.308
  456   1HB   ASN  69          2HB       ASN  69  68.793  -3.426  -4.476
  457   2HB   ASN  69          1HB       ASN  69  69.289  -2.029  -3.537
  458   1HD2  ASN  69          1HD2      ASN  69  67.190  -0.337  -4.777
  459   2HD2  ASN  69          2HD2      ASN  69  65.728  -0.829  -3.993
  460    H    ASP  70           H        ASP  70  68.310   0.052  -3.848
  461    HA   ASP  70           HA       ASP  70  70.380   1.997  -4.433
  462   1HB   ASP  70          2HB       ASP  70  68.148   2.218  -5.921
  463   2HB   ASP  70          1HB       ASP  70  67.648   3.143  -4.505
  464    H    CYS  71           H        CYS  71  71.092   2.634  -2.551
  465    HA   CYS  71           HA       CYS  71  69.171   3.397  -0.474
  466   1HB   CYS  71          2HB       CYS  71  71.380   1.434  -0.237
  467   2HB   CYS  71          1HB       CYS  71  71.186   2.565   1.096
  468    H    GLY  72           H        GLY  72  72.683   3.402  -1.150
  469   1HA   GLY  72          2HA       GLY  72  73.472   5.741  -1.768
  470   2HA   GLY  72          1HA       GLY  72  72.737   6.202  -0.241
  471    H    ASP  73           H        ASP  73  73.587   3.945   1.311
  472    HA   ASP  73           HA       ASP  73  76.406   4.724   1.486
  473   1HB   ASP  73          2HB       ASP  73  76.018   4.144   4.004
  474   2HB   ASP  73          1HB       ASP  73  75.545   5.711   3.365
  475    H    ASN  74           H        ASN  74  76.551   2.842   0.009
  476    HA   ASN  74           HA       ASN  74  77.641   0.878  -0.338
  477   1HB   ASN  74          2HB       ASN  74  78.957   1.965   1.646
  478   2HB   ASN  74          1HB       ASN  74  78.231   0.678   2.599
  479   1HD2  ASN  74          1HD2      ASN  74  78.320  -1.329   0.508
  480   2HD2  ASN  74          2HD2      ASN  74  79.984  -1.745   0.288
  481    H    SER  75           H        SER  75  74.849   0.751   0.198
  482    HA   SER  75           HA       SER  75  74.488  -1.721   1.684
  483   1HB   SER  75          2HB       SER  75  72.873   0.228   1.830
  484   2HB   SER  75          1HB       SER  75  72.403  -0.134   0.170
  485    HG   SER  75           HG       SER  75  71.093  -1.538   0.985
  486    H    ASP  76           H        ASP  76  72.205  -1.844  -0.543
  487    HA   ASP  76           HA       ASP  76  72.893  -3.981  -2.091
  488   1HB   ASP  76          2HB       ASP  76  71.314  -2.659  -3.792
  489   2HB   ASP  76          1HB       ASP  76  70.687  -3.321  -2.278
  490    H    GLU  77           H        GLU  77  73.071  -0.598  -3.120
  491    HA   GLU  77           HA       GLU  77  75.533  -0.813  -4.491
  492   1HB   GLU  77          2HB       GLU  77  74.437  -2.137  -6.115
  493   2HB   GLU  77          1HB       GLU  77  73.005  -1.116  -6.091
  494   1HG   GLU  77          2HG       GLU  77  74.357   0.705  -7.088
  495   2HG   GLU  77          1HG       GLU  77  75.710  -0.418  -7.204
  496    H    ALA  78           H        ALA  78  72.406   0.696  -4.919
  497    HA   ALA  78           HA       ALA  78  71.703   2.832  -5.151
  498   1HB   ALA  78          1HB       ALA  78  72.852   4.634  -4.020
  499   2HB   ALA  78          2HB       ALA  78  74.280   3.623  -3.807
  500   3HB   ALA  78          3HB       ALA  78  72.775   3.214  -2.980
  501    H    GLY  79           H        GLY  79  71.924   2.463  -7.428
  502   1HA   GLY  79          2HA       GLY  79  73.848   4.357  -8.609
  503   2HA   GLY  79          1HA       GLY  79  73.659   2.753  -9.309
  504    H    CYS  80           H        CYS  80  70.775   3.811  -8.023
  505    HA   CYS  80           HA       CYS  80  69.709   4.253 -10.710
  506   1HB   CYS  80          2HB       CYS  80  68.701   2.524  -9.250
  507   2HB   CYS  80          1HB       CYS  80  68.303   3.766  -8.075
  508    H    SER  81           H        SER  81  70.445   5.901  -7.788
  509    HA   SER  81           HA       SER  81  68.631   8.073  -8.055
  510   1HB   SER  81          2HB       SER  81  70.892   8.919  -6.589
  511   2HB   SER  81          1HB       SER  81  69.352   8.346  -5.953
  512    HG   SER  81           HG       SER  81  70.158   6.317  -5.743
  513    H    HIS  82           HN       HIS  82  68.709   9.700  -9.460
  514    HA   HIS  82           HA       HIS  82  71.283  10.493 -10.610
  515   1HB   HIS  82          2HB       HIS  82  70.263   8.907 -12.172
  516   2HB   HIS  82          1HB       HIS  82  68.777   9.846 -12.187
  517    HD1  HIS  82           HD1      HIS  82  69.059  12.342 -13.278
  518    HD2  HIS  82           HD2      HIS  82  72.072   9.588 -14.047
  519    HE1  HIS  82           HE1      HIS  82  70.302  13.197 -15.313
  Start of MODEL    4
    1   1H    SER   1          1HT       SER   1  41.137  -4.528   0.216
    2   2H    SER   1          2HT       SER   1  41.995  -5.259  -1.042
    3   3H    SER   1          3HT       SER   1  42.623  -5.270   0.530
    4    HA   SER   1           HA       SER   1  41.715  -7.413  -0.070
    5   1HB   SER   1          2HB       SER   1  39.999  -6.050   2.017
    6   2HB   SER   1          1HB       SER   1  40.467  -7.752   1.951
    7    HG   SER   1           HG       SER   1  42.202  -7.221   3.003
    8    H    ALA   2           H        ALA   2  38.822  -5.507   0.729
    9    HA   ALA   2           HA       ALA   2  37.613  -6.191  -1.844
   10   1HB   ALA   2          1HB       ALA   2  36.904  -7.977  -0.323
   11   2HB   ALA   2          2HB       ALA   2  35.542  -6.947  -0.770
   12   3HB   ALA   2          3HB       ALA   2  36.299  -6.772   0.814
   13    H    ARG   3           H        ARG   3  36.253  -4.600  -2.589
   14    HA   ARG   3           HA       ARG   3  35.469  -2.482  -2.859
   15   1HB   ARG   3          2HB       ARG   3  34.034  -2.762  -0.946
   16   2HB   ARG   3          1HB       ARG   3  35.377  -2.526   0.163
   17   1HG   ARG   3          2HG       ARG   3  35.435  -0.189  -1.240
   18   2HG   ARG   3          1HG       ARG   3  33.708  -0.551  -1.224
   19   1HD   ARG   3          2HD       ARG   3  33.777  -0.795   1.207
   20   2HD   ARG   3          1HD       ARG   3  35.504  -0.438   1.193
   21    HE   ARG   3           HE       ARG   3  33.335   1.451   0.607
   22   1HH1  ARG   3          1HH1      ARG   3  36.729   0.832   1.238
   23   2HH1  ARG   3          2HH1      ARG   3  37.108   2.505   1.492
   24   1HH2  ARG   3          1HH2      ARG   3  33.849   3.659   0.957
   25   2HH2  ARG   3          2HH2      ARG   3  35.485   4.109   1.338
   26    H    THR   4           H        THR   4  37.524  -2.341   0.020
   27    HA   THR   4           HA       THR   4  38.936  -0.028  -0.937
   28    HB   THR   4           HB       THR   4  39.648  -1.791   1.416
   29    HG1  THR   4           HG1      THR   4  38.129  -0.742   2.595
   30   1HG2  THR   4          1HG2      THR   4  41.323  -0.109   0.825
   31   2HG2  THR   4          2HG2      THR   4  40.541   0.300   2.353
   32   3HG2  THR   4          3HG2      THR   4  40.090   1.151   0.874
   33    H    CYS   5           H        CYS   5  39.533  -1.194  -2.955
   34    HA   CYS   5           HA       CYS   5  41.192  -1.901  -4.324
   35   1HB   CYS   5          2HB       CYS   5  42.546  -0.982  -2.058
   36   2HB   CYS   5          1HB       CYS   5  43.236  -2.574  -2.362
   37    HA   PRO   6           HA       PRO   6  40.845  -6.341  -4.564
   38   1HB   PRO   6          2HB       PRO   6  43.694  -6.311  -5.458
   39   2HB   PRO   6          1HB       PRO   6  42.279  -7.048  -6.219
   40   1HG   PRO   6          2HG       PRO   6  43.314  -4.804  -7.182
   41   2HG   PRO   6          1HG       PRO   6  41.554  -5.040  -7.126
   42   1HD   PRO   6          2HD       PRO   6  43.316  -3.389  -5.367
   43   2HD   PRO   6          1HD       PRO   6  41.670  -3.057  -5.948
   44    HA   PRO   7           HA       PRO   7  42.438  -8.685  -1.162
   45   1HB   PRO   7          2HB       PRO   7  44.138 -10.226  -3.086
   46   2HB   PRO   7          1HB       PRO   7  43.112 -10.816  -1.772
   47   1HG   PRO   7          2HG       PRO   7  42.281 -10.928  -4.297
   48   2HG   PRO   7          1HG       PRO   7  41.161 -10.519  -2.987
   49   1HD   PRO   7          2HD       PRO   7  42.337  -8.779  -5.080
   50   2HD   PRO   7          1HD       PRO   7  40.799  -8.621  -4.211
   51    H    ASN   8           H        ASN   8  45.243  -8.613  -3.389
   52    HA   ASN   8           HA       ASN   8  47.014  -8.057  -1.159
   53   1HB   ASN   8          2HB       ASN   8  47.518  -9.703  -3.044
   54   2HB   ASN   8          1HB       ASN   8  47.772  -8.299  -4.074
   55   1HD2  ASN   8          1HD2      ASN   8  49.657  -7.157  -3.899
   56   2HD2  ASN   8          2HD2      ASN   8  50.969  -7.626  -2.880
   57    H    GLN   9           H        GLN   9  45.081  -6.046  -1.942
   58    HA   GLN   9           HA       GLN   9  46.919  -3.889  -2.681
   59   1HB   GLN   9          2HB       GLN   9  44.458  -4.719  -4.028
   60   2HB   GLN   9          1HB       GLN   9  44.507  -3.009  -3.634
   61   1HG   GLN   9          2HG       GLN   9  45.440  -2.950  -5.684
   62   2HG   GLN   9          1HG       GLN   9  46.890  -3.166  -4.708
   63   1HE2  GLN   9          1HE2      GLN   9  47.880  -5.218  -4.666
   64   2HE2  GLN   9          2HE2      GLN   9  47.579  -6.389  -5.894
   65    H    PHE  10           H        PHE  10  46.261  -1.802  -2.021
   66    HA   PHE  10           HA       PHE  10  44.392  -1.670   0.228
   67   1HB   PHE  10          2HB       PHE  10  46.506  -1.947   1.305
   68   2HB   PHE  10          1HB       PHE  10  47.299  -0.844   0.188
   69    HD1  PHE  10           HD1      PHE  10  44.834  -1.017   2.948
   70    HD2  PHE  10           HD2      PHE  10  47.447   1.431   0.647
   71    HE1  PHE  10           HE1      PHE  10  44.480   0.838   4.524
   72    HE2  PHE  10           HE2      PHE  10  47.093   3.289   2.215
   73    HZ   PHE  10           HZ       PHE  10  45.620   2.993   4.156
   74    H    SER  11           H        SER  11  43.189   0.154   0.152
   75    HA   SER  11           HA       SER  11  43.799   2.075  -1.923
   76   1HB   SER  11          2HB       SER  11  41.206   1.395  -0.548
   77   2HB   SER  11          1HB       SER  11  41.386   2.763  -1.644
   78    HG   SER  11           HG       SER  11  41.720   1.397  -3.313
   79    H    CYS  12           H        CYS  12  44.716   3.880  -1.283
   80    HA   CYS  12           HA       CYS  12  44.604   5.050   1.249
   81   1HB   CYS  12          2HB       CYS  12  46.229   5.952  -0.229
   82   2HB   CYS  12          1HB       CYS  12  45.039   6.222  -1.497
   83    H    ALA  13           H        ALA  13  43.330   6.909   1.943
   84    HA   ALA  13           HA       ALA  13  40.888   6.257   2.577
   85   1HB   ALA  13          1HB       ALA  13  41.981   8.318   3.311
   86   2HB   ALA  13          2HB       ALA  13  40.281   8.576   2.912
   87   3HB   ALA  13          3HB       ALA  13  41.543   9.083   1.785
   88    H    SER  14           H        SER  14  39.792   5.080   1.113
   89    HA   SER  14           HA       SER  14  38.542   4.556  -0.741
   90   1HB   SER  14          2HB       SER  14  36.883   6.826   0.352
   91   2HB   SER  14          1HB       SER  14  36.322   5.357  -0.451
   92    HG   SER  14           HG       SER  14  37.319   5.697   2.156
   93    H    GLY  15           H        GLY  15  40.105   5.334  -2.329
   94   1HA   GLY  15          2HA       GLY  15  38.830   6.725  -4.390
   95   2HA   GLY  15          1HA       GLY  15  39.873   7.868  -3.554
   96    H    ARG  16           H        ARG  16  41.987   6.249  -2.879
   97    HA   ARG  16           HA       ARG  16  43.225   5.864  -5.491
   98   1HB   ARG  16          2HB       ARG  16  44.451   5.830  -2.721
   99   2HB   ARG  16          1HB       ARG  16  45.343   5.723  -4.230
  100   1HG   ARG  16          2HG       ARG  16  45.567   7.947  -3.493
  101   2HG   ARG  16          1HG       ARG  16  44.402   7.988  -4.816
  102   1HD   ARG  16          2HD       ARG  16  42.563   8.100  -3.231
  103   2HD   ARG  16          1HD       ARG  16  43.680   7.965  -1.875
  104    HE   ARG  16           HE       ARG  16  44.458  10.178  -3.357
  105   1HH1  ARG  16          1HH1      ARG  16  41.666   9.138  -1.517
  106   2HH1  ARG  16          2HH1      ARG  16  41.195  10.743  -1.080
  107   1HH2  ARG  16          1HH2      ARG  16  43.851  12.310  -2.759
  108   2HH2  ARG  16          2HH2      ARG  16  42.446  12.550  -1.774
  109    H    CYS  17           H        CYS  17  44.977   3.887  -5.252
  110    HA   CYS  17           HA       CYS  17  44.004   1.593  -3.877
  111   1HB   CYS  17          2HB       CYS  17  42.411   2.098  -5.928
  112   2HB   CYS  17          1HB       CYS  17  43.691   1.315  -6.844
  113    H    ILE  18           H        ILE  18  46.072   1.217  -3.272
  114    HA   ILE  18           HA       ILE  18  48.100   0.827  -5.375
  115    HB   ILE  18           HB       ILE  18  49.738   1.587  -3.857
  116   1HG1  ILE  18          2HG1      ILE  18  47.777   1.382  -1.568
  117   2HG1  ILE  18          1HG1      ILE  18  48.837   0.052  -2.025
  118   1HG2  ILE  18          1HG2      ILE  18  48.238   3.407  -4.555
  119   2HG2  ILE  18          2HG2      ILE  18  48.898   3.694  -2.944
  120   3HG2  ILE  18          3HG2      ILE  18  47.237   3.123  -3.130
  121   1HD1  ILE  18          1HD1      ILE  18  49.800   1.271  -0.215
  122   2HD1  ILE  18          2HD1      ILE  18  49.674   2.776  -1.123
  123   3HD1  ILE  18          3HD1      ILE  18  50.769   1.505  -1.672
  124    HA   PRO  19           HA       PRO  19  48.455  -3.397  -3.774
  125   1HB   PRO  19          2HB       PRO  19  51.388  -3.245  -3.913
  126   2HB   PRO  19          1HB       PRO  19  50.278  -4.260  -4.836
  127   1HG   PRO  19          2HG       PRO  19  51.605  -2.223  -5.974
  128   2HG   PRO  19          1HG       PRO  19  49.957  -2.657  -6.470
  129   1HD   PRO  19          2HD       PRO  19  50.871  -0.458  -4.637
  130   2HD   PRO  19          1HD       PRO  19  49.664  -0.402  -5.941
  131    H    ILE  20           H        ILE  20  48.668  -4.376  -1.785
  132    HA   ILE  20           HA       ILE  20  49.114  -2.949   0.562
  133    HB   ILE  20           HB       ILE  20  49.459  -5.920   0.076
  134   1HG1  ILE  20          2HG1      ILE  20  47.178  -4.863  -0.356
  135   2HG1  ILE  20          1HG1      ILE  20  47.213  -6.191   0.800
  136   1HG2  ILE  20          1HG2      ILE  20  49.190  -4.429   2.680
  137   2HG2  ILE  20          2HG2      ILE  20  50.618  -5.289   2.104
  138   3HG2  ILE  20          3HG2      ILE  20  49.149  -6.181   2.499
  139   1HD1  ILE  20          1HD1      ILE  20  47.143  -4.603   2.641
  140   2HD1  ILE  20          2HD1      ILE  20  45.775  -4.375   1.551
  141   3HD1  ILE  20          3HD1      ILE  20  47.144  -3.264   1.494
  142    H    SER  21           H        SER  21  51.291  -4.567  -1.548
  143    HA   SER  21           HA       SER  21  53.532  -5.001   0.010
  144   1HB   SER  21          2HB       SER  21  53.495  -4.252  -2.914
  145   2HB   SER  21          1HB       SER  21  54.651  -5.295  -2.085
  146    HG   SER  21           HG       SER  21  53.289  -6.913  -2.194
  147    H    TRP  22           H        TRP  22  52.228  -2.025  -0.709
  148    HA   TRP  22           HA       TRP  22  54.801  -0.645  -0.959
  149   1HB   TRP  22          2HB       TRP  22  51.996   0.265  -1.554
  150   2HB   TRP  22          1HB       TRP  22  53.395   1.328  -1.625
  151    HD1  TRP  22           HD1      TRP  22  53.357  -2.260  -3.013
  152    HE1  TRP  22           HE1      TRP  22  53.707  -2.132  -5.538
  153    HE3  TRP  22           HE3      TRP  22  53.222   2.805  -3.610
  154    HZ2  TRP  22           HZ2      TRP  22  53.905  -0.178  -7.542
  155    HZ3  TRP  22           HZ3      TRP  22  53.500   3.732  -5.876
  156    HH2  TRP  22           HH2      TRP  22  53.835   2.268  -7.802
  157    H    THR  23           H        THR  23  51.987  -0.885   1.024
  158    HA   THR  23           HA       THR  23  51.645   1.377   2.356
  159    HB   THR  23           HB       THR  23  51.197   0.023   4.451
  160    HG1  THR  23           HG1      THR  23  51.762  -2.199   2.750
  161   1HG2  THR  23          1HG2      THR  23  49.989  -0.959   1.861
  162   2HG2  THR  23          2HG2      THR  23  49.460   0.451   2.778
  163   3HG2  THR  23          3HG2      THR  23  49.290  -1.163   3.468
  164    H    CYS  24           H        CYS  24  53.838  -0.964   3.729
  165    HA   CYS  24           HA       CYS  24  55.292   1.047   5.137
  166   1HB   CYS  24          2HB       CYS  24  54.550  -1.171   6.098
  167   2HB   CYS  24          1HB       CYS  24  55.731  -1.938   5.048
  168    H    ASP  25           H        ASP  25  56.134   2.036   3.024
  169    HA   ASP  25           HA       ASP  25  58.729   0.785   2.529
  170   1HB   ASP  25          2HB       ASP  25  58.592   0.575   0.266
  171   2HB   ASP  25          1HB       ASP  25  56.914   0.274   0.676
  172    H    LEU  26           H        LEU  26  57.180   3.338   3.585
  173    HA   LEU  26           HA       LEU  26  58.193   5.082   4.585
  174   1HB   LEU  26          2HB       LEU  26  60.428   4.398   2.767
  175   2HB   LEU  26          1HB       LEU  26  60.362   6.041   3.376
  176    HG   LEU  26           HG       LEU  26  60.396   3.547   5.085
  177   1HD1  LEU  26          1HD1      LEU  26  62.670   4.229   5.652
  178   2HD1  LEU  26          2HD1      LEU  26  62.556   5.570   4.512
  179   3HD1  LEU  26          3HD1      LEU  26  62.509   3.908   3.924
  180   1HD2  LEU  26          1HD2      LEU  26  60.601   6.462   5.839
  181   2HD2  LEU  26          2HD2      LEU  26  60.736   5.090   6.938
  182   3HD2  LEU  26          3HD2      LEU  26  59.207   5.420   6.124
  183    H    ASP  27           H        ASP  27  56.128   5.763   3.701
  184    HA   ASP  27           HA       ASP  27  55.142   7.821   3.586
  185   1HB   ASP  27          2HB       ASP  27  57.578   8.680   3.896
  186   2HB   ASP  27          1HB       ASP  27  57.512   9.012   2.169
  187    H    ASP  28           H        ASP  28  55.260   9.726   1.564
  188    HA   ASP  28           HA       ASP  28  54.537  10.323  -0.458
  189   1HB   ASP  28          2HB       ASP  28  56.350   8.750  -1.281
  190   2HB   ASP  28          1HB       ASP  28  55.064   7.575  -1.551
  191    H    ASP  29           H        ASP  29  53.345   7.032   0.270
  192    HA   ASP  29           HA       ASP  29  50.881   7.527  -1.142
  193   1HB   ASP  29          2HB       ASP  29  52.202   5.235  -0.270
  194   2HB   ASP  29          1HB       ASP  29  50.763   5.310   0.742
  195    H    CYS  30           H        CYS  30  48.863   6.531   0.523
  196    HA   CYS  30           HA       CYS  30  48.926   8.228   2.880
  197   1HB   CYS  30          2HB       CYS  30  46.740   9.328   2.160
  198   2HB   CYS  30          1HB       CYS  30  48.245   9.905   1.463
  199    H    GLY  31           H        GLY  31  48.758   5.707   3.351
  200   1HA   GLY  31          2HA       GLY  31  46.082   4.735   3.607
  201   2HA   GLY  31          1HA       GLY  31  47.469   4.209   4.555
  202    H    ASP  32           H        ASP  32  48.064   6.887   5.421
  203    HA   ASP  32           HA       ASP  32  45.789   7.694   7.065
  204   1HB   ASP  32          2HB       ASP  32  47.395   7.874   9.056
  205   2HB   ASP  32          1HB       ASP  32  46.870   6.254   8.623
  206    H    ARG  33           H        ARG  33  49.018   8.225   5.958
  207    HA   ARG  33           HA       ARG  33  48.694  10.849   5.040
  208   1HB   ARG  33          2HB       ARG  33  48.738  11.494   7.400
  209   2HB   ARG  33          1HB       ARG  33  50.174  10.512   7.669
  210   1HG   ARG  33          2HG       ARG  33  51.304  12.000   5.933
  211   2HG   ARG  33          1HG       ARG  33  49.925  13.079   6.144
  212   1HD   ARG  33          2HD       ARG  33  51.798  12.153   8.317
  213   2HD   ARG  33          1HD       ARG  33  51.817  13.739   7.549
  214    HE   ARG  33           HE       ARG  33  49.284  13.085   8.725
  215   1HH1  ARG  33          1HH1      ARG  33  52.474  14.349   9.364
  216   2HH1  ARG  33          2HH1      ARG  33  51.991  15.268  10.760
  217   1HH2  ARG  33          1HH2      ARG  33  48.626  14.291  10.581
  218   2HH2  ARG  33          2HH2      ARG  33  49.803  15.219  11.450
  219    H    SER  34           H        SER  34  50.715   8.382   6.408
  220    HA   SER  34           HA       SER  34  52.439   8.403   4.042
  221   1HB   SER  34          2HB       SER  34  53.506   8.261   6.879
  222   2HB   SER  34          1HB       SER  34  54.455   8.224   5.394
  223    HG   SER  34           HG       SER  34  54.424  10.311   5.359
  224    H    ASP  35           H        ASP  35  50.331   6.780   5.779
  225    HA   ASP  35           HA       ASP  35  49.616   4.617   5.727
  226   1HB   ASP  35          2HB       ASP  35  52.193   4.021   4.275
  227   2HB   ASP  35          1HB       ASP  35  50.897   2.862   4.552
  228    H    GLU  36           H        GLU  36  52.580   5.502   7.098
  229    HA   GLU  36           HA       GLU  36  52.955   2.847   8.272
  230   1HB   GLU  36          2HB       GLU  36  54.880   5.091   7.686
  231   2HB   GLU  36          1HB       GLU  36  55.321   3.631   8.564
  232   1HG   GLU  36          2HG       GLU  36  55.250   2.317   6.724
  233   2HG   GLU  36          1HG       GLU  36  53.961   3.255   5.972
  234    H    SER  37           H        SER  37  51.172   4.940   9.327
  235    HA   SER  37           HA       SER  37  52.262   4.652  12.037
  236   1HB   SER  37          2HB       SER  37  50.885   6.697  12.655
  237   2HB   SER  37          1HB       SER  37  52.309   7.008  11.662
  238    HG   SER  37           HG       SER  37  50.110   6.506  10.135
  239    H    ALA  38           H        ALA  38  49.969   3.721   9.853
  240    HA   ALA  38           HA       ALA  38  48.178   2.883  12.008
  241   1HB   ALA  38          1HB       ALA  38  47.311   3.712   9.248
  242   2HB   ALA  38          2HB       ALA  38  47.102   4.655  10.723
  243   3HB   ALA  38          3HB       ALA  38  46.254   3.121  10.531
  244    H    SER  39           H        SER  39  49.819   1.957   9.081
  245    HA   SER  39           HA       SER  39  48.653  -0.718   9.427
  246   1HB   SER  39          2HB       SER  39  49.364  -1.223   7.145
  247   2HB   SER  39          1HB       SER  39  48.373   0.234   7.167
  248    HG   SER  39           HG       SER  39  50.158   1.468   6.818
  249    H    CYS  40           H        CYS  40  51.754   0.879   8.725
  250    HA   CYS  40           HA       CYS  40  53.124  -1.520   9.691
  251   1HB   CYS  40          2HB       CYS  40  53.781  -0.345   7.501
  252   2HB   CYS  40          1HB       CYS  40  54.497   0.895   8.531
  253    H    ALA  41           H        ALA  41  54.139  -1.587  11.611
  254    HA   ALA  41           HA       ALA  41  54.044   0.824  13.265
  255   1HB   ALA  41          1HB       ALA  41  54.462  -0.677  15.146
  256   2HB   ALA  41          2HB       ALA  41  54.617  -2.036  14.034
  257   3HB   ALA  41          3HB       ALA  41  53.070  -1.206  14.204
  258    H    TYR  42           H        TYR  42  56.133  -0.691  11.241
  259    HA   TYR  42           HA       TYR  42  58.377  -0.898  10.971
  260   1HB   TYR  42          2HB       TYR  42  57.910   1.858  11.976
  261   2HB   TYR  42          1HB       TYR  42  59.581   1.305  11.893
  262    HD1  TYR  42           HD1      TYR  42  56.488   1.500   9.819
  263    HD2  TYR  42           HD2      TYR  42  60.744   1.464   9.894
  264    HE1  TYR  42           HE1      TYR  42  56.527   1.942   7.388
  265    HE2  TYR  42           HE2      TYR  42  60.795   1.936   7.487
  266    HH   TYR  42           HH       TYR  42  58.137   2.999   5.764
  267    HA   PRO  43           HA       PRO  43  59.642  -1.977  15.290
  268   1HB   PRO  43          2HB       PRO  43  58.660  -4.447  15.636
  269   2HB   PRO  43          1HB       PRO  43  57.659  -3.014  15.894
  270   1HG   PRO  43          2HG       PRO  43  57.606  -4.974  13.685
  271   2HG   PRO  43          1HG       PRO  43  56.310  -3.939  14.301
  272   1HD   PRO  43          2HD       PRO  43  57.991  -3.498  12.016
  273   2HD   PRO  43          1HD       PRO  43  56.702  -2.452  12.641
  274    H    THR  44           H        THR  44  59.993  -3.245  12.196
  275    HA   THR  44           HA       THR  44  62.585  -4.277  12.510
  276    HB   THR  44           HB       THR  44  61.469  -6.088  13.757
  277    HG1  THR  44           HG1      THR  44  62.416  -6.815  11.169
  278   1HG2  THR  44          1HG2      THR  44  59.897  -6.557  11.217
  279   2HG2  THR  44          2HG2      THR  44  59.246  -5.949  12.739
  280   3HG2  THR  44          3HG2      THR  44  59.877  -7.592  12.647
  281    H    CYS  45           H        CYS  45  61.186  -2.565  10.761
  282    HA   CYS  45           HA       CYS  45  60.610  -2.114   8.617
  283   1HB   CYS  45          2HB       CYS  45  62.249  -4.593   8.011
  284   2HB   CYS  45          1HB       CYS  45  61.693  -3.423   6.813
  285    H    PHE  46           H        PHE  46  60.053  -4.177   6.511
  286    HA   PHE  46           HA       PHE  46  57.732  -5.473   7.751
  287   1HB   PHE  46          2HB       PHE  46  57.407  -3.116   6.501
  288   2HB   PHE  46          1HB       PHE  46  57.251  -4.203   5.124
  289    HD1  PHE  46           HD1      PHE  46  55.048  -4.438   4.570
  290    HD2  PHE  46           HD2      PHE  46  56.146  -4.424   8.674
  291    HE1  PHE  46           HE1      PHE  46  52.720  -4.886   5.182
  292    HE2  PHE  46           HE2      PHE  46  53.814  -4.881   9.307
  293    HZ   PHE  46           HZ       PHE  46  52.089  -5.109   7.561
  294    HA   PRO  47           HA       PRO  47  59.311  -8.705   5.200
  295   1HB   PRO  47          2HB       PRO  47  57.356 -10.491   6.248
  296   2HB   PRO  47          1HB       PRO  47  59.028 -10.291   6.772
  297   1HG   PRO  47          2HG       PRO  47  56.799  -9.648   8.283
  298   2HG   PRO  47          1HG       PRO  47  58.429  -9.010   8.551
  299   1HD   PRO  47          2HD       PRO  47  56.103  -7.749   7.157
  300   2HD   PRO  47          1HD       PRO  47  57.325  -7.007   8.216
  301    H    LEU  48           H        LEU  48  56.715  -7.048   4.314
  302    HA   LEU  48           HA       LEU  48  55.253  -8.975   2.781
  303   1HB   LEU  48          2HB       LEU  48  55.423  -5.970   2.665
  304   2HB   LEU  48          1HB       LEU  48  54.544  -6.867   1.445
  305    HG   LEU  48           HG       LEU  48  53.942  -6.734   4.394
  306   1HD1  LEU  48          1HD1      LEU  48  51.836  -5.761   3.589
  307   2HD1  LEU  48          2HD1      LEU  48  52.444  -5.839   1.936
  308   3HD1  LEU  48          3HD1      LEU  48  53.235  -4.798   3.120
  309   1HD2  LEU  48          1HD2      LEU  48  53.567  -9.013   3.565
  310   2HD2  LEU  48          2HD2      LEU  48  52.571  -8.370   2.259
  311   3HD2  LEU  48          3HD2      LEU  48  52.048  -8.196   3.934
  312    H    THR  49           H        THR  49  57.731  -6.584   2.002
  313    HA   THR  49           HA       THR  49  59.016  -7.980  -0.013
  314    HB   THR  49           HB       THR  49  56.996  -7.966  -1.302
  315    HG1  THR  49           HG1      THR  49  58.779  -7.488  -2.568
  316   1HG2  THR  49          1HG2      THR  49  56.846  -4.985  -0.855
  317   2HG2  THR  49          2HG2      THR  49  55.824  -6.197  -0.082
  318   3HG2  THR  49          3HG2      THR  49  55.735  -5.954  -1.827
  319    H    GLN  50           H        GLN  50  60.825  -6.984   0.801
  320    HA   GLN  50           HA       GLN  50  61.097  -4.122   0.495
  321   1HB   GLN  50          2HB       GLN  50  60.296  -5.317   2.974
  322   2HB   GLN  50          1HB       GLN  50  61.910  -4.652   3.154
  323   1HG   GLN  50          2HG       GLN  50  61.058  -2.489   2.295
  324   2HG   GLN  50          1HG       GLN  50  59.435  -3.184   2.296
  325   1HE2  GLN  50          1HE2      GLN  50  58.740  -1.649   3.810
  326   2HE2  GLN  50          2HE2      GLN  50  59.194  -1.759   5.475
  327    H    PHE  51           H        PHE  51  63.200  -3.371   0.891
  328    HA   PHE  51           HA       PHE  51  65.291  -5.412   1.282
  329   1HB   PHE  51          2HB       PHE  51  65.242  -4.490  -1.059
  330   2HB   PHE  51          1HB       PHE  51  65.504  -2.885  -0.392
  331    HD1  PHE  51           HD1      PHE  51  67.663  -2.156   0.244
  332    HD2  PHE  51           HD2      PHE  51  67.013  -6.211  -0.864
  333    HE1  PHE  51           HE1      PHE  51  70.088  -2.514   0.154
  334    HE2  PHE  51           HE2      PHE  51  69.441  -6.579  -0.955
  335    HZ   PHE  51           HZ       PHE  51  70.984  -4.729  -0.446
  336    H    THR  52           H        THR  52  66.899  -4.774   2.782
  337    HA   THR  52           HA       THR  52  66.076  -2.433   4.345
  338    HB   THR  52           HB       THR  52  67.768  -4.749   5.294
  339    HG1  THR  52           HG1      THR  52  64.963  -4.332   5.631
  340   1HG2  THR  52          1HG2      THR  52  67.091  -3.947   7.526
  341   2HG2  THR  52          2HG2      THR  52  66.234  -2.605   6.768
  342   3HG2  THR  52          3HG2      THR  52  67.987  -2.720   6.630
  343    H    CYS  53           H        CYS  53  67.254  -0.726   3.625
  344    HA   CYS  53           HA       CYS  53  69.948  -0.720   2.910
  345   1HB   CYS  53          2HB       CYS  53  68.313   1.372   4.317
  346   2HB   CYS  53          1HB       CYS  53  69.964   1.647   3.768
  347    H    ASN  54           H        ASN  54  71.888  -0.457   4.021
  348    HA   ASN  54           HA       ASN  54  72.064  -2.086   6.305
  349   1HB   ASN  54          2HB       ASN  54  74.043  -0.356   4.862
  350   2HB   ASN  54          1HB       ASN  54  74.479  -1.126   6.384
  351   1HD2  ASN  54          1HD2      ASN  54  72.316  -2.538   3.992
  352   2HD2  ASN  54          2HD2      ASN  54  73.374  -3.828   3.544
  353    H    ASN  55           H        ASN  55  71.799   1.382   5.980
  354    HA   ASN  55           HA       ASN  55  72.599   2.148   8.552
  355   1HB   ASN  55          2HB       ASN  55  71.197   3.355   6.332
  356   2HB   ASN  55          1HB       ASN  55  70.464   3.835   7.858
  357   1HD2  ASN  55          1HD2      ASN  55  73.308   3.965   5.855
  358   2HD2  ASN  55          2HD2      ASN  55  74.122   5.193   6.775
  359    H    GLY  56           H        GLY  56  69.852   0.396   7.526
  360   1HA   GLY  56          2HA       GLY  56  68.553  -0.773   9.199
  361   2HA   GLY  56          1HA       GLY  56  68.691   0.648  10.225
  362    H    ARG  57           H        ARG  57  68.202   1.629   7.093
  363    HA   ARG  57           HA       ARG  57  65.398   2.185   7.674
  364   1HB   ARG  57          2HB       ARG  57  65.573   4.023   6.326
  365   2HB   ARG  57          1HB       ARG  57  67.270   3.844   6.735
  366   1HG   ARG  57          2HG       ARG  57  67.192   2.329   4.531
  367   2HG   ARG  57          1HG       ARG  57  65.886   3.462   4.162
  368   1HD   ARG  57          2HD       ARG  57  67.508   5.305   4.813
  369   2HD   ARG  57          1HD       ARG  57  68.764   4.070   4.790
  370    HE   ARG  57           HE       ARG  57  68.128   3.732   2.396
  371   1HH1  ARG  57          1HH1      ARG  57  67.516   6.771   4.014
  372   2HH1  ARG  57          2HH1      ARG  57  67.651   7.721   2.574
  373   1HH2  ARG  57          1HH2      ARG  57  68.338   4.990   0.475
  374   2HH2  ARG  57          2HH2      ARG  57  68.116   6.707   0.559
  375    H    CYS  58           H        CYS  58  63.719   1.584   6.210
  376    HA   CYS  58           HA       CYS  58  64.458  -0.886   4.812
  377   1HB   CYS  58          2HB       CYS  58  61.659  -0.237   5.626
  378   2HB   CYS  58          1HB       CYS  58  62.471  -1.798   5.546
  379    H    ILE  59           H        ILE  59  64.338  -0.834   2.655
  380    HA   ILE  59           HA       ILE  59  62.698   1.278   1.492
  381    HB   ILE  59           HB       ILE  59  64.037   1.144  -0.540
  382   1HG1  ILE  59          2HG1      ILE  59  65.997  -0.589   0.943
  383   2HG1  ILE  59          1HG1      ILE  59  64.712  -1.293  -0.036
  384   1HG2  ILE  59          1HG2      ILE  59  66.046   2.209   0.340
  385   2HG2  ILE  59          2HG2      ILE  59  65.671   1.604   1.952
  386   3HG2  ILE  59          3HG2      ILE  59  64.601   2.773   1.178
  387   1HD1  ILE  59          1HD1      ILE  59  66.787   0.636  -1.042
  388   2HD1  ILE  59          2HD1      ILE  59  65.556  -0.193  -2.003
  389   3HD1  ILE  59          3HD1      ILE  59  66.845  -1.116  -1.227
  390    H    ASN  60           H        ASN  60  61.701   0.779  -0.619
  391    HA   ASN  60           HA       ASN  60  60.242  -1.669  -0.478
  392   1HB   ASN  60          2HB       ASN  60  59.385   0.572  -1.305
  393   2HB   ASN  60          1HB       ASN  60  60.332   0.311  -2.761
  394   1HD2  ASN  60          1HD2      ASN  60  57.432   0.609  -2.263
  395   2HD2  ASN  60          2HD2      ASN  60  56.705  -0.785  -3.004
  396    H    ILE  61           H        ILE  61  60.434  -3.502  -1.724
  397    HA   ILE  61           HA       ILE  61  63.018  -4.085  -2.741
  398    HB   ILE  61           HB       ILE  61  60.818  -5.583  -1.917
  399   1HG1  ILE  61          2HG1      ILE  61  63.170  -6.074  -1.460
  400   2HG1  ILE  61          1HG1      ILE  61  62.344  -7.487  -2.101
  401   1HG2  ILE  61          1HG2      ILE  61  59.911  -5.633  -4.164
  402   2HG2  ILE  61          2HG2      ILE  61  60.480  -7.233  -3.689
  403   3HG2  ILE  61          3HG2      ILE  61  61.443  -6.247  -4.787
  404   1HD1  ILE  61          1HD1      ILE  61  63.341  -7.073  -4.293
  405   2HD1  ILE  61          2HD1      ILE  61  64.566  -7.265  -3.038
  406   3HD1  ILE  61          3HD1      ILE  61  64.168  -5.658  -3.641
  407    H    ASN  62           H        ASN  62  60.335  -2.604  -4.124
  408    HA   ASN  62           HA       ASN  62  60.695  -3.586  -6.819
  409   1HB   ASN  62          2HB       ASN  62  58.468  -2.958  -5.790
  410   2HB   ASN  62          1HB       ASN  62  58.974  -1.277  -5.895
  411   1HD2  ASN  62          1HD2      ASN  62  59.749  -3.704  -8.310
  412   2HD2  ASN  62          2HD2      ASN  62  58.765  -3.038  -9.560
  413    H    TRP  63           H        TRP  63  62.793  -1.908  -5.297
  414    HA   TRP  63           HA       TRP  63  63.051   0.257  -7.268
  415   1HB   TRP  63          2HB       TRP  63  64.355  -0.019  -4.554
  416   2HB   TRP  63          1HB       TRP  63  64.623   1.313  -5.669
  417    HD1  TRP  63           HD1      TRP  63  61.025   0.407  -5.665
  418    HE1  TRP  63           HE1      TRP  63  59.682   2.056  -4.209
  419    HE3  TRP  63           HE3      TRP  63  64.897   2.721  -3.283
  420    HZ2  TRP  63           HZ2      TRP  63  60.200   4.065  -2.305
  421    HZ3  TRP  63           HZ3      TRP  63  64.396   4.494  -1.651
  422    HH2  TRP  63           HH2      TRP  63  62.092   5.152  -1.173
  423    H    ARG  64           H        ARG  64  63.900  -2.752  -7.207
  424    HA   ARG  64           HA       ARG  64  66.700  -2.691  -7.762
  425   1HB   ARG  64          2HB       ARG  64  64.808  -4.616  -9.107
  426   2HB   ARG  64          1HB       ARG  64  66.476  -4.868  -8.627
  427   1HG   ARG  64          2HG       ARG  64  64.278  -4.510  -6.624
  428   2HG   ARG  64          1HG       ARG  64  64.693  -6.081  -7.309
  429   1HD   ARG  64          2HD       ARG  64  66.590  -4.264  -5.827
  430   2HD   ARG  64          1HD       ARG  64  65.768  -5.659  -5.133
  431    HE   ARG  64           HE       ARG  64  67.228  -6.443  -7.420
  432   1HH1  ARG  64          1HH1      ARG  64  67.667  -5.484  -4.080
  433   2HH1  ARG  64          2HH1      ARG  64  69.236  -6.216  -3.937
  434   1HH2  ARG  64          1HH2      ARG  64  69.289  -7.465  -7.209
  435   2HH2  ARG  64          2HH2      ARG  64  70.161  -7.325  -5.709
  436    H    CYS  65           H        CYS  65  67.089  -0.909  -9.138
  437    HA   CYS  65           HA       CYS  65  65.457  -0.462 -11.442
  438   1HB   CYS  65          2HB       CYS  65  67.088   1.370 -11.916
  439   2HB   CYS  65          1HB       CYS  65  66.363   1.452 -10.313
  440    H    ASP  66           H        ASP  66  68.842  -1.305 -11.030
  441    HA   ASP  66           HA       ASP  66  68.890  -2.198 -13.835
  442   1HB   ASP  66          2HB       ASP  66  71.269  -1.668 -13.840
  443   2HB   ASP  66          1HB       ASP  66  70.342  -0.262 -13.326
  444    H    ASN  67           H        ASN  67  70.399  -2.875 -10.690
  445    HA   ASN  67           HA       ASN  67  70.386  -5.712 -11.334
  446   1HB   ASN  67          2HB       ASN  67  72.635  -4.982 -11.868
  447   2HB   ASN  67          1HB       ASN  67  72.768  -4.155 -10.319
  448   1HD2  ASN  67          1HD2      ASN  67  73.226  -5.314  -8.495
  449   2HD2  ASN  67          2HD2      ASN  67  73.690  -6.978  -8.525
  450    H    ASP  68           H        ASP  68  71.168  -3.348  -8.763
  451    HA   ASP  68           HA       ASP  68  69.888  -5.236  -6.909
  452   1HB   ASP  68          2HB       ASP  68  72.377  -4.504  -6.574
  453   2HB   ASP  68          1HB       ASP  68  71.656  -3.039  -5.901
  454    H    ASN  69           H        ASN  69  69.715  -3.132  -4.808
  455    HA   ASN  69           HA       ASN  69  67.112  -2.173  -5.845
  456   1HB   ASN  69          2HB       ASN  69  67.334  -4.026  -4.052
  457   2HB   ASN  69          1HB       ASN  69  67.751  -2.715  -2.959
  458   1HD2  ASN  69          1HD2      ASN  69  65.965  -0.770  -4.009
  459   2HD2  ASN  69          2HD2      ASN  69  64.361  -1.286  -3.602
  460    H    ASP  70           H        ASP  70  67.124  -0.051  -6.177
  461    HA   ASP  70           HA       ASP  70  68.778   1.926  -5.483
  462   1HB   ASP  70          2HB       ASP  70  65.818   1.916  -5.857
  463   2HB   ASP  70          1HB       ASP  70  66.568   3.386  -5.256
  464    H    CYS  71           H        CYS  71  69.746   2.082  -3.605
  465    HA   CYS  71           HA       CYS  71  68.095   2.745  -1.263
  466   1HB   CYS  71          2HB       CYS  71  68.678   0.500  -0.824
  467   2HB   CYS  71          1HB       CYS  71  70.313   0.712  -1.444
  468    H    GLY  72           H        GLY  72  71.438   2.608  -2.516
  469   1HA   GLY  72          2HA       GLY  72  72.966   4.346  -2.676
  470   2HA   GLY  72          1HA       GLY  72  71.778   5.422  -1.962
  471    H    ASP  73           H        ASP  73  72.014   2.763  -0.009
  472    HA   ASP  73           HA       ASP  73  73.969   4.099   1.698
  473   1HB   ASP  73          2HB       ASP  73  71.939   4.485   2.773
  474   2HB   ASP  73          1HB       ASP  73  71.279   2.919   2.318
  475    H    ASN  74           H        ASN  74  75.402   2.685   0.463
  476    HA   ASN  74           HA       ASN  74  77.028   1.097   0.617
  477   1HB   ASN  74          2HB       ASN  74  75.691   0.425   3.246
  478   2HB   ASN  74          1HB       ASN  74  77.253  -0.190   2.723
  479   1HD2  ASN  74          1HD2      ASN  74  75.519   2.536   4.002
  480   2HD2  ASN  74          2HD2      ASN  74  76.906   3.524   4.297
  481    H    SER  75           H        SER  75  73.919   0.384   0.091
  482    HA   SER  75           HA       SER  75  74.103  -2.492   0.339
  483   1HB   SER  75          2HB       SER  75  71.775  -0.781  -0.495
  484   2HB   SER  75          1HB       SER  75  71.718  -2.493  -0.063
  485    HG   SER  75           HG       SER  75  72.709  -0.558   1.748
  486    H    ASP  76           H        ASP  76  72.268  -0.867  -2.024
  487    HA   ASP  76           HA       ASP  76  72.529  -2.737  -4.025
  488   1HB   ASP  76          2HB       ASP  76  71.651  -0.847  -5.496
  489   2HB   ASP  76          1HB       ASP  76  70.686  -1.252  -4.085
  490    H    GLU  77           H        GLU  77  73.939   0.479  -3.969
  491    HA   GLU  77           HA       GLU  77  76.409   0.000  -5.047
  492   1HB   GLU  77          2HB       GLU  77  75.769   0.953  -7.477
  493   2HB   GLU  77          1HB       GLU  77  75.952  -0.753  -7.132
  494   1HG   GLU  77          2HG       GLU  77  74.006  -0.445  -8.466
  495   2HG   GLU  77          1HG       GLU  77  73.502  -0.921  -6.850
  496    H    ALA  78           H        ALA  78  73.688   2.041  -4.654
  497    HA   ALA  78           HA       ALA  78  73.487   4.235  -4.066
  498   1HB   ALA  78          1HB       ALA  78  76.456   4.055  -3.573
  499   2HB   ALA  78          2HB       ALA  78  75.190   3.653  -2.413
  500   3HB   ALA  78          3HB       ALA  78  75.377   5.315  -2.972
  501    H    GLY  79           H        GLY  79  74.085   3.564  -6.913
  502   1HA   GLY  79          2HA       GLY  79  75.044   6.256  -7.675
  503   2HA   GLY  79          1HA       GLY  79  75.676   4.829  -8.478
  504    H    CYS  80           H        CYS  80  72.800   3.694  -8.163
  505    HA   CYS  80           HA       CYS  80  71.976   4.270 -10.792
  506   1HB   CYS  80          2HB       CYS  80  71.406   2.203  -9.519
  507   2HB   CYS  80          1HB       CYS  80  70.289   3.150  -8.544
  508    H    SER  81           H        SER  81  70.686   5.429  -7.680
  509    HA   SER  81           HA       SER  81  68.852   7.200  -9.060
  510   1HB   SER  81          2HB       SER  81  68.735   7.755  -6.329
  511   2HB   SER  81          1HB       SER  81  67.667   6.679  -7.231
  512    HG   SER  81           HG       SER  81  68.800   4.950  -6.596
  513    H    HIS  82           HN       HIS  82  69.398   9.158  -9.688
  514    HA   HIS  82           HA       HIS  82  71.023  10.836  -7.970
  515   1HB   HIS  82          2HB       HIS  82  72.415  11.568  -9.960
  516   2HB   HIS  82          1HB       HIS  82  72.778   9.975  -9.315
  517    HD1  HIS  82           HD1      HIS  82  70.051  10.843 -11.834
  518    HD2  HIS  82           HD2      HIS  82  73.583   8.670 -11.533
  519    HE1  HIS  82           HE1      HIS  82  70.317   9.598 -14.026
  Start of MODEL    5
    1   1H    SER   1          1HT       SER   1  36.721  -6.555  -2.638
    2   2H    SER   1          2HT       SER   1  36.141  -8.142  -2.577
    3   3H    SER   1          3HT       SER   1  37.244  -7.687  -3.779
    4    HA   SER   1           HA       SER   1  38.318  -8.975  -2.047
    5   1HB   SER   1          2HB       SER   1  39.166  -6.065  -1.940
    6   2HB   SER   1          1HB       SER   1  40.192  -7.488  -1.759
    7    HG   SER   1           HG       SER   1  39.924  -6.246  -3.932
    8    H    ALA   2           H        ALA   2  39.475  -8.342   0.207
    9    HA   ALA   2           HA       ALA   2  37.357  -7.917   2.124
   10   1HB   ALA   2          1HB       ALA   2  39.107  -8.338   3.803
   11   2HB   ALA   2          2HB       ALA   2  40.318  -8.354   2.523
   12   3HB   ALA   2          3HB       ALA   2  39.069  -9.597   2.564
   13    H    ARG   3           H        ARG   3  38.652  -5.829   0.245
   14    HA   ARG   3           HA       ARG   3  38.393  -3.564   1.937
   15   1HB   ARG   3          2HB       ARG   3  40.717  -4.406   2.470
   16   2HB   ARG   3          1HB       ARG   3  41.140  -4.135   0.788
   17   1HG   ARG   3          2HG       ARG   3  40.780  -1.760   1.033
   18   2HG   ARG   3          1HG       ARG   3  40.212  -1.986   2.690
   19   1HD   ARG   3          2HD       ARG   3  42.568  -1.227   2.557
   20   2HD   ARG   3          1HD       ARG   3  42.382  -2.778   3.375
   21    HE   ARG   3           HE       ARG   3  43.051  -2.829   0.532
   22   1HH1  ARG   3          1HH1      ARG   3  44.103  -3.191   3.857
   23   2HH1  ARG   3          2HH1      ARG   3  45.555  -4.038   3.436
   24   1HH2  ARG   3          1HH2      ARG   3  44.965  -3.962  -0.024
   25   2HH2  ARG   3          2HH2      ARG   3  46.037  -4.480   1.234
   26    H    THR   4           H        THR   4  38.994  -1.552   0.513
   27    HA   THR   4           HA       THR   4  37.519  -1.621  -1.818
   28    HB   THR   4           HB       THR   4  39.731   0.356  -1.298
   29    HG1  THR   4           HG1      THR   4  37.095   0.697  -0.343
   30   1HG2  THR   4          1HG2      THR   4  38.228   1.918  -2.425
   31   2HG2  THR   4          2HG2      THR   4  37.026   0.643  -2.613
   32   3HG2  THR   4          3HG2      THR   4  38.567   0.533  -3.460
   33    H    CYS   5           H        CYS   5  41.017  -1.598  -1.475
   34    HA   CYS   5           HA       CYS   5  41.317  -2.280  -4.295
   35   1HB   CYS   5          2HB       CYS   5  43.330  -1.417  -2.223
   36   2HB   CYS   5          1HB       CYS   5  43.757  -1.891  -3.869
   37    HA   PRO   6           HA       PRO   6  42.028  -6.588  -3.680
   38   1HB   PRO   6          2HB       PRO   6  44.293  -6.254  -5.583
   39   2HB   PRO   6          1HB       PRO   6  42.901  -7.341  -5.665
   40   1HG   PRO   6          2HG       PRO   6  43.001  -5.203  -7.222
   41   2HG   PRO   6          1HG       PRO   6  41.478  -5.672  -6.440
   42   1HD   PRO   6          2HD       PRO   6  43.421  -3.516  -5.670
   43   2HD   PRO   6          1HD       PRO   6  41.643  -3.469  -5.707
   44    HA   PRO   7           HA       PRO   7  45.158  -7.356  -0.718
   45   1HB   PRO   7          2HB       PRO   7  45.942  -9.823  -2.167
   46   2HB   PRO   7          1HB       PRO   7  45.358  -9.624  -0.511
   47   1HG   PRO   7          2HG       PRO   7  43.785 -10.657  -2.396
   48   2HG   PRO   7          1HG       PRO   7  43.133  -9.559  -1.165
   49   1HD   PRO   7          2HD       PRO   7  43.824  -9.005  -4.024
   50   2HD   PRO   7          1HD       PRO   7  42.439  -8.435  -3.069
   51    H    ASN   8           H        ASN   8  46.194  -7.615  -4.079
   52    HA   ASN   8           HA       ASN   8  49.007  -7.628  -3.404
   53   1HB   ASN   8          2HB       ASN   8  47.719  -8.614  -5.525
   54   2HB   ASN   8          1HB       ASN   8  48.093  -7.017  -6.166
   55   1HD2  ASN   8          1HD2      ASN   8  50.253  -6.426  -6.477
   56   2HD2  ASN   8          2HD2      ASN   8  51.511  -7.607  -6.548
   57    H    GLN   9           H        GLN   9  46.840  -5.318  -3.124
   58    HA   GLN   9           HA       GLN   9  48.798  -3.233  -3.405
   59   1HB   GLN   9          2HB       GLN   9  47.011  -1.762  -4.560
   60   2HB   GLN   9          1HB       GLN   9  47.946  -2.886  -5.534
   61   1HG   GLN   9          2HG       GLN   9  45.513  -4.091  -4.537
   62   2HG   GLN   9          1HG       GLN   9  45.198  -2.622  -5.464
   63   1HE2  GLN   9          1HE2      GLN   9  47.981  -4.629  -6.045
   64   2HE2  GLN   9          2HE2      GLN   9  47.456  -5.261  -7.567
   65    H    PHE  10           H        PHE  10  47.181  -1.051  -2.912
   66    HA   PHE  10           HA       PHE  10  45.798  -1.717  -0.429
   67   1HB   PHE  10          2HB       PHE  10  48.067  -1.398   0.325
   68   2HB   PHE  10          1HB       PHE  10  48.217   0.091  -0.600
   69    HD1  PHE  10           HD1      PHE  10  47.982   2.077   0.505
   70    HD2  PHE  10           HD2      PHE  10  46.096  -1.387   2.105
   71    HE1  PHE  10           HE1      PHE  10  47.196   3.395   2.424
   72    HE2  PHE  10           HE2      PHE  10  45.330  -0.079   4.054
   73    HZ   PHE  10           HZ       PHE  10  45.867   2.329   4.197
   74    H    SER  11           H        SER  11  44.400  -0.082   0.277
   75    HA   SER  11           HA       SER  11  43.712   1.808  -1.817
   76   1HB   SER  11          2HB       SER  11  41.397   1.700  -0.798
   77   2HB   SER  11          1HB       SER  11  41.944   0.205  -1.561
   78    HG   SER  11           HG       SER  11  42.179   0.779   1.206
   79    H    CYS  12           H        CYS  12  44.491   3.759  -1.251
   80    HA   CYS  12           HA       CYS  12  44.649   4.772   1.351
   81   1HB   CYS  12          2HB       CYS  12  45.718   5.988  -0.450
   82   2HB   CYS  12          1HB       CYS  12  44.177   6.223  -1.263
   83    H    ALA  13           H        ALA  13  43.153   6.247   2.432
   84    HA   ALA  13           HA       ALA  13  41.161   4.960   3.448
   85   1HB   ALA  13          1HB       ALA  13  41.753   7.222   4.138
   86   2HB   ALA  13          2HB       ALA  13  40.004   7.014   4.052
   87   3HB   ALA  13          3HB       ALA  13  40.856   7.879   2.771
   88    H    SER  14           H        SER  14  40.249   3.547   2.036
   89    HA   SER  14           HA       SER  14  38.990   2.760   0.279
   90   1HB   SER  14          2HB       SER  14  36.979   4.149   2.053
   91   2HB   SER  14          1HB       SER  14  36.653   2.802   0.959
   92    HG   SER  14           HG       SER  14  37.995   1.509   2.183
   93    H    GLY  15           H        GLY  15  40.003   4.401  -1.230
   94   1HA   GLY  15          2HA       GLY  15  37.943   5.320  -2.950
   95   2HA   GLY  15          1HA       GLY  15  38.704   6.676  -2.128
   96    H    ARG  16           H        ARG  16  41.316   5.865  -2.003
   97    HA   ARG  16           HA       ARG  16  42.084   6.000  -4.817
   98   1HB   ARG  16          2HB       ARG  16  43.765   6.330  -2.315
   99   2HB   ARG  16          1HB       ARG  16  44.355   6.511  -3.959
  100   1HG   ARG  16          2HG       ARG  16  44.017   8.692  -3.264
  101   2HG   ARG  16          1HG       ARG  16  42.558   8.334  -4.189
  102   1HD   ARG  16          2HD       ARG  16  41.372   7.841  -2.079
  103   2HD   ARG  16          1HD       ARG  16  42.825   8.265  -1.173
  104    HE   ARG  16           HE       ARG  16  41.470  10.216  -2.921
  105   1HH1  ARG  16          1HH1      ARG  16  42.809   9.297   0.176
  106   2HH1  ARG  16          2HH1      ARG  16  42.534  10.842   0.908
  107   1HH2  ARG  16          1HH2      ARG  16  41.103  12.276  -1.964
  108   2HH2  ARG  16          2HH2      ARG  16  41.554  12.545  -0.314
  109    H    CYS  17           H        CYS  17  44.224   4.707  -5.283
  110    HA   CYS  17           HA       CYS  17  44.149   2.056  -4.086
  111   1HB   CYS  17          2HB       CYS  17  42.517   2.460  -6.198
  112   2HB   CYS  17          1HB       CYS  17  44.006   2.028  -7.039
  113    H    ILE  18           H        ILE  18  46.251   1.999  -3.556
  114    HA   ILE  18           HA       ILE  18  48.265   2.655  -5.612
  115    HB   ILE  18           HB       ILE  18  49.769   3.243  -3.832
  116   1HG1  ILE  18          2HG1      ILE  18  47.700   2.501  -1.787
  117   2HG1  ILE  18          1HG1      ILE  18  48.847   1.307  -2.390
  118   1HG2  ILE  18          1HG2      ILE  18  48.033   4.936  -4.377
  119   2HG2  ILE  18          2HG2      ILE  18  48.608   5.052  -2.713
  120   3HG2  ILE  18          3HG2      ILE  18  47.047   4.301  -3.055
  121   1HD1  ILE  18          1HD1      ILE  18  50.692   2.694  -1.651
  122   2HD1  ILE  18          2HD1      ILE  18  49.605   2.281  -0.320
  123   3HD1  ILE  18          3HD1      ILE  18  49.543   3.888  -1.040
  124    HA   PRO  19           HA       PRO  19  49.650  -1.625  -5.171
  125   1HB   PRO  19          2HB       PRO  19  52.453  -0.766  -4.916
  126   2HB   PRO  19          1HB       PRO  19  51.685  -1.713  -6.193
  127   1HG   PRO  19          2HG       PRO  19  52.503   0.815  -6.603
  128   2HG   PRO  19          1HG       PRO  19  51.051   0.164  -7.384
  129   1HD   PRO  19          2HD       PRO  19  51.269   1.945  -4.983
  130   2HD   PRO  19          1HD       PRO  19  50.134   2.031  -6.350
  131    H    ILE  20           H        ILE  20  50.653  -3.122  -3.620
  132    HA   ILE  20           HA       ILE  20  50.376  -2.071  -0.938
  133    HB   ILE  20           HB       ILE  20  49.424  -4.263  -1.752
  134   1HG1  ILE  20          2HG1      ILE  20  49.831  -5.413   0.408
  135   2HG1  ILE  20          1HG1      ILE  20  51.108  -4.251   0.748
  136   1HG2  ILE  20          1HG2      ILE  20  52.257  -5.202  -1.360
  137   2HG2  ILE  20          2HG2      ILE  20  51.394  -5.119  -2.897
  138   3HG2  ILE  20          3HG2      ILE  20  50.859  -6.239  -1.642
  139   1HD1  ILE  20          1HD1      ILE  20  49.055  -3.688   1.917
  140   2HD1  ILE  20          2HD1      ILE  20  48.192  -3.605   0.380
  141   3HD1  ILE  20          3HD1      ILE  20  49.472  -2.444   0.737
  142    H    SER  21           H        SER  21  51.937  -2.729   0.762
  143    HA   SER  21           HA       SER  21  53.981  -2.635   1.731
  144   1HB   SER  21          2HB       SER  21  54.528  -4.454  -0.003
  145   2HB   SER  21          1HB       SER  21  55.279  -3.164  -0.937
  146    HG   SER  21           HG       SER  21  56.442  -2.735   1.157
  147    H    TRP  22           H        TRP  22  52.628  -0.567  -0.042
  148    HA   TRP  22           HA       TRP  22  54.793   1.441   0.026
  149   1HB   TRP  22          2HB       TRP  22  52.013   1.515  -1.153
  150   2HB   TRP  22          1HB       TRP  22  53.074   2.914  -1.088
  151    HD1  TRP  22           HD1      TRP  22  53.935  -0.687  -2.209
  152    HE1  TRP  22           HE1      TRP  22  54.827  -0.561  -4.601
  153    HE3  TRP  22           HE3      TRP  22  53.315   4.307  -3.054
  154    HZ2  TRP  22           HZ2      TRP  22  55.244   1.392  -6.607
  155    HZ3  TRP  22           HZ3      TRP  22  53.979   5.227  -5.239
  156    HH2  TRP  22           HH2      TRP  22  54.921   3.796  -6.976
  157    H    THR  23           H        THR  23  52.801   0.131   2.103
  158    HA   THR  23           HA       THR  23  51.260   2.373   3.013
  159    HB   THR  23           HB       THR  23  50.297   0.740   4.585
  160    HG1  THR  23           HG1      THR  23  52.622  -0.504   4.153
  161   1HG2  THR  23          1HG2      THR  23  50.606  -0.402   1.805
  162   2HG2  THR  23          2HG2      THR  23  49.422   0.817   2.288
  163   3HG2  THR  23          3HG2      THR  23  49.340  -0.811   2.964
  164    H    CYS  24           H        CYS  24  51.699   0.684   5.639
  165    HA   CYS  24           HA       CYS  24  53.240   2.411   7.157
  166   1HB   CYS  24          2HB       CYS  24  52.535  -0.487   7.504
  167   2HB   CYS  24          1HB       CYS  24  53.145   0.560   8.788
  168    H    ASP  25           H        ASP  25  55.143   2.559   5.603
  169    HA   ASP  25           HA       ASP  25  57.238   0.822   6.530
  170   1HB   ASP  25          2HB       ASP  25  57.909   0.417   4.009
  171   2HB   ASP  25          1HB       ASP  25  56.831  -0.675   4.861
  172    H    LEU  26           H        LEU  26  56.509   3.651   6.528
  173    HA   LEU  26           HA       LEU  26  57.894   5.386   7.034
  174   1HB   LEU  26          2HB       LEU  26  60.010   3.764   5.637
  175   2HB   LEU  26          1HB       LEU  26  60.308   5.351   6.318
  176    HG   LEU  26           HG       LEU  26  59.362   2.970   7.918
  177   1HD1  LEU  26          1HD1      LEU  26  61.618   2.617   7.035
  178   2HD1  LEU  26          2HD1      LEU  26  61.636   2.871   8.780
  179   3HD1  LEU  26          3HD1      LEU  26  62.118   4.176   7.696
  180   1HD2  LEU  26          1HD2      LEU  26  59.930   4.339   9.842
  181   2HD2  LEU  26          2HD2      LEU  26  58.727   5.153   8.840
  182   3HD2  LEU  26          3HD2      LEU  26  60.417   5.661   8.779
  183    H    ASP  27           H        ASP  27  56.383   4.948   4.386
  184    HA   ASP  27           HA       ASP  27  57.551   7.386   3.222
  185   1HB   ASP  27          2HB       ASP  27  57.588   5.098   1.832
  186   2HB   ASP  27          1HB       ASP  27  55.972   5.654   1.397
  187    H    ASP  28           H        ASP  28  55.867   8.621   1.893
  188    HA   ASP  28           HA       ASP  28  53.697   8.968   3.847
  189   1HB   ASP  28          2HB       ASP  28  55.310  10.831   3.556
  190   2HB   ASP  28          1HB       ASP  28  54.808  10.975   1.877
  191    H    ASP  29           H        ASP  29  52.445   7.305   2.799
  192    HA   ASP  29           HA       ASP  29  51.041   8.259   0.399
  193   1HB   ASP  29          2HB       ASP  29  51.430   5.584   1.632
  194   2HB   ASP  29          1HB       ASP  29  49.863   5.878   0.885
  195    H    CYS  30           H        CYS  30  48.798   6.384   1.665
  196    HA   CYS  30           HA       CYS  30  47.813   7.823   3.832
  197   1HB   CYS  30          2HB       CYS  30  45.916   8.988   2.782
  198   2HB   CYS  30          1HB       CYS  30  47.465   9.649   2.265
  199    H    GLY  31           H        GLY  31  45.865   7.027   4.560
  200   1HA   GLY  31          2HA       GLY  31  44.171   5.204   3.297
  201   2HA   GLY  31          1HA       GLY  31  45.439   4.292   4.126
  202    H    ASP  32           H        ASP  32  45.961   6.047   6.142
  203    HA   ASP  32           HA       ASP  32  43.418   6.223   7.651
  204   1HB   ASP  32          2HB       ASP  32  44.817   6.249   9.706
  205   2HB   ASP  32          1HB       ASP  32  45.007   4.770   8.780
  206    H    ARG  33           H        ARG  33  46.299   7.854   6.638
  207    HA   ARG  33           HA       ARG  33  45.185  10.435   6.548
  208   1HB   ARG  33          2HB       ARG  33  45.321  10.334   8.978
  209   2HB   ARG  33          1HB       ARG  33  46.996   9.816   8.891
  210   1HG   ARG  33          2HG       ARG  33  47.552  12.008   7.856
  211   2HG   ARG  33          1HG       ARG  33  45.884  12.511   8.152
  212   1HD   ARG  33          2HD       ARG  33  46.181  12.153  10.538
  213   2HD   ARG  33          1HD       ARG  33  47.826  11.585  10.265
  214    HE   ARG  33           HE       ARG  33  47.419  14.214   9.245
  215   1HH1  ARG  33          1HH1      ARG  33  48.052  12.400  12.173
  216   2HH1  ARG  33          2HH1      ARG  33  48.792  13.737  12.996
  217   1HH2  ARG  33          1HH2      ARG  33  48.415  15.982  10.345
  218   2HH2  ARG  33          2HH2      ARG  33  48.990  15.758  11.971
  219    H    SER  34           H        SER  34  48.297   9.049   7.537
  220    HA   SER  34           HA       SER  34  49.478   9.909   4.983
  221   1HB   SER  34          2HB       SER  34  50.770  10.024   7.722
  222   2HB   SER  34          1HB       SER  34  51.574  10.403   6.198
  223    HG   SER  34           HG       SER  34  50.515  12.242   6.058
  224    H    ASP  35           H        ASP  35  48.515   7.407   6.748
  225    HA   ASP  35           HA       ASP  35  48.791   5.174   6.594
  226   1HB   ASP  35          2HB       ASP  35  49.605   6.106   4.146
  227   2HB   ASP  35          1HB       ASP  35  50.958   5.097   4.664
  228    H    GLU  36           H        GLU  36  50.384   6.848   8.354
  229    HA   GLU  36           HA       GLU  36  52.328   4.787   9.059
  230   1HB   GLU  36          2HB       GLU  36  52.833   7.739   8.856
  231   2HB   GLU  36          1HB       GLU  36  53.786   6.734   9.941
  232   1HG   GLU  36          2HG       GLU  36  53.509   6.365   6.971
  233   2HG   GLU  36          1HG       GLU  36  54.896   7.065   7.809
  234    H    SER  37           H        SER  37  49.824   4.851  10.118
  235    HA   SER  37           HA       SER  37  50.497   5.308  12.911
  236   1HB   SER  37          2HB       SER  37  48.024   6.522  11.650
  237   2HB   SER  37          1HB       SER  37  48.373   6.490  13.380
  238    HG   SER  37           HG       SER  37  50.498   7.464  12.100
  239    H    ALA  38           H        ALA  38  47.763   4.358  10.809
  240    HA   ALA  38           HA       ALA  38  46.335   2.936  12.714
  241   1HB   ALA  38          1HB       ALA  38  46.389   2.366   9.757
  242   2HB   ALA  38          2HB       ALA  38  45.456   3.648  10.531
  243   3HB   ALA  38          3HB       ALA  38  45.099   1.958  10.890
  244    H    SER  39           H        SER  39  48.264   1.356  10.132
  245    HA   SER  39           HA       SER  39  48.297  -1.047  11.840
  246   1HB   SER  39          2HB       SER  39  47.150  -1.270   9.634
  247   2HB   SER  39          1HB       SER  39  48.658  -0.844   8.826
  248    HG   SER  39           HG       SER  39  49.524  -2.729  10.104
  249    H    CYS  40           H        CYS  40  50.151   1.450  11.285
  250    HA   CYS  40           HA       CYS  40  52.568   0.239  10.357
  251   1HB   CYS  40          2HB       CYS  40  52.231   3.036  11.398
  252   2HB   CYS  40          1HB       CYS  40  53.316   2.447  10.137
  253    H    ALA  41           H        ALA  41  51.718  -0.842  12.862
  254    HA   ALA  41           HA       ALA  41  53.758   0.153  14.710
  255   1HB   ALA  41          1HB       ALA  41  52.865  -1.502  16.284
  256   2HB   ALA  41          2HB       ALA  41  51.766  -2.100  15.041
  257   3HB   ALA  41          3HB       ALA  41  51.584  -0.460  15.665
  258    H    TYR  42           H        TYR  42  55.435  -0.396  13.116
  259    HA   TYR  42           HA       TYR  42  55.903  -3.291  12.878
  260   1HB   TYR  42          2HB       TYR  42  57.071  -2.742  10.723
  261   2HB   TYR  42          1HB       TYR  42  55.336  -2.463  10.715
  262    HD1  TYR  42           HD1      TYR  42  58.622  -0.740  10.988
  263    HD2  TYR  42           HD2      TYR  42  54.464  -0.344  10.190
  264    HE1  TYR  42           HE1      TYR  42  59.002   1.553  10.185
  265    HE2  TYR  42           HE2      TYR  42  54.833   1.944   9.383
  266    HH   TYR  42           HH       TYR  42  56.327   3.684   9.378
  267    HA   PRO  43           HA       PRO  43  60.084  -2.317  14.204
  268   1HB   PRO  43          2HB       PRO  43  60.723  -4.803  14.963
  269   2HB   PRO  43          1HB       PRO  43  59.608  -3.817  15.915
  270   1HG   PRO  43          2HG       PRO  43  59.058  -6.160  14.213
  271   2HG   PRO  43          1HG       PRO  43  58.116  -5.504  15.560
  272   1HD   PRO  43          2HD       PRO  43  57.724  -5.102  12.723
  273   2HD   PRO  43          1HD       PRO  43  56.723  -4.517  14.068
  274    H    THR  44           H        THR  44  59.050  -3.404  11.396
  275    HA   THR  44           HA       THR  44  61.656  -4.245  10.395
  276    HB   THR  44           HB       THR  44  60.553  -6.333  11.133
  277    HG1  THR  44           HG1      THR  44  60.993  -5.866   8.376
  278   1HG2  THR  44          1HG2      THR  44  58.538  -7.137   9.976
  279   2HG2  THR  44          2HG2      THR  44  58.420  -5.605   9.111
  280   3HG2  THR  44          3HG2      THR  44  58.216  -5.645  10.863
  281    H    CYS  45           H        CYS  45  59.565  -2.016  10.000
  282    HA   CYS  45           HA       CYS  45  58.394  -0.922   8.393
  283   1HB   CYS  45          2HB       CYS  45  60.422  -2.268   6.593
  284   2HB   CYS  45          1HB       CYS  45  59.359  -0.955   6.102
  285    H    PHE  46           H        PHE  46  58.600  -2.648   5.582
  286    HA   PHE  46           HA       PHE  46  56.283  -4.301   6.313
  287   1HB   PHE  46          2HB       PHE  46  56.155  -1.990   4.798
  288   2HB   PHE  46          1HB       PHE  46  56.153  -3.280   3.595
  289    HD1  PHE  46           HD1      PHE  46  53.964  -3.340   2.853
  290    HD2  PHE  46           HD2      PHE  46  54.760  -3.321   7.024
  291    HE1  PHE  46           HE1      PHE  46  51.591  -3.777   3.300
  292    HE2  PHE  46           HE2      PHE  46  52.396  -3.755   7.499
  293    HZ   PHE  46           HZ       PHE  46  50.795  -3.980   5.633
  294    HA   PRO  47           HA       PRO  47  58.950  -7.220   4.221
  295   1HB   PRO  47          2HB       PRO  47  57.894  -9.433   5.284
  296   2HB   PRO  47          1HB       PRO  47  58.872  -8.329   6.257
  297   1HG   PRO  47          2HG       PRO  47  55.901  -8.624   6.132
  298   2HG   PRO  47          1HG       PRO  47  56.944  -8.368   7.543
  299   1HD   PRO  47          2HD       PRO  47  55.520  -6.373   6.253
  300   2HD   PRO  47          1HD       PRO  47  56.953  -6.100   7.262
  301    H    LEU  48           H        LEU  48  56.563  -6.085   2.860
  302    HA   LEU  48           HA       LEU  48  55.340  -8.467   1.705
  303   1HB   LEU  48          2HB       LEU  48  54.652  -5.538   1.464
  304   2HB   LEU  48          1HB       LEU  48  53.896  -6.777   0.479
  305    HG   LEU  48           HG       LEU  48  53.704  -6.436   3.465
  306   1HD1  LEU  48          1HD1      LEU  48  51.295  -6.400   2.977
  307   2HD1  LEU  48          2HD1      LEU  48  51.657  -6.523   1.257
  308   3HD1  LEU  48          3HD1      LEU  48  52.162  -5.095   2.164
  309   1HD2  LEU  48          1HD2      LEU  48  54.056  -8.803   3.021
  310   2HD2  LEU  48          2HD2      LEU  48  52.773  -8.778   1.811
  311   3HD2  LEU  48          3HD2      LEU  48  52.390  -8.495   3.509
  312    H    THR  49           H        THR  49  56.848  -5.467   0.446
  313    HA   THR  49           HA       THR  49  58.459  -6.933  -1.368
  314    HB   THR  49           HB       THR  49  56.491  -7.283  -2.641
  315    HG1  THR  49           HG1      THR  49  57.197  -6.516  -4.519
  316   1HG2  THR  49          1HG2      THR  49  55.052  -5.567  -1.644
  317   2HG2  THR  49          2HG2      THR  49  55.000  -5.523  -3.408
  318   3HG2  THR  49          3HG2      THR  49  55.937  -4.320  -2.524
  319    H    GLN  50           H        GLN  50  60.043  -5.700  -0.410
  320    HA   GLN  50           HA       GLN  50  60.644  -3.225  -1.620
  321   1HB   GLN  50          2HB       GLN  50  60.556  -1.765   0.330
  322   2HB   GLN  50          1HB       GLN  50  58.958  -2.388  -0.043
  323   1HG   GLN  50          2HG       GLN  50  59.104  -3.962   1.767
  324   2HG   GLN  50          1HG       GLN  50  60.766  -3.475   2.093
  325   1HE2  GLN  50          1HE2      GLN  50  58.303  -1.185   1.197
  326   2HE2  GLN  50          2HE2      GLN  50  58.188  -0.412   2.737
  327    H    PHE  51           H        PHE  51  62.432  -2.142   0.144
  328    HA   PHE  51           HA       PHE  51  64.204  -4.301   1.030
  329   1HB   PHE  51          2HB       PHE  51  64.785  -3.778  -1.347
  330   2HB   PHE  51          1HB       PHE  51  65.097  -2.114  -0.874
  331    HD1  PHE  51           HD1      PHE  51  66.213  -5.606  -0.336
  332    HD2  PHE  51           HD2      PHE  51  67.203  -1.479  -0.058
  333    HE1  PHE  51           HE1      PHE  51  68.545  -6.198   0.166
  334    HE2  PHE  51           HE2      PHE  51  69.520  -2.059   0.461
  335    HZ   PHE  51           HZ       PHE  51  70.205  -4.421   0.574
  336    H    THR  52           H        THR  52  65.987  -3.429   2.428
  337    HA   THR  52           HA       THR  52  65.055  -0.995   3.784
  338    HB   THR  52           HB       THR  52  66.818  -3.180   4.914
  339    HG1  THR  52           HG1      THR  52  64.091  -2.723   5.558
  340   1HG2  THR  52          1HG2      THR  52  66.283  -2.159   7.064
  341   2HG2  THR  52          2HG2      THR  52  65.312  -0.931   6.254
  342   3HG2  THR  52          3HG2      THR  52  67.057  -0.986   6.000
  343    H    CYS  53           H        CYS  53  66.164   0.728   3.134
  344    HA   CYS  53           HA       CYS  53  68.835   0.686   2.198
  345   1HB   CYS  53          2HB       CYS  53  67.139   2.395   1.589
  346   2HB   CYS  53          1HB       CYS  53  67.283   3.045   3.219
  347    H    ASN  54           H        ASN  54  70.758   1.292   3.171
  348    HA   ASN  54           HA       ASN  54  70.924   0.724   5.972
  349   1HB   ASN  54          2HB       ASN  54  72.959   1.520   3.904
  350   2HB   ASN  54          1HB       ASN  54  73.383   1.445   5.610
  351   1HD2  ASN  54          1HD2      ASN  54  71.073  -0.723   4.129
  352   2HD2  ASN  54          2HD2      ASN  54  72.049  -2.142   4.238
  353    H    ASN  55           H        ASN  55  70.245   3.504   4.224
  354    HA   ASN  55           HA       ASN  55  71.224   5.512   5.912
  355   1HB   ASN  55          2HB       ASN  55  70.209   5.788   3.614
  356   2HB   ASN  55          1HB       ASN  55  68.634   5.528   4.346
  357   1HD2  ASN  55          1HD2      ASN  55  71.348   7.684   4.040
  358   2HD2  ASN  55          2HD2      ASN  55  70.549   9.080   4.702
  359    H    GLY  56           H        GLY  56  69.083   3.035   6.515
  360   1HA   GLY  56          2HA       GLY  56  68.091   2.640   8.633
  361   2HA   GLY  56          1HA       GLY  56  67.998   4.382   8.883
  362    H    ARG  57           H        ARG  57  67.140   4.075   5.818
  363    HA   ARG  57           HA       ARG  57  64.303   4.267   6.509
  364   1HB   ARG  57          2HB       ARG  57  64.053   5.446   4.465
  365   2HB   ARG  57          1HB       ARG  57  65.569   6.021   5.151
  366   1HG   ARG  57          2HG       ARG  57  66.679   4.230   3.717
  367   2HG   ARG  57          1HG       ARG  57  65.143   4.162   2.855
  368   1HD   ARG  57          2HD       ARG  57  66.774   6.641   3.285
  369   2HD   ARG  57          1HD       ARG  57  66.806   5.662   1.818
  370    HE   ARG  57           HE       ARG  57  64.152   6.458   2.466
  371   1HH1  ARG  57          1HH1      ARG  57  67.144   7.647   1.086
  372   2HH1  ARG  57          2HH1      ARG  57  66.365   8.848   0.111
  373   1HH2  ARG  57          1HH2      ARG  57  63.119   8.041   1.174
  374   2HH2  ARG  57          2HH2      ARG  57  64.074   9.075   0.165
  375    H    CYS  58           H        CYS  58  62.741   3.157   5.088
  376    HA   CYS  58           HA       CYS  58  63.903   0.776   3.827
  377   1HB   CYS  58          2HB       CYS  58  61.165   1.246   5.007
  378   2HB   CYS  58          1HB       CYS  58  61.530  -0.133   3.969
  379    H    ILE  59           H        ILE  59  63.570   0.387   1.718
  380    HA   ILE  59           HA       ILE  59  62.339   2.597   0.218
  381    HB   ILE  59           HB       ILE  59  64.004   2.158  -1.555
  382   1HG1  ILE  59          2HG1      ILE  59  65.316   0.359   0.492
  383   2HG1  ILE  59          1HG1      ILE  59  64.402  -0.224  -0.892
  384   1HG2  ILE  59          1HG2      ILE  59  65.952   3.110  -0.369
  385   2HG2  ILE  59          2HG2      ILE  59  65.133   2.798   1.163
  386   3HG2  ILE  59          3HG2      ILE  59  64.439   3.934   0.007
  387   1HD1  ILE  59          1HD1      ILE  59  66.781  -0.319  -1.319
  388   2HD1  ILE  59          2HD1      ILE  59  66.916   1.409  -1.001
  389   3HD1  ILE  59          3HD1      ILE  59  66.001   0.838  -2.398
  390    H    ASN  60           H        ASN  60  61.956   1.811  -2.182
  391    HA   ASN  60           HA       ASN  60  60.277  -0.538  -1.972
  392   1HB   ASN  60          2HB       ASN  60  59.560   1.567  -3.158
  393   2HB   ASN  60          1HB       ASN  60  60.746   1.189  -4.406
  394   1HD2  ASN  60          1HD2      ASN  60  57.726   0.264  -2.935
  395   2HD2  ASN  60          2HD2      ASN  60  57.223  -0.812  -4.190
  396    H    ILE  61           H        ILE  61  60.413  -2.343  -3.448
  397    HA   ILE  61           HA       ILE  61  63.132  -3.257  -3.599
  398    HB   ILE  61           HB       ILE  61  61.142  -4.636  -2.856
  399   1HG1  ILE  61          2HG1      ILE  61  62.887  -5.796  -5.044
  400   2HG1  ILE  61          1HG1      ILE  61  63.364  -5.598  -3.360
  401   1HG2  ILE  61          1HG2      ILE  61  59.611  -4.040  -4.639
  402   2HG2  ILE  61          2HG2      ILE  61  59.869  -5.784  -4.603
  403   3HG2  ILE  61          3HG2      ILE  61  60.670  -4.800  -5.828
  404   1HD1  ILE  61          1HD1      ILE  61  61.135  -7.351  -4.364
  405   2HD1  ILE  61          2HD1      ILE  61  61.615  -7.149  -2.681
  406   3HD1  ILE  61          3HD1      ILE  61  62.728  -7.888  -3.831
  407    H    ASN  62           H        ASN  62  61.518  -1.346  -5.676
  408    HA   ASN  62           HA       ASN  62  62.278  -2.760  -8.122
  409   1HB   ASN  62          2HB       ASN  62  60.052  -1.376  -7.595
  410   2HB   ASN  62          1HB       ASN  62  61.040  -0.052  -8.202
  411   1HD2  ASN  62          1HD2      ASN  62  58.650  -1.241  -9.335
  412   2HD2  ASN  62          2HD2      ASN  62  59.086  -1.778 -10.916
  413    H    TRP  63           H        TRP  63  64.225  -1.512  -6.209
  414    HA   TRP  63           HA       TRP  63  65.426   0.499  -8.003
  415   1HB   TRP  63          2HB       TRP  63  65.804   0.059  -5.036
  416   2HB   TRP  63          1HB       TRP  63  66.769   1.180  -5.988
  417    HD1  TRP  63           HD1      TRP  63  63.239   1.246  -7.140
  418    HE1  TRP  63           HE1      TRP  63  62.034   3.321  -6.219
  419    HE3  TRP  63           HE3      TRP  63  66.683   2.703  -3.664
  420    HZ2  TRP  63           HZ2      TRP  63  62.482   5.309  -4.275
  421    HZ3  TRP  63           HZ3      TRP  63  66.220   4.706  -2.317
  422    HH2  TRP  63           HH2      TRP  63  64.163   5.982  -2.617
  423    H    ARG  64           H        ARG  64  65.510  -2.626  -7.489
  424    HA   ARG  64           HA       ARG  64  68.197  -3.392  -7.462
  425   1HB   ARG  64          2HB       ARG  64  66.023  -4.606  -9.183
  426   2HB   ARG  64          1HB       ARG  64  67.494  -5.395  -8.637
  427   1HG   ARG  64          2HG       ARG  64  65.351  -4.428  -6.765
  428   2HG   ARG  64          1HG       ARG  64  65.380  -6.049  -7.457
  429   1HD   ARG  64          2HD       ARG  64  67.544  -4.819  -5.743
  430   2HD   ARG  64          1HD       ARG  64  66.354  -6.007  -5.208
  431    HE   ARG  64           HE       ARG  64  68.202  -6.665  -7.393
  432   1HH1  ARG  64          1HH1      ARG  64  66.934  -7.256  -4.195
  433   2HH1  ARG  64          2HH1      ARG  64  67.944  -8.631  -3.900
  434   1HH2  ARG  64          1HH2      ARG  64  69.529  -8.510  -7.035
  435   2HH2  ARG  64          2HH2      ARG  64  69.394  -9.367  -5.533
  436    H    CYS  65           H        CYS  65  69.528  -1.993  -8.624
  437    HA   CYS  65           HA       CYS  65  68.791  -1.109 -11.253
  438   1HB   CYS  65          2HB       CYS  65  70.081   0.319  -9.649
  439   2HB   CYS  65          1HB       CYS  65  71.448  -0.772  -9.848
  440    H    ASP  66           H        ASP  66  71.057  -3.355  -9.885
  441    HA   ASP  66           HA       ASP  66  71.401  -4.716 -12.399
  442   1HB   ASP  66          2HB       ASP  66  73.886  -4.432 -12.403
  443   2HB   ASP  66          1HB       ASP  66  73.009  -2.944 -12.732
  444    H    ASN  67           H        ASN  67  73.056  -4.352  -9.245
  445    HA   ASN  67           HA       ASN  67  73.286  -7.220  -9.038
  446   1HB   ASN  67          2HB       ASN  67  75.174  -5.806  -8.346
  447   2HB   ASN  67          1HB       ASN  67  74.158  -5.060  -7.118
  448   1HD2  ASN  67          1HD2      ASN  67  74.715  -5.741  -5.189
  449   2HD2  ASN  67          2HD2      ASN  67  75.113  -7.377  -4.771
  450    H    ASP  68           H        ASP  68  72.455  -4.920  -6.503
  451    HA   ASP  68           HA       ASP  68  70.049  -6.519  -5.931
  452   1HB   ASP  68          2HB       ASP  68  72.072  -6.750  -4.306
  453   2HB   ASP  68          1HB       ASP  68  71.615  -5.143  -3.757
  454    H    ASN  69           H        ASN  69  69.762  -4.339  -3.651
  455    HA   ASN  69           HA       ASN  69  68.163  -2.702  -5.498
  456   1HB   ASN  69          2HB       ASN  69  67.210  -4.242  -3.591
  457   2HB   ASN  69          1HB       ASN  69  67.573  -2.847  -2.580
  458   1HD2  ASN  69          1HD2      ASN  69  66.400  -0.977  -2.842
  459   2HD2  ASN  69          2HD2      ASN  69  64.934  -0.921  -3.760
  460    H    ASP  70           H        ASP  70  68.439  -0.651  -5.679
  461    HA   ASP  70           HA       ASP  70  70.727   0.666  -4.727
  462   1HB   ASP  70          2HB       ASP  70  69.082   0.943  -6.818
  463   2HB   ASP  70          1HB       ASP  70  68.445   2.226  -5.791
  464    H    CYS  71           H        CYS  71  69.859   3.300  -4.376
  465    HA   CYS  71           HA       CYS  71  67.787   3.853  -2.641
  466   1HB   CYS  71          2HB       CYS  71  68.992   2.391  -1.009
  467   2HB   CYS  71          1HB       CYS  71  70.348   3.513  -1.064
  468    H    GLY  72           H        GLY  72  71.067   4.539  -3.617
  469   1HA   GLY  72          2HA       GLY  72  71.964   6.596  -4.249
  470   2HA   GLY  72          1HA       GLY  72  70.523   7.396  -3.635
  471    H    ASP  73           H        ASP  73  71.618   5.174  -1.450
  472    HA   ASP  73           HA       ASP  73  73.158   7.169   0.059
  473   1HB   ASP  73          2HB       ASP  73  71.052   6.911   1.162
  474   2HB   ASP  73          1HB       ASP  73  71.102   5.162   0.998
  475    H    ASN  74           H        ASN  74  72.468   3.733   0.554
  476    HA   ASN  74           HA       ASN  74  74.893   2.669  -0.308
  477   1HB   ASN  74          2HB       ASN  74  75.724   4.091   1.647
  478   2HB   ASN  74          1HB       ASN  74  74.853   2.986   2.699
  479   1HD2  ASN  74          1HD2      ASN  74  75.584   0.843   2.904
  480   2HD2  ASN  74          2HD2      ASN  74  77.188   0.390   2.445
  481    H    SER  75           H        SER  75  72.632   1.616  -0.825
  482    HA   SER  75           HA       SER  75  71.851  -0.281   1.232
  483   1HB   SER  75          2HB       SER  75  70.681   0.443  -1.427
  484   2HB   SER  75          1HB       SER  75  70.092  -0.923  -0.478
  485    HG   SER  75           HG       SER  75  68.951   1.073  -0.152
  486    H    ASP  76           H        ASP  76  71.548  -1.146  -2.063
  487    HA   ASP  76           HA       ASP  76  72.727  -3.633  -1.950
  488   1HB   ASP  76          2HB       ASP  76  71.376  -3.066  -3.821
  489   2HB   ASP  76          1HB       ASP  76  72.380  -1.678  -4.219
  490    H    GLU  77           H        GLU  77  74.049  -0.719  -3.373
  491    HA   GLU  77           HA       GLU  77  76.717  -1.456  -2.459
  492   1HB   GLU  77          2HB       GLU  77  77.273  -0.046  -4.715
  493   2HB   GLU  77          1HB       GLU  77  77.224  -1.800  -4.633
  494   1HG   GLU  77          2HG       GLU  77  75.997  -1.063  -6.552
  495   2HG   GLU  77          1HG       GLU  77  74.870  -1.740  -5.382
  496    H    ALA  78           H        ALA  78  74.733   1.116  -3.743
  497    HA   ALA  78           HA       ALA  78  74.809   2.839  -1.585
  498   1HB   ALA  78          1HB       ALA  78  76.928   3.543  -3.615
  499   2HB   ALA  78          2HB       ALA  78  77.211   3.058  -1.944
  500   3HB   ALA  78          3HB       ALA  78  76.389   4.577  -2.293
  501    H    GLY  79           H        GLY  79  75.286   3.038  -5.105
  502   1HA   GLY  79          2HA       GLY  79  72.705   4.021  -5.665
  503   2HA   GLY  79          1HA       GLY  79  73.827   5.369  -5.547
  504    H    CYS  80           H        CYS  80  72.708   2.752  -7.433
  505    HA   CYS  80           HA       CYS  80  74.850   2.669  -9.336
  506   1HB   CYS  80          2HB       CYS  80  73.508   0.711  -9.045
  507   2HB   CYS  80          1HB       CYS  80  72.021   1.614  -9.302
  508    H    SER  81           H        SER  81  72.435   4.886  -8.700
  509    HA   SER  81           HA       SER  81  72.123   5.750 -11.470
  510   1HB   SER  81          2HB       SER  81  70.875   6.854  -8.944
  511   2HB   SER  81          1HB       SER  81  70.426   7.263 -10.602
  512    HG   SER  81           HG       SER  81  70.385   4.586  -9.741
  513    H    HIS  82           HN       HIS  82  73.923   6.755 -12.116
  514    HA   HIS  82           HA       HIS  82  75.317   8.496 -12.502
  515   1HB   HIS  82          2HB       HIS  82  73.778   9.826 -10.270
  516   2HB   HIS  82          1HB       HIS  82  75.071  10.615 -11.166
  517    HD1  HIS  82           HD1      HIS  82  74.580  11.016 -13.786
  518    HD2  HIS  82           HD2      HIS  82  71.333   9.845 -11.464
  519    HE1  HIS  82           HE1      HIS  82  72.505  11.560 -15.131
  Start of MODEL    6
    1   1H    SER   1          1HT       SER   1  27.670  -4.435   5.499
    2   2H    SER   1          2HT       SER   1  27.324  -5.862   4.661
    3   3H    SER   1          3HT       SER   1  27.490  -4.407   3.821
    4    HA   SER   1           HA       SER   1  29.650  -5.730   5.340
    5   1HB   SER   1          2HB       SER   1  29.277  -5.560   2.338
    6   2HB   SER   1          1HB       SER   1  30.533  -6.441   3.207
    7    HG   SER   1           HG       SER   1  29.138  -8.017   2.953
    8    H    ALA   2           H        ALA   2  31.798  -4.832   4.621
    9    HA   ALA   2           HA       ALA   2  31.566  -1.909   4.420
   10   1HB   ALA   2          1HB       ALA   2  33.837  -1.842   5.310
   11   2HB   ALA   2          2HB       ALA   2  33.915  -3.605   5.266
   12   3HB   ALA   2          3HB       ALA   2  32.782  -2.800   6.351
   13    H    ARG   3           H        ARG   3  33.684  -0.965   3.338
   14    HA   ARG   3           HA       ARG   3  34.512  -2.465   0.996
   15   1HB   ARG   3          2HB       ARG   3  33.812  -0.876  -0.622
   16   2HB   ARG   3          1HB       ARG   3  32.406  -1.208   0.365
   17   1HG   ARG   3          2HG       ARG   3  34.162   1.221   0.685
   18   2HG   ARG   3          1HG       ARG   3  32.685   1.178  -0.270
   19   1HD   ARG   3          2HD       ARG   3  31.887   2.034   1.699
   20   2HD   ARG   3          1HD       ARG   3  31.642   0.311   1.986
   21    HE   ARG   3           HE       ARG   3  34.202   1.116   2.899
   22   1HH1  ARG   3          1HH1      ARG   3  30.804   1.328   3.734
   23   2HH1  ARG   3          2HH1      ARG   3  31.101   1.494   5.433
   24   1HH2  ARG   3          1HH2      ARG   3  34.593   1.324   5.135
   25   2HH2  ARG   3          2HH2      ARG   3  33.261   1.489   6.232
   26    H    THR   4           H        THR   4  36.544  -1.939   0.331
   27    HA   THR   4           HA       THR   4  37.775   0.506   1.319
   28    HB   THR   4           HB       THR   4  39.839  -0.919   1.950
   29    HG1  THR   4           HG1      THR   4  39.262  -3.021   2.694
   30   1HG2  THR   4          1HG2      THR   4  38.546   0.361   3.581
   31   2HG2  THR   4          2HG2      THR   4  39.039  -1.196   4.249
   32   3HG2  THR   4          3HG2      THR   4  37.381  -0.960   3.702
   33    H    CYS   5           H        CYS   5  39.337  -2.357   0.121
   34    HA   CYS   5           HA       CYS   5  39.781  -1.320  -2.535
   35   1HB   CYS   5          2HB       CYS   5  41.408  -0.170  -0.821
   36   2HB   CYS   5          1HB       CYS   5  42.227  -1.729  -0.826
   37    HA   PRO   6           HA       PRO   6  39.995  -5.665  -3.342
   38   1HB   PRO   6          2HB       PRO   6  42.326  -5.264  -5.122
   39   2HB   PRO   6          1HB       PRO   6  40.732  -5.925  -5.491
   40   1HG   PRO   6          2HG       PRO   6  41.440  -3.499  -6.328
   41   2HG   PRO   6          1HG       PRO   6  39.784  -3.829  -5.769
   42   1HD   PRO   6          2HD       PRO   6  42.047  -2.486  -4.334
   43   2HD   PRO   6          1HD       PRO   6  40.327  -2.040  -4.382
   44    HA   PRO   7           HA       PRO   7  43.082  -7.860  -1.025
   45   1HB   PRO   7          2HB       PRO   7  43.894  -9.817  -2.846
   46   2HB   PRO   7          1HB       PRO   7  42.520  -9.945  -1.746
   47   1HG   PRO   7          2HG       PRO   7  42.574  -9.205  -4.632
   48   2HG   PRO   7          1HG       PRO   7  41.379 -10.163  -3.737
   49   1HD   PRO   7          2HD       PRO   7  40.889  -7.619  -4.427
   50   2HD   PRO   7          1HD       PRO   7  40.332  -8.278  -2.876
   51    H    ASN   8           H        ASN   8  45.176  -7.506  -0.608
   52    HA   ASN   8           HA       ASN   8  47.362  -6.927  -0.807
   53   1HB   ASN   8          2HB       ASN   8  47.264  -8.672  -2.711
   54   2HB   ASN   8          1HB       ASN   8  47.227  -7.286  -3.795
   55   1HD2  ASN   8          1HD2      ASN   8  49.075  -6.036  -4.042
   56   2HD2  ASN   8          2HD2      ASN   8  50.615  -6.537  -3.446
   57    H    GLN   9           H        GLN   9  44.961  -5.147  -1.385
   58    HA   GLN   9           HA       GLN   9  46.491  -2.867  -2.405
   59   1HB   GLN   9          2HB       GLN   9  44.025  -3.969  -3.451
   60   2HB   GLN   9          1HB       GLN   9  43.802  -2.312  -2.920
   61   1HG   GLN   9          2HG       GLN   9  44.376  -2.218  -5.201
   62   2HG   GLN   9          1HG       GLN   9  45.787  -1.682  -4.295
   63   1HE2  GLN   9          1HE2      GLN   9  44.854  -5.015  -4.533
   64   2HE2  GLN   9          2HE2      GLN   9  46.163  -5.521  -5.517
   65    H    PHE  10           H        PHE  10  46.072  -0.924  -1.473
   66    HA   PHE  10           HA       PHE  10  44.371  -0.938   0.919
   67   1HB   PHE  10          2HB       PHE  10  46.647  -1.091   1.683
   68   2HB   PHE  10          1HB       PHE  10  47.156   0.180   0.578
   69    HD1  PHE  10           HD1      PHE  10  47.360   2.320   1.340
   70    HD2  PHE  10           HD2      PHE  10  44.855  -0.394   3.461
   71    HE1  PHE  10           HE1      PHE  10  47.011   3.999   3.101
   72    HE2  PHE  10           HE2      PHE  10  44.501   1.295   5.222
   73    HZ   PHE  10           HZ       PHE  10  45.592   3.508   5.035
   74    H    SER  11           H        SER  11  43.194   0.903   1.217
   75    HA   SER  11           HA       SER  11  43.046   2.616  -1.119
   76   1HB   SER  11          2HB       SER  11  41.041   1.280  -0.722
   77   2HB   SER  11          1HB       SER  11  40.945   1.880   0.931
   78    HG   SER  11           HG       SER  11  40.547   3.312  -1.482
   79    H    CYS  12           H        CYS  12  43.846   4.602  -0.854
   80    HA   CYS  12           HA       CYS  12  44.170   5.896   1.608
   81   1HB   CYS  12          2HB       CYS  12  43.821   7.148  -1.128
   82   2HB   CYS  12          1HB       CYS  12  44.260   8.040   0.320
   83    H    ALA  13           H        ALA  13  42.875   7.195   2.771
   84    HA   ALA  13           HA       ALA  13  40.536   6.481   3.522
   85   1HB   ALA  13          1HB       ALA  13  41.103   9.392   3.062
   86   2HB   ALA  13          2HB       ALA  13  41.667   8.430   4.431
   87   3HB   ALA  13          3HB       ALA  13  39.941   8.730   4.219
   88    H    SER  14           H        SER  14  39.187   5.536   2.142
   89    HA   SER  14           HA       SER  14  37.482   5.244   0.693
   90   1HB   SER  14          2HB       SER  14  36.592   7.887   1.856
   91   2HB   SER  14          1HB       SER  14  35.558   6.644   1.146
   92    HG   SER  14           HG       SER  14  36.942   6.633   3.588
   93    H    GLY  15           H        GLY  15  38.810   5.486  -1.197
   94   1HA   GLY  15          2HA       GLY  15  37.488   6.600  -3.245
   95   2HA   GLY  15          1HA       GLY  15  38.445   7.959  -2.681
   96    H    ARG  16           H        ARG  16  40.793   6.507  -1.979
   97    HA   ARG  16           HA       ARG  16  41.807   6.175  -4.697
   98   1HB   ARG  16          2HB       ARG  16  43.326   6.441  -2.092
   99   2HB   ARG  16          1HB       ARG  16  44.028   6.442  -3.703
  100   1HG   ARG  16          2HG       ARG  16  43.984   8.692  -3.073
  101   2HG   ARG  16          1HG       ARG  16  42.600   8.508  -4.148
  102   1HD   ARG  16          2HD       ARG  16  41.146   8.274  -2.129
  103   2HD   ARG  16          1HD       ARG  16  42.550   8.618  -1.119
  104    HE   ARG  16           HE       ARG  16  42.464  10.724  -2.827
  105   1HH1  ARG  16          1HH1      ARG  16  40.126   9.264  -0.664
  106   2HH1  ARG  16          2HH1      ARG  16  39.260  10.737  -0.399
  107   1HH2  ARG  16          1HH2      ARG  16  41.326  12.682  -2.457
  108   2HH2  ARG  16          2HH2      ARG  16  39.937  12.684  -1.421
  109    H    CYS  17           H        CYS  17  43.873   4.492  -4.515
  110    HA   CYS  17           HA       CYS  17  43.407   2.147  -3.023
  111   1HB   CYS  17          2HB       CYS  17  41.833   2.418  -5.433
  112   2HB   CYS  17          1HB       CYS  17  42.935   1.051  -5.564
  113    H    ILE  18           H        ILE  18  45.560   2.091  -2.699
  114    HA   ILE  18           HA       ILE  18  47.300   1.851  -5.064
  115    HB   ILE  18           HB       ILE  18  48.996   2.924  -3.887
  116   1HG1  ILE  18          2HG1      ILE  18  47.585   2.252  -1.296
  117   2HG1  ILE  18          1HG1      ILE  18  48.940   1.347  -1.971
  118   1HG2  ILE  18          1HG2      ILE  18  46.527   4.037  -2.537
  119   2HG2  ILE  18          2HG2      ILE  18  47.069   4.463  -4.164
  120   3HG2  ILE  18          3HG2      ILE  18  48.066   4.872  -2.766
  121   1HD1  ILE  18          1HD1      ILE  18  50.362   3.310  -1.765
  122   2HD1  ILE  18          2HD1      ILE  18  49.670   2.845  -0.209
  123   3HD1  ILE  18          3HD1      ILE  18  49.007   4.217  -1.096
  124    HA   PRO  19           HA       PRO  19  48.090  -2.342  -3.710
  125   1HB   PRO  19          2HB       PRO  19  50.904  -2.032  -4.520
  126   2HB   PRO  19          1HB       PRO  19  49.667  -3.119  -5.161
  127   1HG   PRO  19          2HG       PRO  19  50.570  -1.005  -6.566
  128   2HG   PRO  19          1HG       PRO  19  48.888  -1.557  -6.672
  129   1HD   PRO  19          2HD       PRO  19  50.032   0.755  -5.152
  130   2HD   PRO  19          1HD       PRO  19  48.516   0.650  -6.074
  131    H    ILE  20           H        ILE  20  48.863  -3.343  -1.844
  132    HA   ILE  20           HA       ILE  20  50.005  -1.595   0.131
  133    HB   ILE  20           HB       ILE  20  49.647  -4.537   0.472
  134   1HG1  ILE  20          2HG1      ILE  20  47.602  -2.340   0.778
  135   2HG1  ILE  20          1HG1      ILE  20  47.526  -3.704  -0.329
  136   1HG2  ILE  20          1HG2      ILE  20  49.348  -3.905   2.840
  137   2HG2  ILE  20          2HG2      ILE  20  49.646  -2.223   2.402
  138   3HG2  ILE  20          3HG2      ILE  20  50.921  -3.423   2.205
  139   1HD1  ILE  20          1HD1      ILE  20  47.390  -3.838   2.668
  140   2HD1  ILE  20          2HD1      ILE  20  47.351  -5.226   1.578
  141   3HD1  ILE  20          3HD1      ILE  20  46.045  -4.037   1.544
  142    H    SER  21           H        SER  21  51.867  -1.384  -1.453
  143    HA   SER  21           HA       SER  21  54.075  -2.774  -0.155
  144   1HB   SER  21          2HB       SER  21  53.756  -4.018  -2.268
  145   2HB   SER  21          1HB       SER  21  53.790  -2.506  -3.172
  146    HG   SER  21           HG       SER  21  55.982  -2.425  -1.841
  147    H    TRP  22           H        TRP  22  52.467  -0.183  -0.609
  148    HA   TRP  22           HA       TRP  22  54.651   1.561  -1.547
  149   1HB   TRP  22          2HB       TRP  22  51.667   1.970  -1.627
  150   2HB   TRP  22          1HB       TRP  22  52.838   3.203  -2.081
  151    HD1  TRP  22           HD1      TRP  22  52.612  -0.538  -3.083
  152    HE1  TRP  22           HE1      TRP  22  52.688  -0.669  -5.636
  153    HE3  TRP  22           HE3      TRP  22  52.777   4.444  -4.139
  154    HZ2  TRP  22           HZ2      TRP  22  52.809   1.097  -7.836
  155    HZ3  TRP  22           HZ3      TRP  22  52.874   5.148  -6.500
  156    HH2  TRP  22           HH2      TRP  22  52.887   3.505  -8.310
  157    H    THR  23           H        THR  23  52.334   1.115   0.985
  158    HA   THR  23           HA       THR  23  52.453   3.623   2.187
  159    HB   THR  23           HB       THR  23  51.541   2.537   4.195
  160    HG1  THR  23           HG1      THR  23  52.660   0.608   4.279
  161   1HG2  THR  23          1HG2      THR  23  50.064   2.995   2.255
  162   2HG2  THR  23          2HG2      THR  23  49.542   1.599   3.196
  163   3HG2  THR  23          3HG2      THR  23  50.380   1.361   1.664
  164    H    CYS  24           H        CYS  24  54.638   0.996   2.329
  165    HA   CYS  24           HA       CYS  24  56.169   2.193   4.460
  166   1HB   CYS  24          2HB       CYS  24  55.479  -0.344   4.241
  167   2HB   CYS  24          1HB       CYS  24  56.942  -0.417   3.259
  168    H    ASP  25           H        ASP  25  56.075   2.985   1.421
  169    HA   ASP  25           HA       ASP  25  58.641   2.170   0.372
  170   1HB   ASP  25          2HB       ASP  25  56.445   3.952  -0.597
  171   2HB   ASP  25          1HB       ASP  25  58.033   4.092  -1.335
  172    H    LEU  26           H        LEU  26  57.422   4.909   2.098
  173    HA   LEU  26           HA       LEU  26  58.306   6.862   2.806
  174   1HB   LEU  26          2HB       LEU  26  60.939   5.617   1.966
  175   2HB   LEU  26          1HB       LEU  26  60.815   7.202   2.703
  176    HG   LEU  26           HG       LEU  26  59.973   4.604   3.994
  177   1HD1  LEU  26          1HD1      LEU  26  62.345   6.398   4.491
  178   2HD1  LEU  26          2HD1      LEU  26  62.380   4.780   3.791
  179   3HD1  LEU  26          3HD1      LEU  26  61.892   5.002   5.471
  180   1HD2  LEU  26          1HD2      LEU  26  59.732   5.978   6.024
  181   2HD2  LEU  26          2HD2      LEU  26  58.597   6.447   4.758
  182   3HD2  LEU  26          3HD2      LEU  26  60.032   7.426   5.061
  183    H    ASP  27           H        ASP  27  57.417   6.237   0.057
  184    HA   ASP  27           HA       ASP  27  58.684   8.502  -1.345
  185   1HB   ASP  27          2HB       ASP  27  58.996   6.079  -2.297
  186   2HB   ASP  27          1HB       ASP  27  57.331   6.271  -2.837
  187    H    ASP  28           H        ASP  28  57.005   9.070  -3.304
  188    HA   ASP  28           HA       ASP  28  55.080  10.521  -1.764
  189   1HB   ASP  28          2HB       ASP  28  56.356  11.530  -3.610
  190   2HB   ASP  28          1HB       ASP  28  55.541  10.469  -4.751
  191    H    ASP  29           H        ASP  29  53.511   9.069  -1.007
  192    HA   ASP  29           HA       ASP  29  51.469   8.529  -3.045
  193   1HB   ASP  29          2HB       ASP  29  52.761   6.467  -2.034
  194   2HB   ASP  29          1HB       ASP  29  51.741   6.764  -0.629
  195    H    CYS  30           H        CYS  30  49.588   7.587  -1.027
  196    HA   CYS  30           HA       CYS  30  49.445   9.866   0.812
  197   1HB   CYS  30          2HB       CYS  30  46.876   9.548   0.666
  198   2HB   CYS  30          1HB       CYS  30  47.695  10.477  -0.578
  199    H    GLY  31           H        GLY  31  48.632   6.525   0.105
  200   1HA   GLY  31          2HA       GLY  31  47.927   4.784   1.418
  201   2HA   GLY  31          1HA       GLY  31  48.871   5.535   2.701
  202    H    ASP  32           H        ASP  32  47.868   7.245   3.887
  203    HA   ASP  32           HA       ASP  32  44.990   7.561   3.692
  204   1HB   ASP  32          2HB       ASP  32  45.150   5.674   5.282
  205   2HB   ASP  32          1HB       ASP  32  46.253   6.612   6.285
  206    H    ARG  33           H        ARG  33  46.437   9.402   2.876
  207    HA   ARG  33           HA       ARG  33  47.096  11.570   3.061
  208   1HB   ARG  33          2HB       ARG  33  45.589  12.576   4.403
  209   2HB   ARG  33          1HB       ARG  33  45.483  11.169   5.453
  210   1HG   ARG  33          2HG       ARG  33  47.889  12.134   6.176
  211   2HG   ARG  33          1HG       ARG  33  47.059  13.629   5.741
  212   1HD   ARG  33          2HD       ARG  33  46.832  12.981   8.149
  213   2HD   ARG  33          1HD       ARG  33  45.296  13.184   7.306
  214    HE   ARG  33           HE       ARG  33  45.254  10.710   7.105
  215   1HH1  ARG  33          1HH1      ARG  33  47.257  12.164   9.568
  216   2HH1  ARG  33          2HH1      ARG  33  47.189  10.789  10.616
  217   1HH2  ARG  33          1HH2      ARG  33  45.166   8.876   8.444
  218   2HH2  ARG  33          2HH2      ARG  33  45.996   8.911   9.975
  219    H    SER  34           H        SER  34  47.997   9.479   5.758
  220    HA   SER  34           HA       SER  34  50.790  10.190   5.311
  221   1HB   SER  34          2HB       SER  34  49.550  10.084   8.078
  222   2HB   SER  34          1HB       SER  34  51.235  10.436   7.692
  223    HG   SER  34           HG       SER  34  50.013  12.162   6.291
  224    H    ASP  35           H        ASP  35  50.603   8.137   4.203
  225    HA   ASP  35           HA       ASP  35  50.133   5.717   5.679
  226   1HB   ASP  35          2HB       ASP  35  51.053   4.601   3.647
  227   2HB   ASP  35          1HB       ASP  35  49.735   5.717   3.296
  228    H    GLU  36           H        GLU  36  52.684   7.858   5.422
  229    HA   GLU  36           HA       GLU  36  54.703   5.810   5.968
  230   1HB   GLU  36          2HB       GLU  36  54.982   8.713   5.172
  231   2HB   GLU  36          1HB       GLU  36  56.342   7.672   5.566
  232   1HG   GLU  36          2HG       GLU  36  54.387   7.203   3.325
  233   2HG   GLU  36          1HG       GLU  36  55.991   7.912   3.150
  234    H    SER  37           H        SER  37  53.391   5.770   8.018
  235    HA   SER  37           HA       SER  37  55.049   6.560  10.097
  236   1HB   SER  37          2HB       SER  37  53.389   8.125  11.277
  237   2HB   SER  37          1HB       SER  37  54.279   8.808   9.919
  238    HG   SER  37           HG       SER  37  52.490   9.005   8.823
  239    H    ALA  38           H        ALA  38  51.502   6.366   9.773
  240    HA   ALA  38           HA       ALA  38  51.532   4.378  11.934
  241   1HB   ALA  38          1HB       ALA  38  49.208   4.999  12.316
  242   2HB   ALA  38          2HB       ALA  38  49.266   6.089  10.930
  243   3HB   ALA  38          3HB       ALA  38  50.259   6.413  12.352
  244    H    SER  39           H        SER  39  51.731   4.050   8.795
  245    HA   SER  39           HA       SER  39  49.537   2.114   8.594
  246   1HB   SER  39          2HB       SER  39  51.155   3.338   6.358
  247   2HB   SER  39          1HB       SER  39  49.776   2.256   6.173
  248    HG   SER  39           HG       SER  39  48.510   3.858   7.254
  249    H    CYS  40           H        CYS  40  53.055   2.414   7.957
  250    HA   CYS  40           HA       CYS  40  53.155  -0.452   7.486
  251   1HB   CYS  40          2HB       CYS  40  54.549   0.941   6.064
  252   2HB   CYS  40          1HB       CYS  40  55.377   1.602   7.471
  253    H    ALA  41           H        ALA  41  53.882   1.811  10.031
  254    HA   ALA  41           HA       ALA  41  54.507   1.584  12.194
  255   1HB   ALA  41          1HB       ALA  41  54.174  -1.384  11.790
  256   2HB   ALA  41          2HB       ALA  41  52.903  -0.272  12.295
  257   3HB   ALA  41          3HB       ALA  41  54.297  -0.548  13.338
  258    H    TYR  42           H        TYR  42  56.069  -0.360   9.845
  259    HA   TYR  42           HA       TYR  42  58.216  -0.747   9.311
  260   1HB   TYR  42          2HB       TYR  42  58.935   1.442  11.248
  261   2HB   TYR  42          1HB       TYR  42  59.879   0.874   9.878
  262    HD1  TYR  42           HD1      TYR  42  58.795   1.186   7.525
  263    HD2  TYR  42           HD2      TYR  42  57.530   3.254  11.018
  264    HE1  TYR  42           HE1      TYR  42  57.741   2.921   6.102
  265    HE2  TYR  42           HE2      TYR  42  56.490   4.985   9.628
  266    HH   TYR  42           HH       TYR  42  56.508   4.790   6.086
  267    HA   PRO  43           HA       PRO  43  59.191  -3.173  13.185
  268   1HB   PRO  43          2HB       PRO  43  58.681  -5.479  11.455
  269   2HB   PRO  43          1HB       PRO  43  58.035  -5.138  13.061
  270   1HG   PRO  43          2HG       PRO  43  56.501  -5.062  10.841
  271   2HG   PRO  43          1HG       PRO  43  56.211  -4.001  12.232
  272   1HD   PRO  43          2HD       PRO  43  57.557  -3.397   9.627
  273   2HD   PRO  43          1HD       PRO  43  56.426  -2.399  10.568
  274    H    THR  44           H        THR  44  59.715  -3.395   9.776
  275    HA   THR  44           HA       THR  44  62.580  -3.328  10.133
  276    HB   THR  44           HB       THR  44  61.428  -5.510   8.393
  277    HG1  THR  44           HG1      THR  44  61.898  -5.504  11.158
  278   1HG2  THR  44          1HG2      THR  44  63.705  -4.647   8.002
  279   2HG2  THR  44          2HG2      THR  44  63.666  -6.358   8.431
  280   3HG2  THR  44          3HG2      THR  44  64.140  -5.152   9.632
  281    H    CYS  45           H        CYS  45  60.200  -1.890   9.049
  282    HA   CYS  45           HA       CYS  45  59.276  -0.870   7.252
  283   1HB   CYS  45          2HB       CYS  45  62.107  -1.057   6.207
  284   2HB   CYS  45          1HB       CYS  45  60.827  -0.107   5.453
  285    H    PHE  46           H        PHE  46  59.637  -3.894   7.360
  286    HA   PHE  46           HA       PHE  46  58.717  -4.351   4.639
  287   1HB   PHE  46          2HB       PHE  46  61.006  -4.946   4.425
  288   2HB   PHE  46          1HB       PHE  46  61.002  -5.816   5.955
  289    HD1  PHE  46           HD1      PHE  46  58.375  -6.083   3.408
  290    HD2  PHE  46           HD2      PHE  46  61.806  -7.892   5.133
  291    HE1  PHE  46           HE1      PHE  46  57.833  -8.157   2.246
  292    HE2  PHE  46           HE2      PHE  46  61.298  -9.993   3.952
  293    HZ   PHE  46           HZ       PHE  46  59.303 -10.136   2.503
  294    HA   PRO  47           HA       PRO  47  56.059  -7.078   6.998
  295   1HB   PRO  47          2HB       PRO  47  53.804  -5.614   7.020
  296   2HB   PRO  47          1HB       PRO  47  55.074  -5.374   8.224
  297   1HG   PRO  47          2HG       PRO  47  54.260  -3.632   6.012
  298   2HG   PRO  47          1HG       PRO  47  55.224  -3.248   7.445
  299   1HD   PRO  47          2HD       PRO  47  56.128  -3.892   4.745
  300   2HD   PRO  47          1HD       PRO  47  57.065  -3.260   6.114
  301    H    LEU  48           H        LEU  48  56.406  -5.892   3.944
  302    HA   LEU  48           HA       LEU  48  54.061  -7.311   2.867
  303   1HB   LEU  48          2HB       LEU  48  55.002  -4.837   1.484
  304   2HB   LEU  48          1HB       LEU  48  53.392  -5.524   1.572
  305    HG   LEU  48           HG       LEU  48  54.696  -4.269   3.957
  306   1HD1  LEU  48          1HD1      LEU  48  53.042  -2.890   1.834
  307   2HD1  LEU  48          2HD1      LEU  48  54.730  -2.566   2.232
  308   3HD1  LEU  48          3HD1      LEU  48  53.460  -2.192   3.399
  309   1HD2  LEU  48          1HD2      LEU  48  52.740  -5.644   4.382
  310   2HD2  LEU  48          2HD2      LEU  48  51.816  -4.742   3.179
  311   3HD2  LEU  48          3HD2      LEU  48  52.361  -3.944   4.655
  312    H    THR  49           H        THR  49  56.654  -5.391   1.415
  313    HA   THR  49           HA       THR  49  58.282  -7.501   0.567
  314    HB   THR  49           HB       THR  49  56.423  -8.123  -0.871
  315    HG1  THR  49           HG1      THR  49  57.591  -8.281  -2.721
  316   1HG2  THR  49          1HG2      THR  49  55.590  -6.665  -2.650
  317   2HG2  THR  49          2HG2      THR  49  56.619  -5.357  -2.068
  318   3HG2  THR  49          3HG2      THR  49  55.301  -5.956  -1.060
  319    H    GLN  50           H        GLN  50  59.857  -6.129   1.304
  320    HA   GLN  50           HA       GLN  50  60.294  -3.601  -0.122
  321   1HB   GLN  50          2HB       GLN  50  60.346  -3.753   2.890
  322   2HB   GLN  50          1HB       GLN  50  60.385  -2.316   1.883
  323   1HG   GLN  50          2HG       GLN  50  57.988  -4.070   1.769
  324   2HG   GLN  50          1HG       GLN  50  58.223  -3.053   3.186
  325   1HE2  GLN  50          1HE2      GLN  50  59.545  -0.956   1.647
  326   2HE2  GLN  50          2HE2      GLN  50  58.292  -0.152   0.773
  327    H    PHE  51           H        PHE  51  62.366  -2.550   0.813
  328    HA   PHE  51           HA       PHE  51  64.243  -4.482   1.980
  329   1HB   PHE  51          2HB       PHE  51  64.723  -4.292  -0.469
  330   2HB   PHE  51          1HB       PHE  51  64.980  -2.566  -0.253
  331    HD1  PHE  51           HD1      PHE  51  66.195  -5.857   0.996
  332    HD2  PHE  51           HD2      PHE  51  67.149  -1.793   0.149
  333    HE1  PHE  51           HE1      PHE  51  68.558  -6.302   1.498
  334    HE2  PHE  51           HE2      PHE  51  69.498  -2.223   0.667
  335    HZ   PHE  51           HZ       PHE  51  70.215  -4.483   1.341
  336    H    THR  52           H        THR  52  66.019  -3.370   3.156
  337    HA   THR  52           HA       THR  52  65.113  -0.745   4.119
  338    HB   THR  52           HB       THR  52  66.862  -2.650   5.669
  339    HG1  THR  52           HG1      THR  52  64.224  -2.620   6.408
  340   1HG2  THR  52          1HG2      THR  52  64.975  -0.434   6.485
  341   2HG2  THR  52          2HG2      THR  52  66.736  -0.343   6.465
  342   3HG2  THR  52          3HG2      THR  52  65.923  -1.434   7.589
  343    H    CYS  53           H        CYS  53  66.350   0.780   3.125
  344    HA   CYS  53           HA       CYS  53  68.970   0.586   2.233
  345   1HB   CYS  53          2HB       CYS  53  67.839   3.037   3.552
  346   2HB   CYS  53          1HB       CYS  53  69.054   2.953   2.279
  347    H    ASN  54           H        ASN  54  70.967   0.616   3.180
  348    HA   ASN  54           HA       ASN  54  71.049   0.023   5.976
  349   1HB   ASN  54          2HB       ASN  54  73.333  -0.504   5.719
  350   2HB   ASN  54          1HB       ASN  54  72.551  -1.036   4.236
  351   1HD2  ASN  54          1HD2      ASN  54  73.018  -0.006   2.331
  352   2HD2  ASN  54          2HD2      ASN  54  74.318   1.113   2.168
  353    H    ASN  55           H        ASN  55  71.325   2.902   4.159
  354    HA   ASN  55           HA       ASN  55  72.887   4.296   6.111
  355   1HB   ASN  55          2HB       ASN  55  72.896   4.822   3.644
  356   2HB   ASN  55          1HB       ASN  55  71.291   5.512   3.856
  357   1HD2  ASN  55          1HD2      ASN  55  71.924   7.545   3.267
  358   2HD2  ASN  55          2HD2      ASN  55  72.921   8.543   4.262
  359    H    GLY  56           H        GLY  56  69.924   3.122   6.365
  360   1HA   GLY  56          2HA       GLY  56  68.806   3.638   8.455
  361   2HA   GLY  56          1HA       GLY  56  69.131   5.333   8.147
  362    H    ARG  57           H        ARG  57  68.289   4.339   5.206
  363    HA   ARG  57           HA       ARG  57  65.536   5.224   5.577
  364   1HB   ARG  57          2HB       ARG  57  66.959   4.539   3.008
  365   2HB   ARG  57          1HB       ARG  57  65.456   5.432   3.176
  366   1HG   ARG  57          2HG       ARG  57  66.511   7.343   3.871
  367   2HG   ARG  57          1HG       ARG  57  67.947   6.474   4.435
  368   1HD   ARG  57          2HD       ARG  57  68.556   7.609   2.426
  369   2HD   ARG  57          1HD       ARG  57  68.419   5.887   2.049
  370    HE   ARG  57           HE       ARG  57  65.969   7.220   1.546
  371   1HH1  ARG  57          1HH1      ARG  57  69.175   6.781   0.247
  372   2HH1  ARG  57          2HH1      ARG  57  68.689   7.036  -1.398
  373   1HH2  ARG  57          1HH2      ARG  57  65.313   7.573  -0.629
  374   2HH2  ARG  57          2HH2      ARG  57  66.495   7.474  -1.894
  375    H    CYS  58           H        CYS  58  64.032   4.083   3.847
  376    HA   CYS  58           HA       CYS  58  64.459   1.198   3.773
  377   1HB   CYS  58          2HB       CYS  58  61.835   2.487   4.574
  378   2HB   CYS  58          1HB       CYS  58  62.196   0.763   4.527
  379    H    ILE  59           H        ILE  59  63.560   0.242   1.878
  380    HA   ILE  59           HA       ILE  59  62.372   2.165   0.016
  381    HB   ILE  59           HB       ILE  59  63.561   0.926  -1.842
  382   1HG1  ILE  59          2HG1      ILE  59  65.611   0.233   0.234
  383   2HG1  ILE  59          1HG1      ILE  59  64.298  -0.884  -0.128
  384   1HG2  ILE  59          1HG2      ILE  59  65.581   2.296  -1.639
  385   2HG2  ILE  59          2HG2      ILE  59  65.160   2.639   0.041
  386   3HG2  ILE  59          3HG2      ILE  59  64.110   3.193  -1.264
  387   1HD1  ILE  59          1HD1      ILE  59  66.303  -1.435  -1.381
  388   2HD1  ILE  59          2HD1      ILE  59  66.310   0.176  -2.102
  389   3HD1  ILE  59          3HD1      ILE  59  64.998  -0.946  -2.459
  390    H    ASN  60           H        ASN  60  61.799   0.854  -2.084
  391    HA   ASN  60           HA       ASN  60  59.933  -1.233  -1.336
  392   1HB   ASN  60          2HB       ASN  60  59.455   0.633  -3.014
  393   2HB   ASN  60          1HB       ASN  60  60.555  -0.194  -4.110
  394   1HD2  ASN  60          1HD2      ASN  60  57.457  -0.186  -2.622
  395   2HD2  ASN  60          2HD2      ASN  60  56.790  -1.519  -3.520
  396    H    ILE  61           H        ILE  61  59.947  -3.315  -2.570
  397    HA   ILE  61           HA       ILE  61  62.624  -4.383  -2.479
  398    HB   ILE  61           HB       ILE  61  60.259  -5.416  -1.774
  399   1HG1  ILE  61          2HG1      ILE  61  62.549  -6.330  -1.305
  400   2HG1  ILE  61          1HG1      ILE  61  61.308  -7.553  -1.530
  401   1HG2  ILE  61          1HG2      ILE  61  60.716  -6.578  -4.512
  402   2HG2  ILE  61          2HG2      ILE  61  59.388  -5.514  -4.043
  403   3HG2  ILE  61          3HG2      ILE  61  59.521  -7.124  -3.331
  404   1HD1  ILE  61          1HD1      ILE  61  62.126  -7.914  -3.825
  405   2HD1  ILE  61          2HD1      ILE  61  63.360  -8.227  -2.605
  406   3HD1  ILE  61          3HD1      ILE  61  63.397  -6.727  -3.533
  407    H    ASN  62           H        ASN  62  60.714  -3.010  -4.895
  408    HA   ASN  62           HA       ASN  62  61.593  -4.745  -7.041
  409   1HB   ASN  62          2HB       ASN  62  59.837  -2.302  -6.962
  410   2HB   ASN  62          1HB       ASN  62  60.331  -3.051  -8.476
  411   1HD2  ASN  62          1HD2      ASN  62  58.380  -3.348  -5.622
  412   2HD2  ASN  62          2HD2      ASN  62  57.466  -4.720  -6.153
  413    H    TRP  63           H        TRP  63  63.469  -2.929  -5.455
  414    HA   TRP  63           HA       TRP  63  64.649  -1.534  -7.757
  415   1HB   TRP  63          2HB       TRP  63  65.079  -1.150  -4.785
  416   2HB   TRP  63          1HB       TRP  63  66.050  -0.354  -6.015
  417    HD1  TRP  63           HD1      TRP  63  62.392  -0.547  -6.903
  418    HE1  TRP  63           HE1      TRP  63  61.310   1.768  -6.599
  419    HE3  TRP  63           HE3      TRP  63  66.185   1.816  -4.423
  420    HZ2  TRP  63           HZ2      TRP  63  61.974   4.254  -5.474
  421    HZ3  TRP  63           HZ3      TRP  63  65.880   4.166  -3.772
  422    HH2  TRP  63           HH2      TRP  63  63.814   5.358  -4.287
  423    H    ARG  64           H        ARG  64  64.702  -4.386  -6.343
  424    HA   ARG  64           HA       ARG  64  67.456  -5.016  -6.046
  425   1HB   ARG  64          2HB       ARG  64  65.592  -6.367  -5.082
  426   2HB   ARG  64          1HB       ARG  64  65.120  -6.838  -6.706
  427   1HG   ARG  64          2HG       ARG  64  66.326  -8.663  -6.000
  428   2HG   ARG  64          1HG       ARG  64  67.548  -7.739  -6.877
  429   1HD   ARG  64          2HD       ARG  64  68.217  -6.725  -4.671
  430   2HD   ARG  64          1HD       ARG  64  67.141  -7.889  -3.893
  431    HE   ARG  64           HE       ARG  64  69.260  -8.884  -5.659
  432   1HH1  ARG  64          1HH1      ARG  64  67.910  -8.596  -2.447
  433   2HH1  ARG  64          2HH1      ARG  64  69.118  -9.592  -1.713
  434   1HH2  ARG  64          1HH2      ARG  64  70.835 -10.222  -4.705
  435   2HH2  ARG  64          2HH2      ARG  64  70.776 -10.532  -2.999
  436    H    CYS  65           H        CYS  65  68.581  -4.293  -7.831
  437    HA   CYS  65           HA       CYS  65  67.590  -4.888 -10.481
  438   1HB   CYS  65          2HB       CYS  65  69.983  -3.339  -9.516
  439   2HB   CYS  65          1HB       CYS  65  69.610  -3.588 -11.216
  440    H    ASP  66           H        ASP  66  70.921  -4.935  -9.545
  441    HA   ASP  66           HA       ASP  66  71.232  -7.406 -11.093
  442   1HB   ASP  66          2HB       ASP  66  73.602  -6.556 -11.400
  443   2HB   ASP  66          1HB       ASP  66  72.337  -5.614 -12.176
  444    H    ASN  67           H        ASN  67  72.783  -5.725  -8.337
  445    HA   ASN  67           HA       ASN  67  73.805  -8.269  -7.424
  446   1HB   ASN  67          2HB       ASN  67  74.135  -5.540  -6.172
  447   2HB   ASN  67          1HB       ASN  67  74.985  -7.003  -5.696
  448   1HD2  ASN  67          1HD2      ASN  67  74.760  -4.438  -7.969
  449   2HD2  ASN  67          2HD2      ASN  67  76.199  -4.799  -8.850
  450    H    ASP  68           H        ASP  68  72.324  -5.580  -5.680
  451    HA   ASP  68           HA       ASP  68  70.438  -7.456  -4.440
  452   1HB   ASP  68          2HB       ASP  68  72.576  -6.854  -3.022
  453   2HB   ASP  68          1HB       ASP  68  71.740  -5.329  -2.759
  454    H    ASN  69           H        ASN  69  69.774  -5.050  -2.637
  455    HA   ASN  69           HA       ASN  69  67.892  -3.960  -4.617
  456   1HB   ASN  69          2HB       ASN  69  67.333  -5.324  -2.379
  457   2HB   ASN  69          1HB       ASN  69  67.397  -3.702  -1.699
  458   1HD2  ASN  69          1HD2      ASN  69  65.180  -5.597  -2.083
  459   2HD2  ASN  69          2HD2      ASN  69  63.985  -4.729  -2.977
  460    H    ASP  70           H        ASP  70  67.836  -1.888  -5.038
  461    HA   ASP  70           HA       ASP  70  70.110  -0.324  -4.480
  462   1HB   ASP  70          2HB       ASP  70  68.324  -0.434  -6.466
  463   2HB   ASP  70          1HB       ASP  70  67.663   0.942  -5.590
  464    H    CYS  71           H        CYS  71  69.037   2.271  -4.415
  465    HA   CYS  71           HA       CYS  71  67.059   3.054  -2.772
  466   1HB   CYS  71          2HB       CYS  71  68.096   1.720  -0.926
  467   2HB   CYS  71          1HB       CYS  71  69.515   2.758  -1.020
  468    H    GLY  72           H        GLY  72  70.324   3.483  -3.833
  469   1HA   GLY  72          2HA       GLY  72  71.114   5.422  -4.901
  470   2HA   GLY  72          1HA       GLY  72  69.823   6.341  -4.144
  471    H    ASP  73           H        ASP  73  70.884   4.685  -1.635
  472    HA   ASP  73           HA       ASP  73  72.884   6.719  -0.900
  473   1HB   ASP  73          2HB       ASP  73  72.269   6.220   1.430
  474   2HB   ASP  73          1HB       ASP  73  70.868   6.729   0.496
  475    H    ASN  74           H        ASN  74  73.237   4.166  -2.367
  476    HA   ASN  74           HA       ASN  74  74.752   2.499  -2.555
  477   1HB   ASN  74          2HB       ASN  74  76.230   4.364  -1.491
  478   2HB   ASN  74          1HB       ASN  74  76.108   3.404  -0.026
  479   1HD2  ASN  74          1HD2      ASN  74  76.153   0.833  -1.351
  480   2HD2  ASN  74          2HD2      ASN  74  77.761   0.608  -1.943
  481    H    SER  75           H        SER  75  72.294   2.046  -1.199
  482    HA   SER  75           HA       SER  75  72.698   0.306   0.975
  483   1HB   SER  75          2HB       SER  75  70.461   0.575  -0.999
  484   2HB   SER  75          1HB       SER  75  70.441  -0.648   0.274
  485    HG   SER  75           HG       SER  75  70.643   2.177   0.618
  486    H    ASP  76           H        ASP  76  71.510  -0.856  -2.117
  487    HA   ASP  76           HA       ASP  76  72.994  -3.235  -2.040
  488   1HB   ASP  76          2HB       ASP  76  71.097  -3.021  -3.545
  489   2HB   ASP  76          1HB       ASP  76  71.910  -1.729  -4.431
  490    H    GLU  77           H        GLU  77  73.369  -0.417  -4.086
  491    HA   GLU  77           HA       GLU  77  76.160  -0.093  -3.673
  492   1HB   GLU  77          2HB       GLU  77  76.535  -0.362  -6.285
  493   2HB   GLU  77          1HB       GLU  77  76.744  -1.704  -5.176
  494   1HG   GLU  77          2HG       GLU  77  75.528  -2.362  -7.178
  495   2HG   GLU  77          1HG       GLU  77  74.548  -2.553  -5.729
  496    H    ALA  78           H        ALA  78  73.272   0.671  -5.426
  497    HA   ALA  78           HA       ALA  78  72.271   2.684  -5.810
  498   1HB   ALA  78          1HB       ALA  78  73.243   4.779  -5.080
  499   2HB   ALA  78          2HB       ALA  78  74.779   3.978  -4.753
  500   3HB   ALA  78          3HB       ALA  78  73.353   3.573  -3.799
  501    H    GLY  79           H        GLY  79  73.749   1.214  -7.755
  502   1HA   GLY  79          2HA       GLY  79  74.596   3.444  -9.510
  503   2HA   GLY  79          1HA       GLY  79  75.291   1.832  -9.583
  504    H    CYS  80           H        CYS  80  72.013   1.568  -8.967
  505    HA   CYS  80           HA       CYS  80  71.496   1.111 -11.824
  506   1HB   CYS  80          2HB       CYS  80  71.324  -0.931 -10.535
  507   2HB   CYS  80          1HB       CYS  80  70.221  -0.163  -9.397
  508    H    SER  81           H        SER  81  69.469   1.799  -8.944
  509    HA   SER  81           HA       SER  81  67.731   3.308 -10.772
  510   1HB   SER  81          2HB       SER  81  67.071   2.027  -8.115
  511   2HB   SER  81          1HB       SER  81  65.926   2.850  -9.175
  512    HG   SER  81           HG       SER  81  67.423   0.511  -9.789
  513    H    HIS  82           HN       HIS  82  69.402   5.085 -10.389
  514    HA   HIS  82           HA       HIS  82  68.096   7.096  -8.910
  515   1HB   HIS  82          2HB       HIS  82  70.018   5.627  -7.390
  516   2HB   HIS  82          1HB       HIS  82  70.675   7.232  -7.695
  517    HD1  HIS  82           HD1      HIS  82  67.419   5.728  -6.390
  518    HD2  HIS  82           HD2      HIS  82  69.815   9.095  -5.955
  519    HE1  HIS  82           HE1      HIS  82  66.380   7.105  -4.536
  Start of MODEL    7
    1   1H    SER   1          1HT       SER   1  35.667  -5.335   5.470
    2   2H    SER   1          2HT       SER   1  37.149  -5.226   4.662
    3   3H    SER   1          3HT       SER   1  36.779  -6.605   5.571
    4    HA   SER   1           HA       SER   1  36.555  -6.988   3.185
    5   1HB   SER   1          2HB       SER   1  33.895  -7.026   4.636
    6   2HB   SER   1          1HB       SER   1  34.417  -8.104   3.340
    7    HG   SER   1           HG       SER   1  34.684  -9.139   5.322
    8    H    ALA   2           H        ALA   2  35.669  -6.410   1.221
    9    HA   ALA   2           HA       ALA   2  34.771  -5.098  -0.391
   10   1HB   ALA   2          1HB       ALA   2  32.652  -5.249   0.828
   11   2HB   ALA   2          2HB       ALA   2  32.859  -3.668   0.077
   12   3HB   ALA   2          3HB       ALA   2  33.117  -3.858   1.809
   13    H    ARG   3           H        ARG   3  35.215  -3.147  -1.378
   14    HA   ARG   3           HA       ARG   3  36.377  -1.247  -1.823
   15   1HB   ARG   3          2HB       ARG   3  34.876  -0.338  -0.016
   16   2HB   ARG   3          1HB       ARG   3  36.165  -0.654   1.135
   17   1HG   ARG   3          2HG       ARG   3  37.622   0.857  -0.281
   18   2HG   ARG   3          1HG       ARG   3  36.151   1.314  -1.139
   19   1HD   ARG   3          2HD       ARG   3  36.632   1.615   1.825
   20   2HD   ARG   3          1HD       ARG   3  36.713   2.911   0.635
   21    HE   ARG   3           HE       ARG   3  34.195   1.600   0.554
   22   1HH1  ARG   3          1HH1      ARG   3  36.066   3.906   2.392
   23   2HH1  ARG   3          2HH1      ARG   3  34.685   4.734   3.027
   24   1HH2  ARG   3          1HH2      ARG   3  32.349   2.678   1.389
   25   2HH2  ARG   3          2HH2      ARG   3  32.555   4.030   2.450
   26    H    THR   4           H        THR   4  37.654  -3.786  -0.645
   27    HA   THR   4           HA       THR   4  40.076  -2.710   0.554
   28    HB   THR   4           HB       THR   4  40.622  -5.211   0.776
   29    HG1  THR   4           HG1      THR   4  39.187  -6.213  -0.529
   30   1HG2  THR   4          1HG2      THR   4  39.905  -3.820   2.651
   31   2HG2  THR   4          2HG2      THR   4  39.193  -5.431   2.754
   32   3HG2  THR   4          3HG2      THR   4  38.218  -4.069   2.202
   33    H    CYS   5           H        CYS   5  39.263  -2.708  -2.439
   34    HA   CYS   5           HA       CYS   5  40.340  -2.701  -4.425
   35   1HB   CYS   5          2HB       CYS   5  42.647  -2.814  -2.518
   36   2HB   CYS   5          1HB       CYS   5  42.935  -2.943  -4.250
   37    HA   PRO   6           HA       PRO   6  40.873  -6.896  -5.827
   38   1HB   PRO   6          2HB       PRO   6  43.014  -6.229  -7.694
   39   2HB   PRO   6          1HB       PRO   6  41.336  -6.651  -8.037
   40   1HG   PRO   6          2HG       PRO   6  42.329  -4.163  -8.435
   41   2HG   PRO   6          1HG       PRO   6  40.637  -4.468  -8.000
   42   1HD   PRO   6          2HD       PRO   6  42.915  -3.586  -6.265
   43   2HD   PRO   6          1HD       PRO   6  41.227  -3.026  -6.284
   44    HA   PRO   7           HA       PRO   7  44.373  -9.083  -4.090
   45   1HB   PRO   7          2HB       PRO   7  44.823 -10.324  -6.762
   46   2HB   PRO   7          1HB       PRO   7  44.625 -11.094  -5.183
   47   1HG   PRO   7          2HG       PRO   7  42.650 -11.129  -6.971
   48   2HG   PRO   7          1HG       PRO   7  42.313 -10.922  -5.244
   49   1HD   PRO   7          2HD       PRO   7  42.307  -8.900  -7.434
   50   2HD   PRO   7          1HD       PRO   7  41.251  -9.027  -6.012
   51    H    ASN   8           H        ASN   8  46.532  -8.765  -3.867
   52    HA   ASN   8           HA       ASN   8  48.634  -7.945  -4.161
   53   1HB   ASN   8          2HB       ASN   8  48.313  -9.202  -6.431
   54   2HB   ASN   8          1HB       ASN   8  48.160  -7.581  -7.102
   55   1HD2  ASN   8          1HD2      ASN   8  49.969  -6.230  -7.135
   56   2HD2  ASN   8          2HD2      ASN   8  51.567  -6.831  -6.871
   57    H    GLN   9           H        GLN   9  46.110  -6.276  -4.000
   58    HA   GLN   9           HA       GLN   9  47.320  -3.705  -4.695
   59   1HB   GLN   9          2HB       GLN   9  44.973  -4.831  -5.880
   60   2HB   GLN   9          1HB       GLN   9  44.483  -3.482  -4.874
   61   1HG   GLN   9          2HG       GLN   9  44.840  -2.672  -7.076
   62   2HG   GLN   9          1HG       GLN   9  46.139  -2.068  -6.048
   63   1HE2  GLN   9          1HE2      GLN   9  46.047  -5.374  -7.179
   64   2HE2  GLN   9          2HE2      GLN   9  47.377  -5.244  -8.262
   65    H    PHE  10           H        PHE  10  46.926  -2.109  -3.251
   66    HA   PHE  10           HA       PHE  10  45.677  -2.950  -0.738
   67   1HB   PHE  10          2HB       PHE  10  48.000  -2.552  -0.386
   68   2HB   PHE  10          1HB       PHE  10  47.963  -1.060  -1.318
   69    HD1  PHE  10           HD1      PHE  10  45.846  -2.336   1.471
   70    HD2  PHE  10           HD2      PHE  10  48.497   0.713   0.095
   71    HE1  PHE  10           HE1      PHE  10  45.443  -1.056   3.529
   72    HE2  PHE  10           HE2      PHE  10  48.076   1.996   2.147
   73    HZ   PHE  10           HZ       PHE  10  46.551   1.114   3.864
   74    H    SER  11           H        SER  11  44.167  -1.715   0.146
   75    HA   SER  11           HA       SER  11  43.105   0.462  -1.429
   76   1HB   SER  11          2HB       SER  11  41.015   0.025  -0.120
   77   2HB   SER  11          1HB       SER  11  41.540  -1.351  -1.093
   78    HG   SER  11           HG       SER  11  42.135  -0.997   1.664
   79    H    CYS  12           H        CYS  12  43.865   2.239  -0.788
   80    HA   CYS  12           HA       CYS  12  44.922   2.743   1.788
   81   1HB   CYS  12          2HB       CYS  12  45.256   3.762  -0.706
   82   2HB   CYS  12          1HB       CYS  12  44.279   5.016   0.041
   83    H    ALA  13           H        ALA  13  44.150   5.310   2.363
   84    HA   ALA  13           HA       ALA  13  41.805   5.067   3.813
   85   1HB   ALA  13          1HB       ALA  13  43.091   7.584   2.781
   86   2HB   ALA  13          2HB       ALA  13  43.478   6.756   4.286
   87   3HB   ALA  13          3HB       ALA  13  41.894   7.501   4.072
   88    H    SER  14           H        SER  14  40.233   4.159   2.441
   89    HA   SER  14           HA       SER  14  38.126   4.378   1.681
   90   1HB   SER  14          2HB       SER  14  38.732   7.330   1.561
   91   2HB   SER  14          1HB       SER  14  37.138   6.614   1.300
   92    HG   SER  14           HG       SER  14  38.517   7.041   3.637
   93    H    GLY  15           H        GLY  15  40.203   6.584  -0.287
   94   1HA   GLY  15          2HA       GLY  15  38.612   5.622  -2.585
   95   2HA   GLY  15          1HA       GLY  15  39.252   7.246  -2.448
   96    H    ARG  16           H        ARG  16  41.768   5.409  -1.416
   97    HA   ARG  16           HA       ARG  16  42.926   5.559  -4.099
   98   1HB   ARG  16          2HB       ARG  16  44.240   5.181  -1.412
   99   2HB   ARG  16          1HB       ARG  16  45.107   5.155  -2.935
  100   1HG   ARG  16          2HG       ARG  16  44.519   7.479  -3.333
  101   2HG   ARG  16          1HG       ARG  16  43.572   7.506  -1.840
  102   1HD   ARG  16          2HD       ARG  16  45.544   7.086  -0.524
  103   2HD   ARG  16          1HD       ARG  16  46.516   6.874  -1.977
  104    HE   ARG  16           HE       ARG  16  45.274   9.474  -1.681
  105   1HH1  ARG  16          1HH1      ARG  16  48.104   7.498  -1.159
  106   2HH1  ARG  16          2HH1      ARG  16  49.188   8.842  -0.974
  107   1HH2  ARG  16          1HH2      ARG  16  46.719  11.274  -1.405
  108   2HH2  ARG  16          2HH2      ARG  16  48.404  10.973  -1.066
  109    H    CYS  17           H        CYS  17  44.046   3.799  -5.034
  110    HA   CYS  17           HA       CYS  17  43.654   1.154  -3.871
  111   1HB   CYS  17          2HB       CYS  17  41.720   1.903  -5.505
  112   2HB   CYS  17          1HB       CYS  17  42.911   1.547  -6.752
  113    H    ILE  18           H        ILE  18  45.824   0.781  -3.707
  114    HA   ILE  18           HA       ILE  18  47.493   1.531  -6.032
  115    HB   ILE  18           HB       ILE  18  49.150   2.362  -4.609
  116   1HG1  ILE  18          2HG1      ILE  18  47.784   0.876  -2.355
  117   2HG1  ILE  18          1HG1      ILE  18  49.325   0.453  -3.100
  118   1HG2  ILE  18          1HG2      ILE  18  47.130   3.768  -4.573
  119   2HG2  ILE  18          2HG2      ILE  18  48.039   3.890  -3.067
  120   3HG2  ILE  18          3HG2      ILE  18  46.570   2.908  -3.135
  121   1HD1  ILE  18          1HD1      ILE  18  50.268   2.569  -2.272
  122   2HD1  ILE  18          2HD1      ILE  18  49.706   1.510  -0.978
  123   3HD1  ILE  18          3HD1      ILE  18  48.734   2.898  -1.463
  124    HA   PRO  19           HA       PRO  19  48.952  -2.711  -6.047
  125   1HB   PRO  19          2HB       PRO  19  51.616  -1.647  -6.732
  126   2HB   PRO  19          1HB       PRO  19  50.578  -2.760  -7.639
  127   1HG   PRO  19          2HG       PRO  19  50.964  -0.214  -8.426
  128   2HG   PRO  19          1HG       PRO  19  49.423  -1.054  -8.670
  129   1HD   PRO  19          2HD       PRO  19  50.166   0.995  -6.627
  130   2HD   PRO  19          1HD       PRO  19  48.632   0.768  -7.492
  131    H    ILE  20           H        ILE  20  49.783  -3.989  -4.419
  132    HA   ILE  20           HA       ILE  20  51.057  -2.621  -2.217
  133    HB   ILE  20           HB       ILE  20  50.820  -5.584  -2.340
  134   1HG1  ILE  20          2HG1      ILE  20  48.639  -3.608  -1.661
  135   2HG1  ILE  20          1HG1      ILE  20  48.605  -4.821  -2.932
  136   1HG2  ILE  20          1HG2      ILE  20  50.753  -3.536  -0.141
  137   2HG2  ILE  20          2HG2      ILE  20  52.091  -4.613  -0.542
  138   3HG2  ILE  20          3HG2      ILE  20  50.585  -5.277   0.094
  139   1HD1  ILE  20          1HD1      ILE  20  48.602  -6.589  -1.277
  140   2HD1  ILE  20          2HD1      ILE  20  47.258  -5.475  -1.013
  141   3HD1  ILE  20          3HD1      ILE  20  48.690  -5.389   0.013
  142    H    SER  21           H        SER  21  53.018  -2.001  -3.113
  143    HA   SER  21           HA       SER  21  55.027  -4.024  -2.628
  144   1HB   SER  21          2HB       SER  21  54.720  -4.156  -5.078
  145   2HB   SER  21          1HB       SER  21  54.976  -2.418  -5.205
  146    HG   SER  21           HG       SER  21  57.063  -3.130  -3.979
  147    H    TRP  22           H        TRP  22  53.722  -1.259  -1.877
  148    HA   TRP  22           HA       TRP  22  56.165   0.023  -1.068
  149   1HB   TRP  22          2HB       TRP  22  55.648   2.156  -2.387
  150   2HB   TRP  22          1HB       TRP  22  56.402   0.815  -3.234
  151    HD1  TRP  22           HD1      TRP  22  54.825  -0.567  -4.969
  152    HE1  TRP  22           HE1      TRP  22  52.790   0.204  -6.341
  153    HE3  TRP  22           HE3      TRP  22  53.590   3.640  -2.326
  154    HZ2  TRP  22           HZ2      TRP  22  50.919   2.310  -6.310
  155    HZ3  TRP  22           HZ3      TRP  22  51.668   4.977  -3.071
  156    HH2  TRP  22           HH2      TRP  22  50.361   4.321  -5.020
  157    H    THR  23           H        THR  23  53.586  -0.701   0.247
  158    HA   THR  23           HA       THR  23  52.479   1.715   1.177
  159    HB   THR  23           HB       THR  23  51.908   0.368   3.255
  160    HG1  THR  23           HG1      THR  23  53.769  -1.245   2.099
  161   1HG2  THR  23          1HG2      THR  23  51.201  -0.866   0.579
  162   2HG2  THR  23          2HG2      THR  23  50.397   0.523   1.315
  163   3HG2  THR  23          3HG2      THR  23  50.307  -1.061   2.088
  164    H    CYS  24           H        CYS  24  54.109  -0.196   3.512
  165    HA   CYS  24           HA       CYS  24  55.300   1.712   5.042
  166   1HB   CYS  24          2HB       CYS  24  54.936  -0.630   5.638
  167   2HB   CYS  24          1HB       CYS  24  56.174  -1.130   4.501
  168    H    ASP  25           H        ASP  25  56.249   3.216   3.480
  169    HA   ASP  25           HA       ASP  25  58.938   2.458   2.579
  170   1HB   ASP  25          2HB       ASP  25  57.588   1.870   0.711
  171   2HB   ASP  25          1HB       ASP  25  56.648   3.346   0.834
  172    H    LEU  26           H        LEU  26  56.868   4.709   3.924
  173    HA   LEU  26           HA       LEU  26  57.204   6.745   4.827
  174   1HB   LEU  26          2HB       LEU  26  59.951   6.410   3.668
  175   2HB   LEU  26          1HB       LEU  26  59.447   7.928   4.387
  176    HG   LEU  26           HG       LEU  26  59.428   5.279   5.845
  177   1HD1  LEU  26          1HD1      LEU  26  61.398   6.122   7.014
  178   2HD1  LEU  26          2HD1      LEU  26  61.424   7.536   5.959
  179   3HD1  LEU  26          3HD1      LEU  26  61.709   5.929   5.288
  180   1HD2  LEU  26          1HD2      LEU  26  59.110   8.116   6.816
  181   2HD2  LEU  26          2HD2      LEU  26  59.158   6.676   7.831
  182   3HD2  LEU  26          3HD2      LEU  26  57.827   6.912   6.698
  183    H    ASP  27           H        ASP  27  56.330   6.130   1.971
  184    HA   ASP  27           HA       ASP  27  56.538   8.894   0.976
  185   1HB   ASP  27          2HB       ASP  27  57.239   6.892  -0.525
  186   2HB   ASP  27          1HB       ASP  27  55.510   6.600  -0.682
  187    H    ASP  28           H        ASP  28  54.332   9.079  -0.618
  188    HA   ASP  28           HA       ASP  28  52.435   9.611   1.525
  189   1HB   ASP  28          2HB       ASP  28  53.123  11.420  -0.043
  190   2HB   ASP  28          1HB       ASP  28  52.367  10.529  -1.358
  191    H    ASP  29           H        ASP  29  51.911   7.241   1.633
  192    HA   ASP  29           HA       ASP  29  49.362   7.137   0.197
  193   1HB   ASP  29          2HB       ASP  29  49.392   4.769  -0.042
  194   2HB   ASP  29          1HB       ASP  29  50.924   5.356  -0.666
  195    H    CYS  30           H        CYS  30  48.678   4.695   1.986
  196    HA   CYS  30           HA       CYS  30  48.444   5.867   4.546
  197   1HB   CYS  30          2HB       CYS  30  46.004   6.533   4.339
  198   2HB   CYS  30          1HB       CYS  30  47.191   7.607   3.616
  199    H    GLY  31           H        GLY  31  48.853   3.559   4.946
  200   1HA   GLY  31          2HA       GLY  31  46.662   1.741   4.841
  201   2HA   GLY  31          1HA       GLY  31  48.042   1.638   5.930
  202    H    ASP  32           H        ASP  32  47.452   4.446   6.745
  203    HA   ASP  32           HA       ASP  32  44.889   4.294   8.111
  204   1HB   ASP  32          2HB       ASP  32  46.171   3.434   9.901
  205   2HB   ASP  32          1HB       ASP  32  47.558   4.444   9.509
  206    H    ARG  33           H        ARG  33  47.869   6.197   8.167
  207    HA   ARG  33           HA       ARG  33  46.309   8.580   7.442
  208   1HB   ARG  33          2HB       ARG  33  47.587   8.160   9.816
  209   2HB   ARG  33          1HB       ARG  33  48.841   8.973   8.890
  210   1HG   ARG  33          2HG       ARG  33  47.537  10.550  10.181
  211   2HG   ARG  33          1HG       ARG  33  47.330  10.812   8.448
  212   1HD   ARG  33          2HD       ARG  33  45.230  10.909   9.877
  213   2HD   ARG  33          1HD       ARG  33  45.180   9.879   8.447
  214    HE   ARG  33           HE       ARG  33  45.885   8.106  10.321
  215   1HH1  ARG  33          1HH1      ARG  33  43.442  10.613  10.422
  216   2HH1  ARG  33          2HH1      ARG  33  42.351   9.686  11.394
  217   1HH2  ARG  33          1HH2      ARG  33  44.452   6.864  11.562
  218   2HH2  ARG  33          2HH2      ARG  33  42.933   7.553  12.050
  219    H    SER  34           H        SER  34  49.779   8.020   7.798
  220    HA   SER  34           HA       SER  34  50.128   8.536   4.922
  221   1HB   SER  34          2HB       SER  34  52.499   9.083   5.576
  222   2HB   SER  34          1HB       SER  34  51.302  10.172   6.280
  223    HG   SER  34           HG       SER  34  53.075   8.571   7.517
  224    H    ASP  35           H        ASP  35  49.471   6.092   6.556
  225    HA   ASP  35           HA       ASP  35  49.822   3.845   6.470
  226   1HB   ASP  35          2HB       ASP  35  50.294   4.024   4.091
  227   2HB   ASP  35          1HB       ASP  35  51.964   4.480   4.443
  228    H    GLU  36           H        GLU  36  52.130   6.044   7.483
  229    HA   GLU  36           HA       GLU  36  53.996   3.953   8.309
  230   1HB   GLU  36          2HB       GLU  36  54.404   6.950   8.334
  231   2HB   GLU  36          1HB       GLU  36  55.636   5.717   8.579
  232   1HG   GLU  36          2HG       GLU  36  54.114   6.254   6.035
  233   2HG   GLU  36          1HG       GLU  36  55.801   6.647   6.355
  234    H    SER  37           H        SER  37  52.229   3.439   9.855
  235    HA   SER  37           HA       SER  37  53.129   4.057  12.425
  236   1HB   SER  37          2HB       SER  37  51.941   6.210  11.982
  237   2HB   SER  37          1HB       SER  37  50.441   5.302  11.794
  238    HG   SER  37           HG       SER  37  51.848   5.955  14.078
  239    H    ALA  38           H        ALA  38  49.805   3.499  11.204
  240    HA   ALA  38           HA       ALA  38  49.575   1.380  13.172
  241   1HB   ALA  38          1HB       ALA  38  47.872   3.141  13.045
  242   2HB   ALA  38          2HB       ALA  38  47.197   1.528  12.821
  243   3HB   ALA  38          3HB       ALA  38  47.441   2.584  11.430
  244    H    SER  39           H        SER  39  50.339   1.453   9.903
  245    HA   SER  39           HA       SER  39  49.093  -1.168   9.497
  246   1HB   SER  39          2HB       SER  39  49.805  -0.624   7.020
  247   2HB   SER  39          1HB       SER  39  48.342   0.073   7.715
  248    HG   SER  39           HG       SER  39  50.279   1.386   6.618
  249    H    CYS  40           H        CYS  40  52.211   0.532   8.939
  250    HA   CYS  40           HA       CYS  40  53.472  -2.067   8.623
  251   1HB   CYS  40          2HB       CYS  40  54.196  -0.195   7.193
  252   2HB   CYS  40          1HB       CYS  40  54.751   0.670   8.625
  253    H    ALA  41           H        ALA  41  53.556   0.638  10.916
  254    HA   ALA  41           HA       ALA  41  54.061   0.756  13.121
  255   1HB   ALA  41          1HB       ALA  41  54.157  -1.223  14.500
  256   2HB   ALA  41          2HB       ALA  41  54.302  -2.245  13.069
  257   3HB   ALA  41          3HB       ALA  41  52.813  -1.346  13.359
  258    H    TYR  42           H        TYR  42  56.139  -0.597  10.869
  259    HA   TYR  42           HA       TYR  42  58.365  -0.689  10.586
  260   1HB   TYR  42          2HB       TYR  42  58.016   1.672  12.369
  261   2HB   TYR  42          1HB       TYR  42  59.651   1.122  12.004
  262    HD1  TYR  42           HD1      TYR  42  60.318   3.032  10.677
  263    HD2  TYR  42           HD2      TYR  42  56.827   0.824   9.681
  264    HE1  TYR  42           HE1      TYR  42  60.238   4.148   8.492
  265    HE2  TYR  42           HE2      TYR  42  56.734   1.929   7.495
  266    HH   TYR  42           HH       TYR  42  57.502   3.823   6.373
  267    HA   PRO  43           HA       PRO  43  59.851  -3.027  14.230
  268   1HB   PRO  43          2HB       PRO  43  58.598  -5.388  14.171
  269   2HB   PRO  43          1HB       PRO  43  57.883  -4.003  14.999
  270   1HG   PRO  43          2HG       PRO  43  57.110  -5.270  12.445
  271   2HG   PRO  43          1HG       PRO  43  56.132  -4.314  13.571
  272   1HD   PRO  43          2HD       PRO  43  57.406  -3.444  11.142
  273   2HD   PRO  43          1HD       PRO  43  56.416  -2.490  12.261
  274    H    THR  44           H        THR  44  59.492  -3.222  11.002
  275    HA   THR  44           HA       THR  44  61.816  -4.757  10.480
  276    HB   THR  44           HB       THR  44  59.256  -5.997   9.456
  277    HG1  THR  44           HG1      THR  44  60.562  -6.377  11.884
  278   1HG2  THR  44          1HG2      THR  44  62.096  -6.992   9.572
  279   2HG2  THR  44          2HG2      THR  44  61.255  -6.420   8.131
  280   3HG2  THR  44          3HG2      THR  44  60.721  -7.892   8.938
  281    H    CYS  45           H        CYS  45  58.856  -3.323   9.419
  282    HA   CYS  45           HA       CYS  45  58.342  -1.872   7.768
  283   1HB   CYS  45          2HB       CYS  45  61.237  -2.105   6.925
  284   2HB   CYS  45          1HB       CYS  45  60.053  -1.009   6.208
  285    H    PHE  46           H        PHE  46  58.660  -4.941   7.592
  286    HA   PHE  46           HA       PHE  46  58.111  -5.043   4.704
  287   1HB   PHE  46          2HB       PHE  46  60.172  -6.291   5.487
  288   2HB   PHE  46          1HB       PHE  46  59.100  -7.353   6.379
  289    HD1  PHE  46           HD1      PHE  46  56.952  -7.966   4.555
  290    HD2  PHE  46           HD2      PHE  46  61.095  -7.399   3.751
  291    HE1  PHE  46           HE1      PHE  46  56.764  -9.415   2.591
  292    HE2  PHE  46           HE2      PHE  46  60.907  -8.841   1.772
  293    HZ   PHE  46           HZ       PHE  46  58.738  -9.855   1.189
  294    HA   PRO  47           HA       PRO  47  54.210  -6.580   6.503
  295   1HB   PRO  47          2HB       PRO  47  52.832  -4.739   4.785
  296   2HB   PRO  47          1HB       PRO  47  52.836  -4.774   6.548
  297   1HG   PRO  47          2HG       PRO  47  53.979  -2.778   5.032
  298   2HG   PRO  47          1HG       PRO  47  54.444  -3.165   6.698
  299   1HD   PRO  47          2HD       PRO  47  55.778  -3.916   4.128
  300   2HD   PRO  47          1HD       PRO  47  56.498  -3.459   5.687
  301    H    LEU  48           H        LEU  48  55.109  -5.414   3.356
  302    HA   LEU  48           HA       LEU  48  54.544  -7.904   2.047
  303   1HB   LEU  48          2HB       LEU  48  52.830  -5.475   1.583
  304   2HB   LEU  48          1HB       LEU  48  52.995  -6.741   0.383
  305    HG   LEU  48           HG       LEU  48  52.122  -7.442   3.160
  306   1HD1  LEU  48          1HD1      LEU  48  49.791  -7.150   2.468
  307   2HD1  LEU  48          2HD1      LEU  48  50.338  -6.428   0.952
  308   3HD1  LEU  48          3HD1      LEU  48  50.664  -5.614   2.483
  309   1HD2  LEU  48          1HD2      LEU  48  52.702  -9.233   1.615
  310   2HD2  LEU  48          2HD2      LEU  48  51.549  -8.603   0.437
  311   3HD2  LEU  48          3HD2      LEU  48  50.978  -9.247   1.977
  312    H    THR  49           H        THR  49  56.575  -7.930   1.220
  313    HA   THR  49           HA       THR  49  58.258  -7.568  -0.235
  314    HB   THR  49           HB       THR  49  57.684  -6.535  -2.447
  315    HG1  THR  49           HG1      THR  49  55.739  -5.415  -1.215
  316   1HG2  THR  49          1HG2      THR  49  56.201  -8.374  -3.133
  317   2HG2  THR  49          2HG2      THR  49  55.882  -8.734  -1.436
  318   3HG2  THR  49          3HG2      THR  49  57.507  -8.930  -2.089
  319    H    GLN  50           H        GLN  50  59.475  -6.290   1.124
  320    HA   GLN  50           HA       GLN  50  59.696  -3.482   0.419
  321   1HB   GLN  50          2HB       GLN  50  59.093  -4.451   3.218
  322   2HB   GLN  50          1HB       GLN  50  59.642  -2.829   2.827
  323   1HG   GLN  50          2HG       GLN  50  57.119  -4.019   1.720
  324   2HG   GLN  50          1HG       GLN  50  57.182  -3.103   3.225
  325   1HE2  GLN  50          1HE2      GLN  50  59.281  -1.345   2.162
  326   2HE2  GLN  50          2HE2      GLN  50  58.461  -0.232   1.139
  327    H    PHE  51           H        PHE  51  61.580  -2.510   1.650
  328    HA   PHE  51           HA       PHE  51  63.538  -4.514   2.526
  329   1HB   PHE  51          2HB       PHE  51  63.963  -3.782   0.143
  330   2HB   PHE  51          1HB       PHE  51  64.223  -2.155   0.763
  331    HD1  PHE  51           HD1      PHE  51  66.233  -1.583   1.947
  332    HD2  PHE  51           HD2      PHE  51  65.543  -5.565   0.623
  333    HE1  PHE  51           HE1      PHE  51  68.598  -2.123   2.350
  334    HE2  PHE  51           HE2      PHE  51  67.905  -6.116   1.022
  335    HZ   PHE  51           HZ       PHE  51  69.433  -4.396   1.892
  336    H    THR  52           H        THR  52  65.049  -3.718   4.057
  337    HA   THR  52           HA       THR  52  64.185  -1.238   5.366
  338    HB   THR  52           HB       THR  52  65.945  -3.325   6.637
  339    HG1  THR  52           HG1      THR  52  63.242  -3.464   7.219
  340   1HG2  THR  52          1HG2      THR  52  64.914  -2.465   8.697
  341   2HG2  THR  52          2HG2      THR  52  63.953  -1.338   7.741
  342   3HG2  THR  52          3HG2      THR  52  65.707  -1.183   7.784
  343    H    CYS  53           H        CYS  53  65.409   0.312   4.326
  344    HA   CYS  53           HA       CYS  53  68.074   0.097   3.519
  345   1HB   CYS  53          2HB       CYS  53  66.507   1.933   2.916
  346   2HB   CYS  53          1HB       CYS  53  66.724   2.589   4.537
  347    H    ASN  54           H        ASN  54  70.031   0.412   4.497
  348    HA   ASN  54           HA       ASN  54  70.185  -0.213   7.241
  349   1HB   ASN  54          2HB       ASN  54  72.446  -0.438   6.930
  350   2HB   ASN  54          1HB       ASN  54  71.913  -0.536   5.258
  351   1HD2  ASN  54          1HD2      ASN  54  72.111   1.355   3.944
  352   2HD2  ASN  54          2HD2      ASN  54  73.305   2.544   4.310
  353    H    ASN  55           H        ASN  55  70.326   2.845   5.523
  354    HA   ASN  55           HA       ASN  55  71.227   4.223   7.882
  355   1HB   ASN  55          2HB       ASN  55  72.136   4.727   5.609
  356   2HB   ASN  55          1HB       ASN  55  70.565   5.403   5.189
  357   1HD2  ASN  55          1HD2      ASN  55  71.873   7.322   4.762
  358   2HD2  ASN  55          2HD2      ASN  55  72.227   8.388   6.082
  359    H    GLY  56           H        GLY  56  68.702   3.053   8.190
  360   1HA   GLY  56          2HA       GLY  56  67.206   3.866   9.804
  361   2HA   GLY  56          1HA       GLY  56  67.473   5.495   9.206
  362    H    ARG  57           H        ARG  57  67.032   4.110   6.412
  363    HA   ARG  57           HA       ARG  57  64.221   4.850   6.437
  364   1HB   ARG  57          2HB       ARG  57  65.858   4.111   4.025
  365   2HB   ARG  57          1HB       ARG  57  64.379   5.060   4.079
  366   1HG   ARG  57          2HG       ARG  57  65.456   6.951   4.783
  367   2HG   ARG  57          1HG       ARG  57  66.802   6.048   5.496
  368   1HD   ARG  57          2HD       ARG  57  67.444   5.352   3.191
  369   2HD   ARG  57          1HD       ARG  57  66.226   6.469   2.569
  370    HE   ARG  57           HE       ARG  57  67.536   8.253   3.716
  371   1HH1  ARG  57          1HH1      ARG  57  69.026   5.252   2.749
  372   2HH1  ARG  57          2HH1      ARG  57  70.631   5.913   2.663
  373   1HH2  ARG  57          1HH2      ARG  57  69.652   9.153   3.574
  374   2HH2  ARG  57          2HH2      ARG  57  70.985   8.121   3.138
  375    H    CYS  58           H        CYS  58  62.685   3.568   5.147
  376    HA   CYS  58           HA       CYS  58  63.471   0.766   4.757
  377   1HB   CYS  58          2HB       CYS  58  60.777   1.738   5.745
  378   2HB   CYS  58          1HB       CYS  58  61.222   0.066   5.413
  379    H    ILE  59           H        ILE  59  63.322   0.286   2.608
  380    HA   ILE  59           HA       ILE  59  61.814   2.259   1.063
  381    HB   ILE  59           HB       ILE  59  63.359   2.091  -0.767
  382   1HG1  ILE  59          2HG1      ILE  59  65.041   0.220   0.914
  383   2HG1  ILE  59          1HG1      ILE  59  63.971  -0.324  -0.374
  384   1HG2  ILE  59          1HG2      ILE  59  63.850   3.720   0.949
  385   2HG2  ILE  59          2HG2      ILE  59  65.346   3.077   0.271
  386   3HG2  ILE  59          3HG2      ILE  59  64.785   2.524   1.849
  387   1HD1  ILE  59          1HD1      ILE  59  66.357   1.487  -0.671
  388   2HD1  ILE  59          2HD1      ILE  59  65.265   1.036  -1.979
  389   3HD1  ILE  59          3HD1      ILE  59  66.239  -0.197  -1.176
  390    H    ASN  60           H        ASN  60  60.978   1.663  -0.966
  391    HA   ASN  60           HA       ASN  60  59.475  -0.624  -1.220
  392   1HB   ASN  60          2HB       ASN  60  59.301   1.498  -2.544
  393   2HB   ASN  60          1HB       ASN  60  60.702   0.986  -3.468
  394   1HD2  ASN  60          1HD2      ASN  60  58.042   1.599  -4.374
  395   2HD2  ASN  60          2HD2      ASN  60  57.460   0.181  -5.173
  396    H    ILE  61           H        ILE  61  59.795  -2.662  -1.955
  397    HA   ILE  61           HA       ILE  61  62.456  -3.671  -2.086
  398    HB   ILE  61           HB       ILE  61  60.119  -4.773  -1.383
  399   1HG1  ILE  61          2HG1      ILE  61  62.410  -5.661  -0.952
  400   2HG1  ILE  61          1HG1      ILE  61  61.222  -6.913  -1.284
  401   1HG2  ILE  61          1HG2      ILE  61  59.436  -6.475  -3.020
  402   2HG2  ILE  61          2HG2      ILE  61  60.541  -5.768  -4.196
  403   3HG2  ILE  61          3HG2      ILE  61  59.169  -4.833  -3.603
  404   1HD1  ILE  61          1HD1      ILE  61  62.083  -7.158  -3.536
  405   2HD1  ILE  61          2HD1      ILE  61  63.373  -7.358  -2.349
  406   3HD1  ILE  61          3HD1      ILE  61  63.234  -5.852  -3.255
  407    H    ASN  62           H        ASN  62  60.310  -2.383  -4.381
  408    HA   ASN  62           HA       ASN  62  61.293  -3.917  -6.644
  409   1HB   ASN  62          2HB       ASN  62  58.874  -3.188  -6.311
  410   2HB   ASN  62          1HB       ASN  62  59.403  -1.560  -6.703
  411   1HD2  ASN  62          1HD2      ASN  62  58.964  -4.798  -7.916
  412   2HD2  ASN  62          2HD2      ASN  62  58.986  -4.386  -9.592
  413    H    TRP  63           H        TRP  63  63.058  -2.052  -5.097
  414    HA   TRP  63           HA       TRP  63  63.822  -0.264  -7.304
  415   1HB   TRP  63          2HB       TRP  63  64.492  -0.186  -4.366
  416   2HB   TRP  63          1HB       TRP  63  65.290   0.835  -5.558
  417    HD1  TRP  63           HD1      TRP  63  61.816   0.603  -6.641
  418    HE1  TRP  63           HE1      TRP  63  60.454   2.643  -5.864
  419    HE3  TRP  63           HE3      TRP  63  65.068   2.471  -3.194
  420    HZ2  TRP  63           HZ2      TRP  63  60.728   4.771  -4.024
  421    HZ3  TRP  63           HZ3      TRP  63  64.454   4.512  -1.964
  422    HH2  TRP  63           HH2      TRP  63  62.325   5.639  -2.373
  423    H    ARG  64           H        ARG  64  64.353  -3.240  -6.326
  424    HA   ARG  64           HA       ARG  64  67.131  -3.639  -6.386
  425   1HB   ARG  64          2HB       ARG  64  64.938  -5.458  -7.425
  426   2HB   ARG  64          1HB       ARG  64  66.598  -5.940  -7.112
  427   1HG   ARG  64          2HG       ARG  64  64.874  -4.823  -4.934
  428   2HG   ARG  64          1HG       ARG  64  64.814  -6.531  -5.379
  429   1HD   ARG  64          2HD       ARG  64  67.223  -6.708  -4.978
  430   2HD   ARG  64          1HD       ARG  64  67.272  -5.007  -4.521
  431    HE   ARG  64           HE       ARG  64  65.549  -5.852  -2.751
  432   1HH1  ARG  64          1HH1      ARG  64  68.401  -7.526  -3.924
  433   2HH1  ARG  64          2HH1      ARG  64  68.753  -8.260  -2.387
  434   1HH2  ARG  64          1HH2      ARG  64  66.019  -6.853  -0.730
  435   2HH2  ARG  64          2HH2      ARG  64  67.403  -7.892  -0.590
  436    H    CYS  65           H        CYS  65  68.305  -2.646  -7.943
  437    HA   CYS  65           HA       CYS  65  67.249  -2.489 -10.643
  438   1HB   CYS  65          2HB       CYS  65  68.216  -0.478  -9.640
  439   2HB   CYS  65          1HB       CYS  65  69.751  -1.315  -9.421
  440    H    ASP  66           H        ASP  66  70.315  -3.365  -9.204
  441    HA   ASP  66           HA       ASP  66  70.945  -5.078 -11.493
  442   1HB   ASP  66          2HB       ASP  66  73.242  -5.044 -10.559
  443   2HB   ASP  66          1HB       ASP  66  72.629  -3.416 -10.851
  444    H    ASN  67           H        ASN  67  71.062  -5.155  -7.952
  445    HA   ASN  67           HA       ASN  67  70.234  -7.922  -7.969
  446   1HB   ASN  67          2HB       ASN  67  72.740  -7.954  -8.021
  447   2HB   ASN  67          1HB       ASN  67  72.733  -7.058  -6.505
  448   1HD2  ASN  67          1HD2      ASN  67  70.450  -9.596  -7.330
  449   2HD2  ASN  67          2HD2      ASN  67  70.993 -10.719  -6.135
  450    H    ASP  68           H        ASP  68  71.202  -5.094  -6.057
  451    HA   ASP  68           HA       ASP  68  69.041  -5.810  -4.193
  452   1HB   ASP  68          2HB       ASP  68  71.592  -5.615  -3.425
  453   2HB   ASP  68          1HB       ASP  68  71.153  -3.911  -3.304
  454    H    ASN  69           H        ASN  69  68.486  -3.523  -2.913
  455    HA   ASN  69           HA       ASN  69  67.389  -2.022  -5.204
  456   1HB   ASN  69          2HB       ASN  69  65.531  -1.439  -3.481
  457   2HB   ASN  69          1HB       ASN  69  65.537  -3.013  -4.261
  458   1HD2  ASN  69          1HD2      ASN  69  67.636  -1.964  -1.640
  459   2HD2  ASN  69          2HD2      ASN  69  67.032  -3.105  -0.487
  460    H    ASP  70           H        ASP  70  67.798  -0.028  -5.451
  461    HA   ASP  70           HA       ASP  70  69.906   1.198  -4.178
  462   1HB   ASP  70          2HB       ASP  70  68.408   1.626  -6.411
  463   2HB   ASP  70          1HB       ASP  70  67.996   3.022  -5.418
  464    H    CYS  71           H        CYS  71  70.123   2.250  -2.315
  465    HA   CYS  71           HA       CYS  71  67.856   3.905  -1.432
  466   1HB   CYS  71          2HB       CYS  71  68.221   1.875   0.014
  467   2HB   CYS  71          1HB       CYS  71  69.784   2.558   0.455
  468    H    GLY  72           H        GLY  72  70.737   4.150  -2.811
  469   1HA   GLY  72          2HA       GLY  72  71.674   6.262  -3.225
  470   2HA   GLY  72          1HA       GLY  72  70.999   6.841  -1.719
  471    H    ASP  73           H        ASP  73  72.119   5.126   0.173
  472    HA   ASP  73           HA       ASP  73  74.935   5.920  -0.158
  473   1HB   ASP  73          2HB       ASP  73  74.872   5.901   2.460
  474   2HB   ASP  73          1HB       ASP  73  74.264   7.283   1.560
  475    H    ASN  74           H        ASN  74  74.760   3.654  -1.212
  476    HA   ASN  74           HA       ASN  74  75.763   1.619  -1.281
  477   1HB   ASN  74          2HB       ASN  74  77.162   2.786   1.125
  478   2HB   ASN  74          1HB       ASN  74  77.625   1.256   0.392
  479   1HD2  ASN  74          1HD2      ASN  74  77.104   2.129  -2.336
  480   2HD2  ASN  74          2HD2      ASN  74  78.371   3.235  -2.732
  481    H    SER  75           H        SER  75  73.298   1.934   0.450
  482    HA   SER  75           HA       SER  75  73.464   0.093   2.576
  483   1HB   SER  75          2HB       SER  75  71.632   1.793   2.176
  484   2HB   SER  75          1HB       SER  75  71.033   0.732   0.901
  485    HG   SER  75           HG       SER  75  70.861  -0.916   2.556
  486    H    ASP  76           H        ASP  76  71.941  -0.173  -0.492
  487    HA   ASP  76           HA       ASP  76  71.999  -3.047  -0.654
  488   1HB   ASP  76          2HB       ASP  76  71.111  -2.387  -3.007
  489   2HB   ASP  76          1HB       ASP  76  70.122  -1.950  -1.613
  490    H    GLU  77           H        GLU  77  73.238  -0.380  -2.512
  491    HA   GLU  77           HA       GLU  77  75.860  -1.240  -2.868
  492   1HB   GLU  77          2HB       GLU  77  75.767  -1.703  -5.341
  493   2HB   GLU  77          1HB       GLU  77  75.061  -2.958  -4.342
  494   1HG   GLU  77          2HG       GLU  77  73.498  -2.840  -5.983
  495   2HG   GLU  77          1HG       GLU  77  72.828  -1.667  -4.855
  496    H    ALA  78           H        ALA  78  73.099   0.456  -4.073
  497    HA   ALA  78           HA       ALA  78  72.712   2.565  -4.782
  498   1HB   ALA  78          1HB       ALA  78  75.057   3.214  -3.015
  499   2HB   ALA  78          2HB       ALA  78  73.383   3.042  -2.492
  500   3HB   ALA  78          3HB       ALA  78  73.835   4.345  -3.587
  501    H    GLY  79           H        GLY  79  73.200   2.233  -6.958
  502   1HA   GLY  79          2HA       GLY  79  74.969   4.061  -8.083
  503   2HA   GLY  79          1HA       GLY  79  75.818   2.525  -8.009
  504    H    CYS  80           H        CYS  80  73.117   1.136  -8.389
  505    HA   CYS  80           HA       CYS  80  73.361   1.002 -11.239
  506   1HB   CYS  80          2HB       CYS  80  72.819  -0.974  -9.812
  507   2HB   CYS  80          1HB       CYS  80  71.238  -0.263  -9.495
  508    H    SER  81           H        SER  81  70.940   2.395  -9.010
  509    HA   SER  81           HA       SER  81  69.181   2.970 -11.243
  510   1HB   SER  81          2HB       SER  81  68.265   2.242  -9.065
  511   2HB   SER  81          1HB       SER  81  68.884   3.721  -8.330
  512    HG   SER  81           HG       SER  81  67.480   4.912  -9.601
  513    H    HIS  82           HN       HIS  82  69.259   4.725 -12.419
  514    HA   HIS  82           HA       HIS  82  69.979   7.283 -11.202
  515   1HB   HIS  82          2HB       HIS  82  71.234   6.045 -13.638
  516   2HB   HIS  82          1HB       HIS  82  71.111   7.793 -13.502
  517    HD1  HIS  82           HD1      HIS  82  72.602   4.877 -11.536
  518    HD2  HIS  82           HD2      HIS  82  73.142   8.949 -12.161
  519    HE1  HIS  82           HE1      HIS  82  74.748   5.496 -10.357
  Start of MODEL    8
    1   1H    SER   1          1HT       SER   1  30.433  -7.579   0.274
    2   2H    SER   1          2HT       SER   1  31.425  -8.893  -0.146
    3   3H    SER   1          3HT       SER   1  30.041  -8.547  -1.057
    4    HA   SER   1           HA       SER   1  32.082  -7.853  -2.168
    5   1HB   SER   1          2HB       SER   1  30.299  -5.551  -1.331
    6   2HB   SER   1          1HB       SER   1  31.234  -5.678  -2.825
    7    HG   SER   1           HG       SER   1  29.069  -6.245  -3.187
    8    H    ALA   2           H        ALA   2  33.875  -6.446  -2.236
    9    HA   ALA   2           HA       ALA   2  34.734  -5.451   0.393
   10   1HB   ALA   2          1HB       ALA   2  36.216  -7.123  -0.604
   11   2HB   ALA   2          2HB       ALA   2  37.015  -5.553  -0.494
   12   3HB   ALA   2          3HB       ALA   2  36.390  -6.117  -2.044
   13    H    ARG   3           H        ARG   3  36.569  -3.578  -0.208
   14    HA   ARG   3           HA       ARG   3  35.443  -1.748  -2.165
   15   1HB   ARG   3          2HB       ARG   3  34.826  -0.041  -0.717
   16   2HB   ARG   3          1HB       ARG   3  34.316  -1.465   0.179
   17   1HG   ARG   3          2HG       ARG   3  36.366  -1.362   1.510
   18   2HG   ARG   3          1HG       ARG   3  36.869   0.072   0.611
   19   1HD   ARG   3          2HD       ARG   3  34.543   0.996   1.379
   20   2HD   ARG   3          1HD       ARG   3  34.689  -0.246   2.627
   21    HE   ARG   3           HE       ARG   3  36.716   1.860   2.202
   22   1HH1  ARG   3          1HH1      ARG   3  34.853  -0.214   4.322
   23   2HH1  ARG   3          2HH1      ARG   3  35.437   0.541   5.772
   24   1HH2  ARG   3          1HH2      ARG   3  37.494   2.858   4.097
   25   2HH2  ARG   3          2HH2      ARG   3  36.928   2.312   5.642
   26    H    THR   4           H        THR   4  36.838  -0.048  -2.709
   27    HA   THR   4           HA       THR   4  38.785   1.002  -3.138
   28    HB   THR   4           HB       THR   4  40.129   1.666  -1.100
   29    HG1  THR   4           HG1      THR   4  39.331  -0.277   0.112
   30   1HG2  THR   4          1HG2      THR   4  38.348   3.130  -0.232
   31   2HG2  THR   4          2HG2      THR   4  37.150   2.160  -1.090
   32   3HG2  THR   4          3HG2      THR   4  38.357   3.073  -1.995
   33    H    CYS   5           H        CYS   5  39.870  -0.411  -4.454
   34    HA   CYS   5           HA       CYS   5  41.840  -1.283  -5.163
   35   1HB   CYS   5          2HB       CYS   5  42.528  -0.161  -2.637
   36   2HB   CYS   5          1HB       CYS   5  43.329  -1.721  -2.771
   37    HA   PRO   6           HA       PRO   6  41.301  -5.663  -4.487
   38   1HB   PRO   6          2HB       PRO   6  43.826  -6.025  -5.920
   39   2HB   PRO   6          1HB       PRO   6  42.196  -6.497  -6.405
   40   1HG   PRO   6          2HG       PRO   6  43.553  -4.503  -7.626
   41   2HG   PRO   6          1HG       PRO   6  41.788  -4.494  -7.459
   42   1HD   PRO   6          2HD       PRO   6  43.853  -3.033  -5.856
   43   2HD   PRO   6          1HD       PRO   6  42.282  -2.461  -6.457
   44    HA   PRO   7           HA       PRO   7  43.826  -6.870  -1.069
   45   1HB   PRO   7          2HB       PRO   7  44.252  -9.511  -2.350
   46   2HB   PRO   7          1HB       PRO   7  43.541  -9.119  -0.780
   47   1HG   PRO   7          2HG       PRO   7  42.002  -9.906  -2.804
   48   2HG   PRO   7          1HG       PRO   7  41.463  -8.633  -1.692
   49   1HD   PRO   7          2HD       PRO   7  42.571  -8.384  -4.465
   50   2HD   PRO   7          1HD       PRO   7  41.229  -7.503  -3.705
   51    H    ASN   8           H        ASN   8  45.150  -7.347  -4.271
   52    HA   ASN   8           HA       ASN   8  47.859  -7.743  -3.258
   53   1HB   ASN   8          2HB       ASN   8  46.741  -8.744  -5.452
   54   2HB   ASN   8          1HB       ASN   8  47.274  -7.215  -6.144
   55   1HD2  ASN   8          1HD2      ASN   8  49.512  -6.759  -6.218
   56   2HD2  ASN   8          2HD2      ASN   8  50.676  -8.034  -6.155
   57    H    GLN   9           H        GLN   9  46.068  -5.266  -3.100
   58    HA   GLN   9           HA       GLN   9  48.028  -3.290  -3.946
   59   1HB   GLN   9          2HB       GLN   9  45.415  -3.710  -5.101
   60   2HB   GLN   9          1HB       GLN   9  45.465  -2.149  -4.303
   61   1HG   GLN   9          2HG       GLN   9  46.051  -1.774  -6.535
   62   2HG   GLN   9          1HG       GLN   9  47.538  -1.653  -5.601
   63   1HE2  GLN   9          1HE2      GLN   9  45.993  -4.679  -6.457
   64   2HE2  GLN   9          2HE2      GLN   9  47.218  -5.223  -7.538
   65    H    PHE  10           H        PHE  10  47.156  -1.082  -3.039
   66    HA   PHE  10           HA       PHE  10  45.778  -1.441  -0.491
   67   1HB   PHE  10          2HB       PHE  10  48.077  -1.516   0.185
   68   2HB   PHE  10          1HB       PHE  10  48.489  -0.153  -0.852
   69    HD1  PHE  10           HD1      PHE  10  46.412  -1.067   2.083
   70    HD2  PHE  10           HD2      PHE  10  48.491   1.999  -0.017
   71    HE1  PHE  10           HE1      PHE  10  45.959   0.493   3.933
   72    HE2  PHE  10           HE2      PHE  10  48.043   3.564   1.830
   73    HZ   PHE  10           HZ       PHE  10  46.776   2.819   3.805
   74    H    SER  11           H        SER  11  44.586   0.357   0.083
   75    HA   SER  11           HA       SER  11  44.311   2.333  -2.012
   76   1HB   SER  11          2HB       SER  11  42.002   2.646  -1.091
   77   2HB   SER  11          1HB       SER  11  42.310   1.025  -1.717
   78    HG   SER  11           HG       SER  11  42.759   1.611   1.000
   79    H    CYS  12           H        CYS  12  45.360   4.163  -1.515
   80    HA   CYS  12           HA       CYS  12  45.788   5.238   1.010
   81   1HB   CYS  12          2HB       CYS  12  46.957   6.349  -0.681
   82   2HB   CYS  12          1HB       CYS  12  45.546   6.451  -1.726
   83    H    ALA  13           H        ALA  13  44.662   7.054   2.034
   84    HA   ALA  13           HA       ALA  13  42.576   6.250   3.331
   85   1HB   ALA  13          1HB       ALA  13  42.780   9.095   2.391
   86   2HB   ALA  13          2HB       ALA  13  43.658   8.382   3.748
   87   3HB   ALA  13          3HB       ALA  13  41.900   8.531   3.812
   88    H    SER  14           H        SER  14  41.308   4.912   1.961
   89    HA   SER  14           HA       SER  14  39.415   4.314   0.865
   90   1HB   SER  14          2HB       SER  14  38.342   6.701   2.381
   91   2HB   SER  14          1HB       SER  14  37.396   5.345   1.769
   92    HG   SER  14           HG       SER  14  39.345   5.345   3.817
   93    H    GLY  15           H        GLY  15  41.021   5.949  -0.812
   94   1HA   GLY  15          2HA       GLY  15  38.928   6.888  -2.606
   95   2HA   GLY  15          1HA       GLY  15  40.069   8.106  -2.061
   96    H    ARG  16           H        ARG  16  42.435   6.717  -2.083
   97    HA   ARG  16           HA       ARG  16  42.829   6.521  -4.965
   98   1HB   ARG  16          2HB       ARG  16  44.816   6.737  -2.696
   99   2HB   ARG  16          1HB       ARG  16  45.267   6.587  -4.387
  100   1HG   ARG  16          2HG       ARG  16  45.435   8.868  -3.926
  101   2HG   ARG  16          1HG       ARG  16  43.898   8.703  -4.774
  102   1HD   ARG  16          2HD       ARG  16  42.733   8.706  -2.594
  103   2HD   ARG  16          1HD       ARG  16  44.279   8.954  -1.784
  104    HE   ARG  16           HE       ARG  16  43.166  10.886  -3.711
  105   1HH1  ARG  16          1HH1      ARG  16  44.724  10.139  -0.666
  106   2HH1  ARG  16          2HH1      ARG  16  44.842  11.797  -0.174
  107   1HH2  ARG  16          1HH2      ARG  16  43.329  13.076  -3.078
  108   2HH2  ARG  16          2HH2      ARG  16  44.039  13.476  -1.550
  109    H    CYS  17           H        CYS  17  44.604   4.864  -5.605
  110    HA   CYS  17           HA       CYS  17  44.325   2.347  -4.170
  111   1HB   CYS  17          2HB       CYS  17  42.429   2.626  -5.865
  112   2HB   CYS  17          1HB       CYS  17  43.659   2.512  -7.114
  113    H    ILE  18           H        ILE  18  46.372   1.825  -3.878
  114    HA   ILE  18           HA       ILE  18  48.325   2.314  -6.034
  115    HB   ILE  18           HB       ILE  18  49.980   2.921  -4.375
  116   1HG1  ILE  18          2HG1      ILE  18  48.899   3.244  -1.941
  117   2HG1  ILE  18          1HG1      ILE  18  47.957   1.859  -2.472
  118   1HG2  ILE  18          1HG2      ILE  18  48.404   4.684  -5.092
  119   2HG2  ILE  18          2HG2      ILE  18  49.036   4.950  -3.465
  120   3HG2  ILE  18          3HG2      ILE  18  47.404   4.317  -3.681
  121   1HD1  ILE  18          1HD1      ILE  18  49.820   1.072  -1.230
  122   2HD1  ILE  18          2HD1      ILE  18  50.934   2.039  -2.192
  123   3HD1  ILE  18          3HD1      ILE  18  50.094   0.674  -2.927
  124    HA   PRO  19           HA       PRO  19  49.266  -2.004  -5.414
  125   1HB   PRO  19          2HB       PRO  19  51.818  -2.157  -6.291
  126   2HB   PRO  19          1HB       PRO  19  50.448  -1.915  -7.383
  127   1HG   PRO  19          2HG       PRO  19  52.436   0.060  -6.361
  128   2HG   PRO  19          1HG       PRO  19  51.673  -0.046  -7.956
  129   1HD   PRO  19          2HD       PRO  19  50.901   1.700  -5.952
  130   2HD   PRO  19          1HD       PRO  19  49.868   1.179  -7.295
  131    H    ILE  20           H        ILE  20  50.102  -3.362  -3.902
  132    HA   ILE  20           HA       ILE  20  51.057  -2.418  -1.465
  133    HB   ILE  20           HB       ILE  20  51.080  -5.113  -2.754
  134   1HG1  ILE  20          2HG1      ILE  20  48.929  -4.209  -2.049
  135   2HG1  ILE  20          1HG1      ILE  20  49.363  -5.607  -1.071
  136   1HG2  ILE  20          1HG2      ILE  20  51.713  -6.146  -0.630
  137   2HG2  ILE  20          2HG2      ILE  20  52.032  -4.544   0.033
  138   3HG2  ILE  20          3HG2      ILE  20  53.010  -5.155  -1.301
  139   1HD1  ILE  20          1HD1      ILE  20  49.642  -2.725  -0.254
  140   2HD1  ILE  20          2HD1      ILE  20  50.089  -4.120   0.729
  141   3HD1  ILE  20          3HD1      ILE  20  48.400  -3.850   0.295
  142    H    SER  21           H        SER  21  53.123  -2.795  -0.420
  143    HA   SER  21           HA       SER  21  55.423  -2.906  -0.261
  144   1HB   SER  21          2HB       SER  21  55.640  -4.132  -2.423
  145   2HB   SER  21          1HB       SER  21  55.550  -2.597  -3.280
  146    HG   SER  21           HG       SER  21  57.521  -3.254  -1.343
  147    H    TRP  22           H        TRP  22  53.388  -0.641  -1.550
  148    HA   TRP  22           HA       TRP  22  55.402   1.505  -1.598
  149   1HB   TRP  22          2HB       TRP  22  52.528   1.409  -2.494
  150   2HB   TRP  22          1HB       TRP  22  53.493   2.877  -2.515
  151    HD1  TRP  22           HD1      TRP  22  54.508  -0.668  -3.726
  152    HE1  TRP  22           HE1      TRP  22  55.210  -0.491  -6.194
  153    HE3  TRP  22           HE3      TRP  22  53.445   4.261  -4.508
  154    HZ2  TRP  22           HZ2      TRP  22  55.299   1.479  -8.211
  155    HZ3  TRP  22           HZ3      TRP  22  53.866   5.215  -6.740
  156    HH2  TRP  22           HH2      TRP  22  54.771   3.855  -8.550
  157    H    THR  23           H        THR  23  53.384   0.141   0.631
  158    HA   THR  23           HA       THR  23  52.458   2.508   1.902
  159    HB   THR  23           HB       THR  23  51.686   1.040   3.684
  160    HG1  THR  23           HG1      THR  23  53.257  -0.461   3.944
  161   1HG2  THR  23          1HG2      THR  23  51.282  -0.258   0.986
  162   2HG2  THR  23          2HG2      THR  23  50.366   1.121   1.602
  163   3HG2  THR  23          3HG2      THR  23  50.249  -0.448   2.401
  164    H    CYS  24           H        CYS  24  55.035   0.217   2.587
  165    HA   CYS  24           HA       CYS  24  55.782   1.720   4.938
  166   1HB   CYS  24          2HB       CYS  24  55.381  -0.732   5.054
  167   2HB   CYS  24          1HB       CYS  24  56.797  -0.965   4.036
  168    H    ASP  25           H        ASP  25  56.546   2.643   2.145
  169    HA   ASP  25           HA       ASP  25  59.465   2.469   2.503
  170   1HB   ASP  25          2HB       ASP  25  59.646   3.000   0.056
  171   2HB   ASP  25          1HB       ASP  25  58.943   1.435   0.431
  172    H    LEU  26           H        LEU  26  57.231   4.439   3.391
  173    HA   LEU  26           HA       LEU  26  57.420   6.470   4.327
  174   1HB   LEU  26          2HB       LEU  26  60.107   6.540   2.974
  175   2HB   LEU  26          1HB       LEU  26  59.457   7.921   3.831
  176    HG   LEU  26           HG       LEU  26  59.234   6.119   5.800
  177   1HD1  LEU  26          1HD1      LEU  26  61.559   5.135   4.159
  178   2HD1  LEU  26          2HD1      LEU  26  60.061   4.259   4.472
  179   3HD1  LEU  26          3HD1      LEU  26  61.160   4.630   5.801
  180   1HD2  LEU  26          1HD2      LEU  26  61.376   6.929   6.637
  181   2HD2  LEU  26          2HD2      LEU  26  60.445   8.236   5.904
  182   3HD2  LEU  26          3HD2      LEU  26  61.794   7.513   5.027
  183    H    ASP  27           H        ASP  27  55.652   7.201   3.346
  184    HA   ASP  27           HA       ASP  27  54.610   9.051   2.534
  185   1HB   ASP  27          2HB       ASP  27  56.986  10.050   2.745
  186   2HB   ASP  27          1HB       ASP  27  57.043   9.881   0.994
  187    H    ASP  28           H        ASP  28  54.686  10.281   0.062
  188    HA   ASP  28           HA       ASP  28  53.748  10.154  -1.978
  189   1HB   ASP  28          2HB       ASP  28  55.763   8.753  -2.522
  190   2HB   ASP  28          1HB       ASP  28  54.780   7.324  -2.203
  191    H    ASP  29           H        ASP  29  53.279   7.029  -0.345
  192    HA   ASP  29           HA       ASP  29  50.580   6.717  -1.256
  193   1HB   ASP  29          2HB       ASP  29  52.279   4.941  -0.413
  194   2HB   ASP  29          1HB       ASP  29  51.750   5.418   1.195
  195    H    CYS  30           H        CYS  30  48.888   6.328   0.747
  196    HA   CYS  30           HA       CYS  30  49.121   8.193   2.873
  197   1HB   CYS  30          2HB       CYS  30  47.263   9.725   2.008
  198   2HB   CYS  30          1HB       CYS  30  48.900   9.953   1.406
  199    H    GLY  31           H        GLY  31  48.275   5.533   2.749
  200   1HA   GLY  31          2HA       GLY  31  45.432   5.378   3.043
  201   2HA   GLY  31          1HA       GLY  31  46.606   4.216   3.655
  202    H    ASP  32           H        ASP  32  48.100   5.574   5.393
  203    HA   ASP  32           HA       ASP  32  46.251   6.395   7.502
  204   1HB   ASP  32          2HB       ASP  32  47.948   4.985   8.326
  205   2HB   ASP  32          1HB       ASP  32  49.192   5.766   7.359
  206    H    ARG  33           H        ARG  33  49.135   7.616   5.920
  207    HA   ARG  33           HA       ARG  33  48.152  10.267   5.593
  208   1HB   ARG  33          2HB       ARG  33  50.022   9.647   7.838
  209   2HB   ARG  33          1HB       ARG  33  50.350  11.089   6.886
  210   1HG   ARG  33          2HG       ARG  33  48.450  12.153   7.591
  211   2HG   ARG  33          1HG       ARG  33  47.602  10.644   7.933
  212   1HD   ARG  33          2HD       ARG  33  49.969  11.618   9.514
  213   2HD   ARG  33          1HD       ARG  33  48.296  11.967   9.952
  214    HE   ARG  33           HE       ARG  33  48.947   9.153   9.565
  215   1HH1  ARG  33          1HH1      ARG  33  48.698  11.786  11.857
  216   2HH1  ARG  33          2HH1      ARG  33  48.391  10.757  13.211
  217   1HH2  ARG  33          1HH2      ARG  33  48.495   7.786  11.329
  218   2HH2  ARG  33          2HH2      ARG  33  48.280   8.477  12.915
  219    H    SER  34           H        SER  34  51.306   8.743   6.126
  220    HA   SER  34           HA       SER  34  51.677   8.697   3.219
  221   1HB   SER  34          2HB       SER  34  53.854   9.035   5.298
  222   2HB   SER  34          1HB       SER  34  54.079   9.007   3.550
  223    HG   SER  34           HG       SER  34  53.848  11.101   3.718
  224    H    ASP  35           H        ASP  35  51.027   7.015   5.870
  225    HA   ASP  35           HA       ASP  35  50.689   4.815   6.247
  226   1HB   ASP  35          2HB       ASP  35  52.051   4.463   3.597
  227   2HB   ASP  35          1HB       ASP  35  51.456   3.113   4.569
  228    H    GLU  36           H        GLU  36  52.852   6.103   7.449
  229    HA   GLU  36           HA       GLU  36  54.776   3.903   7.712
  230   1HB   GLU  36          2HB       GLU  36  54.800   6.688   8.897
  231   2HB   GLU  36          1HB       GLU  36  56.036   5.474   9.194
  232   1HG   GLU  36          2HG       GLU  36  56.814   7.016   7.538
  233   2HG   GLU  36          1HG       GLU  36  56.542   5.447   6.790
  234    H    SER  37           H        SER  37  52.330   5.630   9.393
  235    HA   SER  37           HA       SER  37  52.575   3.839  11.694
  236   1HB   SER  37          2HB       SER  37  50.830   5.537  12.646
  237   2HB   SER  37          1HB       SER  37  52.525   6.016  12.545
  238    HG   SER  37           HG       SER  37  50.491   6.637  10.644
  239    H    ALA  38           H        ALA  38  50.931   2.488  12.245
  240    HA   ALA  38           HA       ALA  38  48.994   1.348  12.221
  241   1HB   ALA  38          1HB       ALA  38  47.836   3.642  10.655
  242   2HB   ALA  38          2HB       ALA  38  47.917   3.547  12.414
  243   3HB   ALA  38          3HB       ALA  38  46.932   2.393  11.514
  244    H    SER  39           H        SER  39  50.432   2.227   9.259
  245    HA   SER  39           HA       SER  39  49.000   0.050   7.915
  246   1HB   SER  39          2HB       SER  39  50.932   2.049   6.708
  247   2HB   SER  39          1HB       SER  39  49.867   0.945   5.838
  248    HG   SER  39           HG       SER  39  48.895   2.957   5.873
  249    H    CYS  40           H        CYS  40  52.325   1.301   8.225
  250    HA   CYS  40           HA       CYS  40  53.287  -1.448   7.956
  251   1HB   CYS  40          2HB       CYS  40  54.449   0.271   6.606
  252   2HB   CYS  40          1HB       CYS  40  54.935   1.087   8.098
  253    H    ALA  41           H        ALA  41  53.504   1.315  10.160
  254    HA   ALA  41           HA       ALA  41  53.689   1.467  12.415
  255   1HB   ALA  41          1HB       ALA  41  53.492  -0.460  13.870
  256   2HB   ALA  41          2HB       ALA  41  53.701  -1.548  12.497
  257   3HB   ALA  41          3HB       ALA  41  52.266  -0.528  12.605
  258    H    TYR  42           H        TYR  42  55.855  -0.036  10.395
  259    HA   TYR  42           HA       TYR  42  58.083  -0.362  10.334
  260   1HB   TYR  42          2HB       TYR  42  57.858   2.076  12.078
  261   2HB   TYR  42          1HB       TYR  42  59.429   1.412  11.640
  262    HD1  TYR  42           HD1      TYR  42  59.524   3.905  10.665
  263    HD2  TYR  42           HD2      TYR  42  57.159   0.750   9.073
  264    HE1  TYR  42           HE1      TYR  42  59.417   5.075   8.510
  265    HE2  TYR  42           HE2      TYR  42  57.035   1.925   6.923
  266    HH   TYR  42           HH       TYR  42  59.023   4.531   6.144
  267    HA   PRO  43           HA       PRO  43  58.696  -2.660  14.314
  268   1HB   PRO  43          2HB       PRO  43  58.040  -5.127  12.964
  269   2HB   PRO  43          1HB       PRO  43  57.250  -4.411  14.370
  270   1HG   PRO  43          2HG       PRO  43  56.079  -4.667  11.898
  271   2HG   PRO  43          1HG       PRO  43  55.603  -3.464  13.106
  272   1HD   PRO  43          2HD       PRO  43  57.331  -3.142  10.687
  273   2HD   PRO  43          1HD       PRO  43  56.124  -2.028  11.368
  274    H    THR  44           H        THR  44  59.101  -3.646  10.962
  275    HA   THR  44           HA       THR  44  61.989  -3.631  11.266
  276    HB   THR  44           HB       THR  44  61.374  -5.985  11.691
  277    HG1  THR  44           HG1      THR  44  62.690  -5.369   9.250
  278   1HG2  THR  44          1HG2      THR  44  59.276  -6.078  10.449
  279   2HG2  THR  44          2HG2      THR  44  60.374  -7.344   9.905
  280   3HG2  THR  44          3HG2      THR  44  60.153  -5.893   8.927
  281    H    CYS  45           H        CYS  45  59.545  -2.342   9.888
  282    HA   CYS  45           HA       CYS  45  58.976  -1.337   7.963
  283   1HB   CYS  45          2HB       CYS  45  61.924  -1.671   7.478
  284   2HB   CYS  45          1HB       CYS  45  60.861  -0.801   6.376
  285    H    PHE  46           H        PHE  46  59.051  -4.402   8.075
  286    HA   PHE  46           HA       PHE  46  58.371  -4.604   5.247
  287   1HB   PHE  46          2HB       PHE  46  60.441  -5.712   5.202
  288   2HB   PHE  46          1HB       PHE  46  60.156  -6.507   6.741
  289    HD1  PHE  46           HD1      PHE  46  57.550  -6.481   4.118
  290    HD2  PHE  46           HD2      PHE  46  60.781  -8.637   5.875
  291    HE1  PHE  46           HE1      PHE  46  56.828  -8.516   2.949
  292    HE2  PHE  46           HE2      PHE  46  60.058 -10.673   4.707
  293    HZ   PHE  46           HZ       PHE  46  58.078 -10.618   3.248
  294    HA   PRO  47           HA       PRO  47  54.902  -6.659   7.158
  295   1HB   PRO  47          2HB       PRO  47  52.969  -5.029   6.270
  296   2HB   PRO  47          1HB       PRO  47  53.864  -4.681   7.752
  297   1HG   PRO  47          2HG       PRO  47  54.055  -3.397   5.091
  298   2HG   PRO  47          1HG       PRO  47  54.419  -2.731   6.691
  299   1HD   PRO  47          2HD       PRO  47  56.255  -3.768   4.767
  300   2HD   PRO  47          1HD       PRO  47  56.615  -3.187   6.404
  301    H    LEU  48           H        LEU  48  55.536  -5.224   4.053
  302    HA   LEU  48           HA       LEU  48  54.476  -7.502   2.614
  303   1HB   LEU  48          2HB       LEU  48  53.295  -4.735   2.326
  304   2HB   LEU  48          1HB       LEU  48  53.009  -6.053   1.204
  305    HG   LEU  48           HG       LEU  48  52.378  -6.340   4.120
  306   1HD1  LEU  48          1HD1      LEU  48  50.070  -5.699   3.620
  307   2HD1  LEU  48          2HD1      LEU  48  50.534  -5.296   1.968
  308   3HD1  LEU  48          3HD1      LEU  48  51.177  -4.359   3.317
  309   1HD2  LEU  48          1HD2      LEU  48  51.320  -7.692   1.638
  310   2HD2  LEU  48          2HD2      LEU  48  50.823  -8.042   3.294
  311   3HD2  LEU  48          3HD2      LEU  48  52.478  -8.374   2.778
  312    H    THR  49           H        THR  49  56.618  -7.703   1.865
  313    HA   THR  49           HA       THR  49  58.258  -7.537   0.343
  314    HB   THR  49           HB       THR  49  57.607  -6.488  -1.900
  315    HG1  THR  49           HG1      THR  49  55.740  -5.376  -0.673
  316   1HG2  THR  49          1HG2      THR  49  56.228  -8.417  -2.498
  317   2HG2  THR  49          2HG2      THR  49  55.954  -8.751  -0.789
  318   3HG2  THR  49          3HG2      THR  49  57.577  -8.893  -1.466
  319    H    GLN  50           H        GLN  50  59.690  -6.299   1.440
  320    HA   GLN  50           HA       GLN  50  59.934  -3.501   0.644
  321   1HB   GLN  50          2HB       GLN  50  59.986  -4.412   3.529
  322   2HB   GLN  50          1HB       GLN  50  60.245  -2.775   2.952
  323   1HG   GLN  50          2HG       GLN  50  57.665  -4.225   2.484
  324   2HG   GLN  50          1HG       GLN  50  57.991  -3.343   3.974
  325   1HE2  GLN  50          1HE2      GLN  50  59.576  -1.302   2.561
  326   2HE2  GLN  50          2HE2      GLN  50  58.420  -0.299   1.763
  327    H    PHE  51           H        PHE  51  62.041  -2.596   1.372
  328    HA   PHE  51           HA       PHE  51  63.981  -4.564   2.340
  329   1HB   PHE  51          2HB       PHE  51  64.288  -4.347  -0.149
  330   2HB   PHE  51          1HB       PHE  51  64.630  -2.635   0.092
  331    HD1  PHE  51           HD1      PHE  51  66.851  -1.988   0.298
  332    HD2  PHE  51           HD2      PHE  51  65.746  -5.967   1.326
  333    HE1  PHE  51           HE1      PHE  51  69.201  -2.516   0.739
  334    HE2  PHE  51           HE2      PHE  51  68.106  -6.503   1.770
  335    HZ   PHE  51           HZ       PHE  51  69.836  -4.777   1.476
  336    H    THR  52           H        THR  52  65.760  -3.566   3.486
  337    HA   THR  52           HA       THR  52  65.106  -0.868   4.428
  338    HB   THR  52           HB       THR  52  66.871  -2.911   5.790
  339    HG1  THR  52           HG1      THR  52  64.397  -2.366   6.885
  340   1HG2  THR  52          1HG2      THR  52  65.550  -0.391   6.797
  341   2HG2  THR  52          2HG2      THR  52  67.266  -0.585   6.444
  342   3HG2  THR  52          3HG2      THR  52  66.527  -1.497   7.761
  343    H    CYS  53           H        CYS  53  66.265   0.619   3.408
  344    HA   CYS  53           HA       CYS  53  68.603   0.251   1.957
  345   1HB   CYS  53          2HB       CYS  53  67.243   2.230   1.707
  346   2HB   CYS  53          1HB       CYS  53  67.608   2.720   3.358
  347    H    ASN  54           H        ASN  54  70.779   0.814   2.358
  348    HA   ASN  54           HA       ASN  54  71.695  -0.247   4.833
  349   1HB   ASN  54          2HB       ASN  54  73.156   1.001   2.499
  350   2HB   ASN  54          1HB       ASN  54  73.967   0.259   3.882
  351   1HD2  ASN  54          1HD2      ASN  54  72.095  -0.274   1.025
  352   2HD2  ASN  54          2HD2      ASN  54  72.330  -1.981   0.936
  353    H    ASN  55           H        ASN  55  70.967   2.935   3.787
  354    HA   ASN  55           HA       ASN  55  72.689   4.197   5.707
  355   1HB   ASN  55          2HB       ASN  55  72.152   6.225   4.756
  356   2HB   ASN  55          1HB       ASN  55  72.005   5.127   3.390
  357   1HD2  ASN  55          1HD2      ASN  55  70.807   7.723   3.904
  358   2HD2  ASN  55          2HD2      ASN  55  69.107   7.481   3.807
  359    H    GLY  56           H        GLY  56  69.568   2.876   5.685
  360   1HA   GLY  56          2HA       GLY  56  68.665   2.697   8.017
  361   2HA   GLY  56          1HA       GLY  56  68.863   4.438   8.089
  362    H    ARG  57           H        ARG  57  67.895   4.211   5.034
  363    HA   ARG  57           HA       ARG  57  65.184   4.886   5.593
  364   1HB   ARG  57          2HB       ARG  57  66.420   4.038   2.974
  365   2HB   ARG  57          1HB       ARG  57  64.842   4.769   3.160
  366   1HG   ARG  57          2HG       ARG  57  65.720   6.855   3.624
  367   2HG   ARG  57          1HG       ARG  57  67.311   6.195   4.048
  368   1HD   ARG  57          2HD       ARG  57  67.584   5.435   1.723
  369   2HD   ARG  57          1HD       ARG  57  66.047   6.189   1.310
  370    HE   ARG  57           HE       ARG  57  68.581   7.550   1.893
  371   1HH1  ARG  57          1HH1      ARG  57  65.188   7.771   1.022
  372   2HH1  ARG  57          2HH1      ARG  57  65.331   9.372   0.384
  373   1HH2  ARG  57          1HH2      ARG  57  68.788   9.607   1.036
  374   2HH2  ARG  57          2HH2      ARG  57  67.401  10.421   0.364
  375    H    CYS  58           H        CYS  58  63.289   3.724   5.070
  376    HA   CYS  58           HA       CYS  58  63.652   0.844   4.605
  377   1HB   CYS  58          2HB       CYS  58  61.167   2.305   5.544
  378   2HB   CYS  58          1HB       CYS  58  61.410   0.563   5.476
  379    H    ILE  59           H        ILE  59  63.299   0.207   2.526
  380    HA   ILE  59           HA       ILE  59  62.054   2.252   0.840
  381    HB   ILE  59           HB       ILE  59  63.574   1.695  -0.969
  382   1HG1  ILE  59          2HG1      ILE  59  64.985  -0.064   1.045
  383   2HG1  ILE  59          1HG1      ILE  59  64.015  -0.652  -0.303
  384   1HG2  ILE  59          1HG2      ILE  59  65.599   2.688  -0.008
  385   2HG2  ILE  59          2HG2      ILE  59  64.966   2.394   1.612
  386   3HG2  ILE  59          3HG2      ILE  59  64.138   3.517   0.534
  387   1HD1  ILE  59          1HD1      ILE  59  65.552   0.459  -1.860
  388   2HD1  ILE  59          2HD1      ILE  59  66.345  -0.760  -0.866
  389   3HD1  ILE  59          3HD1      ILE  59  66.551   0.952  -0.491
  390    H    ASN  60           H        ASN  60  61.577   1.414  -1.397
  391    HA   ASN  60           HA       ASN  60  59.544  -0.583  -1.174
  392   1HB   ASN  60          2HB       ASN  60  59.522   1.550  -2.591
  393   2HB   ASN  60          1HB       ASN  60  60.596   0.701  -3.699
  394   1HD2  ASN  60          1HD2      ASN  60  57.403   1.141  -2.594
  395   2HD2  ASN  60          2HD2      ASN  60  56.641   0.023  -3.686
  396    H    ILE  61           H        ILE  61  59.507  -2.651  -2.124
  397    HA   ILE  61           HA       ILE  61  62.059  -3.917  -2.326
  398    HB   ILE  61           HB       ILE  61  59.642  -4.780  -1.568
  399   1HG1  ILE  61          2HG1      ILE  61  61.869  -5.899  -1.235
  400   2HG1  ILE  61          1HG1      ILE  61  60.522  -7.004  -1.460
  401   1HG2  ILE  61          1HG2      ILE  61  58.584  -4.752  -3.693
  402   2HG2  ILE  61          2HG2      ILE  61  58.817  -6.437  -3.229
  403   3HG2  ILE  61          3HG2      ILE  61  59.885  -5.696  -4.417
  404   1HD1  ILE  61          1HD1      ILE  61  61.204  -7.368  -3.767
  405   2HD1  ILE  61          2HD1      ILE  61  62.503  -7.756  -2.638
  406   3HD1  ILE  61          3HD1      ILE  61  62.547  -6.247  -3.550
  407    H    ASN  62           H        ASN  62  60.154  -2.281  -4.600
  408    HA   ASN  62           HA       ASN  62  60.938  -3.904  -6.875
  409   1HB   ASN  62          2HB       ASN  62  59.280  -1.409  -6.581
  410   2HB   ASN  62          1HB       ASN  62  59.785  -1.991  -8.163
  411   1HD2  ASN  62          1HD2      ASN  62  57.673  -2.370  -8.791
  412   2HD2  ASN  62          2HD2      ASN  62  56.748  -3.694  -8.181
  413    H    TRP  63           H        TRP  63  62.941  -2.386  -5.211
  414    HA   TRP  63           HA       TRP  63  64.101  -0.713  -7.338
  415   1HB   TRP  63          2HB       TRP  63  64.645  -0.768  -4.366
  416   2HB   TRP  63          1HB       TRP  63  65.561   0.199  -5.516
  417    HD1  TRP  63           HD1      TRP  63  61.966   0.234  -6.436
  418    HE1  TRP  63           HE1      TRP  63  60.857   2.427  -5.671
  419    HE3  TRP  63           HE3      TRP  63  65.642   1.965  -3.364
  420    HZ2  TRP  63           HZ2      TRP  63  61.459   4.602  -3.987
  421    HZ3  TRP  63           HZ3      TRP  63  65.304   4.107  -2.204
  422    HH2  TRP  63           HH2      TRP  63  63.258   5.399  -2.508
  423    H    ARG  64           H        ARG  64  64.196  -3.722  -6.118
  424    HA   ARG  64           HA       ARG  64  66.945  -4.377  -6.074
  425   1HB   ARG  64          2HB       ARG  64  64.878  -5.717  -5.249
  426   2HB   ARG  64          1HB       ARG  64  64.768  -6.287  -6.905
  427   1HG   ARG  64          2HG       ARG  64  66.003  -7.975  -5.997
  428   2HG   ARG  64          1HG       ARG  64  67.307  -6.897  -6.497
  429   1HD   ARG  64          2HD       ARG  64  67.600  -7.775  -4.192
  430   2HD   ARG  64          1HD       ARG  64  67.516  -6.013  -4.254
  431    HE   ARG  64           HE       ARG  64  64.954  -6.721  -3.776
  432   1HH1  ARG  64          1HH1      ARG  64  67.978  -7.591  -2.233
  433   2HH1  ARG  64          2HH1      ARG  64  67.271  -7.739  -0.661
  434   1HH2  ARG  64          1HH2      ARG  64  64.030  -6.919  -1.702
  435   2HH2  ARG  64          2HH2      ARG  64  65.019  -7.375  -0.357
  436    H    CYS  65           H        CYS  65  67.927  -3.426  -7.869
  437    HA   CYS  65           HA       CYS  65  66.895  -3.795 -10.517
  438   1HB   CYS  65          2HB       CYS  65  69.249  -2.401  -9.340
  439   2HB   CYS  65          1HB       CYS  65  69.293  -2.800 -11.050
  440    H    ASP  66           H        ASP  66  70.173  -4.373  -9.490
  441    HA   ASP  66           HA       ASP  66  70.354  -6.495 -11.488
  442   1HB   ASP  66          2HB       ASP  66  72.843  -6.099 -11.173
  443   2HB   ASP  66          1HB       ASP  66  71.925  -4.749 -11.837
  444    H    ASN  67           H        ASN  67  71.667  -5.877  -8.210
  445    HA   ASN  67           HA       ASN  67  71.599  -8.760  -7.832
  446   1HB   ASN  67          2HB       ASN  67  73.689  -8.803  -6.824
  447   2HB   ASN  67          1HB       ASN  67  73.912  -7.612  -8.099
  448   1HD2  ASN  67          1HD2      ASN  67  73.845  -5.361  -7.518
  449   2HD2  ASN  67          2HD2      ASN  67  74.225  -4.880  -5.894
  450    H    ASP  68           H        ASP  68  71.386  -5.605  -6.177
  451    HA   ASP  68           HA       ASP  68  69.478  -6.924  -4.399
  452   1HB   ASP  68          2HB       ASP  68  71.758  -6.619  -3.280
  453   2HB   ASP  68          1HB       ASP  68  71.407  -4.892  -3.295
  454    H    ASN  69           H        ASN  69  69.227  -4.263  -2.881
  455    HA   ASN  69           HA       ASN  69  66.984  -3.683  -4.711
  456   1HB   ASN  69          2HB       ASN  69  66.767  -4.867  -2.401
  457   2HB   ASN  69          1HB       ASN  69  66.904  -3.237  -1.754
  458   1HD2  ASN  69          1HD2      ASN  69  65.273  -1.725  -2.253
  459   2HD2  ASN  69          2HD2      ASN  69  63.690  -2.238  -2.732
  460    H    ASP  70           H        ASP  70  69.575  -2.066  -4.490
  461    HA   ASP  70           HA       ASP  70  70.072   0.150  -4.836
  462   1HB   ASP  70          2HB       ASP  70  67.827  -0.355  -6.198
  463   2HB   ASP  70          1HB       ASP  70  67.191   0.851  -5.087
  464    H    CYS  71           H        CYS  71  68.638   2.501  -4.327
  465    HA   CYS  71           HA       CYS  71  67.171   2.842  -2.054
  466   1HB   CYS  71          2HB       CYS  71  68.912   1.912  -0.675
  467   2HB   CYS  71          1HB       CYS  71  70.109   2.994  -1.378
  468    H    GLY  72           H        GLY  72  70.256   4.411  -2.948
  469   1HA   GLY  72          2HA       GLY  72  69.821   6.431  -4.495
  470   2HA   GLY  72          1HA       GLY  72  68.792   6.958  -3.172
  471    H    ASP  73           H        ASP  73  70.508   5.981  -1.090
  472    HA   ASP  73           HA       ASP  73  73.069   7.161  -1.448
  473   1HB   ASP  73          2HB       ASP  73  72.984   8.921   0.065
  474   2HB   ASP  73          1HB       ASP  73  71.424   9.060  -0.723
  475    H    ASN  74           H        ASN  74  74.109   5.540  -0.912
  476    HA   ASN  74           HA       ASN  74  75.157   3.935   0.349
  477   1HB   ASN  74          2HB       ASN  74  73.201   4.672   2.550
  478   2HB   ASN  74          1HB       ASN  74  74.563   3.573   2.727
  479   1HD2  ASN  74          1HD2      ASN  74  73.528   6.859   2.547
  480   2HD2  ASN  74          2HD2      ASN  74  75.057   7.574   2.925
  481    H    SER  75           H        SER  75  73.768   3.120  -1.510
  482    HA   SER  75           HA       SER  75  71.371   1.678  -0.756
  483   1HB   SER  75          2HB       SER  75  72.570   1.790  -3.487
  484   2HB   SER  75          1HB       SER  75  70.876   1.682  -3.013
  485    HG   SER  75           HG       SER  75  72.047   3.840  -3.719
  486    H    ASP  76           H        ASP  76  71.185  -0.339  -2.419
  487    HA   ASP  76           HA       ASP  76  72.726  -2.519  -1.867
  488   1HB   ASP  76          2HB       ASP  76  70.872  -2.884  -3.235
  489   2HB   ASP  76          1HB       ASP  76  71.316  -1.599  -4.353
  490    H    GLU  77           H        GLU  77  73.156  -0.621  -4.846
  491    HA   GLU  77           HA       GLU  77  76.035  -1.123  -4.720
  492   1HB   GLU  77          2HB       GLU  77  75.652  -0.295  -7.270
  493   2HB   GLU  77          1HB       GLU  77  75.607  -1.975  -6.764
  494   1HG   GLU  77          2HG       GLU  77  73.733  -1.443  -8.221
  495   2HG   GLU  77          1HG       GLU  77  73.176  -1.881  -6.609
  496    H    ALA  78           H        ALA  78  73.754   1.349  -5.736
  497    HA   ALA  78           HA       ALA  78  75.116   3.485  -4.476
  498   1HB   ALA  78          1HB       ALA  78  75.505   3.333  -7.466
  499   2HB   ALA  78          2HB       ALA  78  76.764   3.090  -6.256
  500   3HB   ALA  78          3HB       ALA  78  75.990   4.667  -6.417
  501    H    GLY  79           H        GLY  79  73.200   2.732  -7.405
  502   1HA   GLY  79          2HA       GLY  79  70.811   3.853  -6.708
  503   2HA   GLY  79          1HA       GLY  79  71.763   5.227  -7.253
  504    H    CYS  80           H        CYS  80  70.319   2.188  -8.179
  505    HA   CYS  80           HA       CYS  80  70.819   2.674 -11.012
  506   1HB   CYS  80          2HB       CYS  80  71.105   0.411 -10.527
  507   2HB   CYS  80          1HB       CYS  80  69.771   0.383  -9.379
  508    H    SER  81           H        SER  81  68.183   2.470  -8.689
  509    HA   SER  81           HA       SER  81  66.120   2.906 -10.622
  510   1HB   SER  81          2HB       SER  81  65.753   1.679  -8.496
  511   2HB   SER  81          1HB       SER  81  66.018   3.179  -7.608
  512    HG   SER  81           HG       SER  81  64.194   4.047  -8.656
  513    H    HIS  82           HN       HIS  82  65.371   4.754 -11.408
  514    HA   HIS  82           HA       HIS  82  65.692   7.226  -9.901
  515   1HB   HIS  82          2HB       HIS  82  67.645   7.044 -11.459
  516   2HB   HIS  82          1HB       HIS  82  66.518   6.977 -12.809
  517    HD1  HIS  82           HD1      HIS  82  64.896   9.229 -12.937
  518    HD2  HIS  82           HD2      HIS  82  68.473   9.527 -10.847
  519    HE1  HIS  82           HE1      HIS  82  65.423  11.701 -12.778
  Start of MODEL    9
    1   1H    SER   1          1HT       SER   1  38.124 -10.874   3.248
    2   2H    SER   1          2HT       SER   1  36.598 -10.159   3.400
    3   3H    SER   1          3HT       SER   1  37.782  -9.876   4.571
    4    HA   SER   1           HA       SER   1  39.136  -8.694   3.013
    5   1HB   SER   1          2HB       SER   1  36.877  -9.132   1.045
    6   2HB   SER   1          1HB       SER   1  38.425  -8.341   0.733
    7    HG   SER   1           HG       SER   1  38.521 -10.461  -0.006
    8    H    ALA   2           H        ALA   2  38.492  -6.446   2.078
    9    HA   ALA   2           HA       ALA   2  36.028  -5.421   3.261
   10   1HB   ALA   2          1HB       ALA   2  37.745  -5.124   4.992
   11   2HB   ALA   2          2HB       ALA   2  37.192  -3.571   4.360
   12   3HB   ALA   2          3HB       ALA   2  38.747  -4.232   3.847
   13    H    ARG   3           H        ARG   3  36.349  -2.754   2.749
   14    HA   ARG   3           HA       ARG   3  36.431  -2.743  -0.165
   15   1HB   ARG   3          2HB       ARG   3  35.217  -0.725  -0.096
   16   2HB   ARG   3          1HB       ARG   3  34.555  -1.676   1.222
   17   1HG   ARG   3          2HG       ARG   3  35.872  -0.407   2.822
   18   2HG   ARG   3          1HG       ARG   3  36.587   0.526   1.503
   19   1HD   ARG   3          2HD       ARG   3  34.194   1.153   0.882
   20   2HD   ARG   3          1HD       ARG   3  33.735   0.509   2.458
   21    HE   ARG   3           HE       ARG   3  35.855   2.439   2.600
   22   1HH1  ARG   3          1HH1      ARG   3  32.388   2.016   2.462
   23   2HH1  ARG   3          2HH1      ARG   3  32.035   3.566   3.147
   24   1HH2  ARG   3          1HH2      ARG   3  35.410   4.514   3.482
   25   2HH2  ARG   3          2HH2      ARG   3  33.760   4.992   3.726
   26    H    THR   4           H        THR   4  38.744  -2.713   1.882
   27    HA   THR   4           HA       THR   4  40.108  -0.229   1.366
   28    HB   THR   4           HB       THR   4  41.416  -2.654   2.564
   29    HG1  THR   4           HG1      THR   4  40.378  -1.613   4.599
   30   1HG2  THR   4          1HG2      THR   4  42.709  -0.570   2.298
   31   2HG2  THR   4          2HG2      THR   4  42.480  -0.984   3.996
   32   3HG2  THR   4          3HG2      THR   4  41.508   0.291   3.262
   33    H    CYS   5           H        CYS   5  39.455  -1.718  -0.984
   34    HA   CYS   5           HA       CYS   5  40.293  -2.426  -2.946
   35   1HB   CYS   5          2HB       CYS   5  42.793  -1.336  -1.707
   36   2HB   CYS   5          1HB       CYS   5  42.870  -2.210  -3.239
   37    HA   PRO   6           HA       PRO   6  41.153  -6.688  -2.385
   38   1HB   PRO   6          2HB       PRO   6  42.687  -6.864  -4.860
   39   2HB   PRO   6          1HB       PRO   6  41.087  -7.508  -4.495
   40   1HG   PRO   6          2HG       PRO   6  41.543  -5.436  -6.202
   41   2HG   PRO   6          1HG       PRO   6  40.026  -5.664  -5.316
   42   1HD   PRO   6          2HD       PRO   6  42.272  -3.779  -4.798
   43   2HD   PRO   6          1HD       PRO   6  40.531  -3.564  -4.527
   44    HA   PRO   7           HA       PRO   7  45.191  -7.571  -0.724
   45   1HB   PRO   7          2HB       PRO   7  45.140 -10.038  -2.410
   46   2HB   PRO   7          1HB       PRO   7  45.462  -9.866  -0.680
   47   1HG   PRO   7          2HG       PRO   7  43.116 -10.793  -1.517
   48   2HG   PRO   7          1HG       PRO   7  43.207  -9.675  -0.144
   49   1HD   PRO   7          2HD       PRO   7  42.372  -9.150  -2.963
   50   2HD   PRO   7          1HD       PRO   7  41.738  -8.471  -1.450
   51    H    ASN   8           H        ASN   8  47.263  -7.202  -1.256
   52    HA   ASN   8           HA       ASN   8  49.165  -6.851  -2.451
   53   1HB   ASN   8          2HB       ASN   8  48.480  -8.718  -3.978
   54   2HB   ASN   8          1HB       ASN   8  47.652  -7.532  -4.978
   55   1HD2  ASN   8          1HD2      ASN   8  48.835  -6.242  -6.338
   56   2HD2  ASN   8          2HD2      ASN   8  50.531  -6.430  -6.586
   57    H    GLN   9           H        GLN   9  46.246  -5.285  -2.721
   58    HA   GLN   9           HA       GLN   9  47.733  -2.871  -3.361
   59   1HB   GLN   9          2HB       GLN   9  45.794  -1.943  -4.647
   60   2HB   GLN   9          1HB       GLN   9  46.682  -3.221  -5.456
   61   1HG   GLN   9          2HG       GLN   9  44.383  -4.137  -3.908
   62   2HG   GLN   9          1HG       GLN   9  43.985  -3.061  -5.245
   63   1HE2  GLN   9          1HE2      GLN   9  46.722  -5.195  -5.224
   64   2HE2  GLN   9          2HE2      GLN   9  46.153  -6.278  -6.439
   65    H    PHE  10           H        PHE  10  46.218  -0.898  -2.882
   66    HA   PHE  10           HA       PHE  10  44.862  -1.336  -0.325
   67   1HB   PHE  10          2HB       PHE  10  47.132  -0.991   0.351
   68   2HB   PHE  10          1HB       PHE  10  47.348   0.307  -0.811
   69    HD1  PHE  10           HD1      PHE  10  47.526   2.387   0.045
   70    HD2  PHE  10           HD2      PHE  10  45.084  -0.462   2.068
   71    HE1  PHE  10           HE1      PHE  10  47.010   4.055   1.791
   72    HE2  PHE  10           HE2      PHE  10  44.575   1.202   3.813
   73    HZ   PHE  10           HZ       PHE  10  45.541   3.461   3.672
   74    H    SER  11           H        SER  11  43.547   0.501   0.295
   75    HA   SER  11           HA       SER  11  42.848   2.132  -2.005
   76   1HB   SER  11          2HB       SER  11  40.617   2.327  -1.059
   77   2HB   SER  11          1HB       SER  11  41.069   0.624  -1.143
   78    HG   SER  11           HG       SER  11  41.660   2.014   1.208
   79    H    CYS  12           H        CYS  12  43.837   4.052  -1.861
   80    HA   CYS  12           HA       CYS  12  44.330   5.493   0.485
   81   1HB   CYS  12          2HB       CYS  12  43.785   6.454  -2.320
   82   2HB   CYS  12          1HB       CYS  12  44.131   7.564  -0.999
   83    H    ALA  13           H        ALA  13  43.135   7.247   1.431
   84    HA   ALA  13           HA       ALA  13  41.004   6.463   2.706
   85   1HB   ALA  13          1HB       ALA  13  42.118   8.603   3.097
   86   2HB   ALA  13          2HB       ALA  13  40.361   8.745   3.158
   87   3HB   ALA  13          3HB       ALA  13  41.243   9.296   1.732
   88    H    SER  14           H        SER  14  39.602   5.197   1.663
   89    HA   SER  14           HA       SER  14  37.724   4.577   0.571
   90   1HB   SER  14          2HB       SER  14  36.831   7.279   1.592
   91   2HB   SER  14          1HB       SER  14  35.764   5.955   1.116
   92    HG   SER  14           HG       SER  14  37.525   6.117   3.321
   93    H    GLY  15           H        GLY  15  38.801   4.724  -1.557
   94   1HA   GLY  15          2HA       GLY  15  37.048   5.335  -3.479
   95   2HA   GLY  15          1HA       GLY  15  37.812   6.896  -3.225
   96    H    ARG  16           H        ARG  16  40.451   5.849  -2.715
   97    HA   ARG  16           HA       ARG  16  41.149   5.479  -5.520
   98   1HB   ARG  16          2HB       ARG  16  42.908   6.152  -3.155
   99   2HB   ARG  16          1HB       ARG  16  43.450   6.055  -4.823
  100   1HG   ARG  16          2HG       ARG  16  43.186   8.342  -4.400
  101   2HG   ARG  16          1HG       ARG  16  41.750   7.887  -5.315
  102   1HD   ARG  16          2HD       ARG  16  40.501   7.688  -3.184
  103   2HD   ARG  16          1HD       ARG  16  41.931   8.254  -2.322
  104    HE   ARG  16           HE       ARG  16  41.486  10.204  -4.151
  105   1HH1  ARG  16          1HH1      ARG  16  39.475   8.689  -1.709
  106   2HH1  ARG  16          2HH1      ARG  16  38.470  10.079  -1.490
  107   1HH2  ARG  16          1HH2      ARG  16  40.158  12.057  -3.842
  108   2HH2  ARG  16          2HH2      ARG  16  38.854  11.986  -2.706
  109    H    CYS  17           H        CYS  17  43.196   4.058  -5.861
  110    HA   CYS  17           HA       CYS  17  43.252   1.684  -4.190
  111   1HB   CYS  17          2HB       CYS  17  41.389   1.635  -6.132
  112   2HB   CYS  17          1HB       CYS  17  42.789   1.101  -7.065
  113    H    ILE  18           H        ILE  18  45.361   1.371  -3.972
  114    HA   ILE  18           HA       ILE  18  47.157   1.993  -6.230
  115    HB   ILE  18           HB       ILE  18  48.753   2.945  -4.705
  116   1HG1  ILE  18          2HG1      ILE  18  47.705   3.194  -2.220
  117   2HG1  ILE  18          1HG1      ILE  18  47.066   1.615  -2.665
  118   1HG2  ILE  18          1HG2      ILE  18  46.966   4.456  -5.394
  119   2HG2  ILE  18          2HG2      ILE  18  47.520   4.835  -3.761
  120   3HG2  ILE  18          3HG2      ILE  18  46.005   3.966  -3.997
  121   1HD1  ILE  18          1HD1      ILE  18  49.404   0.914  -3.188
  122   2HD1  ILE  18          2HD1      ILE  18  49.109   1.299  -1.495
  123   3HD1  ILE  18          3HD1      ILE  18  49.951   2.455  -2.526
  124    HA   PRO  19           HA       PRO  19  48.821  -2.128  -5.484
  125   1HB   PRO  19          2HB       PRO  19  51.369  -1.078  -6.530
  126   2HB   PRO  19          1HB       PRO  19  50.348  -2.375  -7.161
  127   1HG   PRO  19          2HG       PRO  19  50.553  -0.009  -8.411
  128   2HG   PRO  19          1HG       PRO  19  49.035  -0.925  -8.390
  129   1HD   PRO  19          2HD       PRO  19  49.838   1.450  -6.746
  130   2HD   PRO  19          1HD       PRO  19  48.278   1.089  -7.516
  131    H    ILE  20           H        ILE  20  49.722  -2.960  -3.640
  132    HA   ILE  20           HA       ILE  20  50.853  -1.239  -1.678
  133    HB   ILE  20           HB       ILE  20  51.059  -4.229  -1.777
  134   1HG1  ILE  20          2HG1      ILE  20  48.694  -3.190  -1.837
  135   2HG1  ILE  20          1HG1      ILE  20  49.024  -4.421  -0.622
  136   1HG2  ILE  20          1HG2      ILE  20  51.305  -4.055   0.667
  137   2HG2  ILE  20          2HG2      ILE  20  51.315  -2.299   0.512
  138   3HG2  ILE  20          3HG2      ILE  20  52.610  -3.256  -0.210
  139   1HD1  ILE  20          1HD1      ILE  20  49.373  -2.672   1.044
  140   2HD1  ILE  20          2HD1      ILE  20  47.769  -2.580   0.316
  141   3HD1  ILE  20          3HD1      ILE  20  49.029  -1.448  -0.178
  142    H    SER  21           H        SER  21  52.566  -0.302  -2.995
  143    HA   SER  21           HA       SER  21  55.051  -1.636  -2.288
  144   1HB   SER  21          2HB       SER  21  54.707  -2.237  -4.662
  145   2HB   SER  21          1HB       SER  21  54.492  -0.538  -5.062
  146    HG   SER  21           HG       SER  21  56.745  -0.489  -3.912
  147    H    TRP  22           H        TRP  22  53.055   0.739  -1.958
  148    HA   TRP  22           HA       TRP  22  55.064   2.909  -2.060
  149   1HB   TRP  22          2HB       TRP  22  52.111   3.314  -2.518
  150   2HB   TRP  22          1HB       TRP  22  53.396   4.484  -2.763
  151    HD1  TRP  22           HD1      TRP  22  55.034   1.892  -4.370
  152    HE1  TRP  22           HE1      TRP  22  54.430   1.630  -6.841
  153    HE3  TRP  22           HE3      TRP  22  50.696   4.591  -4.430
  154    HZ2  TRP  22           HZ2      TRP  22  52.400   2.488  -8.619
  155    HZ3  TRP  22           HZ3      TRP  22  49.489   4.839  -6.562
  156    HH2  TRP  22           HH2      TRP  22  50.324   3.809  -8.617
  157    H    THR  23           H        THR  23  52.700   1.320  -0.193
  158    HA   THR  23           HA       THR  23  51.806   3.473   1.388
  159    HB   THR  23           HB       THR  23  50.830   1.600   2.776
  160    HG1  THR  23           HG1      THR  23  52.636   0.220   1.313
  161   1HG2  THR  23          1HG2      THR  23  50.366   1.558  -0.200
  162   2HG2  THR  23          2HG2      THR  23  49.580   2.632   0.957
  163   3HG2  THR  23          3HG2      THR  23  49.270   0.896   1.009
  164    H    CYS  24           H        CYS  24  52.640   0.698   3.089
  165    HA   CYS  24           HA       CYS  24  53.679   2.141   5.274
  166   1HB   CYS  24          2HB       CYS  24  53.409  -0.791   4.671
  167   2HB   CYS  24          1HB       CYS  24  53.857  -0.151   6.248
  168    H    ASP  25           H        ASP  25  55.520   2.778   3.412
  169    HA   ASP  25           HA       ASP  25  57.884   1.358   4.350
  170   1HB   ASP  25          2HB       ASP  25  58.745   1.053   2.045
  171   2HB   ASP  25          1HB       ASP  25  57.330   0.074   2.402
  172    H    LEU  26           H        LEU  26  56.644   4.078   4.506
  173    HA   LEU  26           HA       LEU  26  57.541   6.086   5.023
  174   1HB   LEU  26          2HB       LEU  26  60.125   4.860   4.082
  175   2HB   LEU  26          1HB       LEU  26  60.005   6.473   4.757
  176    HG   LEU  26           HG       LEU  26  59.341   3.904   6.210
  177   1HD1  LEU  26          1HD1      LEU  26  61.339   4.419   7.535
  178   2HD1  LEU  26          2HD1      LEU  26  61.673   5.798   6.488
  179   3HD1  LEU  26          3HD1      LEU  26  61.730   4.163   5.833
  180   1HD2  LEU  26          1HD2      LEU  26  59.402   6.758   7.181
  181   2HD2  LEU  26          2HD2      LEU  26  59.149   5.329   8.185
  182   3HD2  LEU  26          3HD2      LEU  26  57.962   5.768   6.956
  183    H    ASP  27           H        ASP  27  56.536   5.315   2.283
  184    HA   ASP  27           HA       ASP  27  57.542   7.786   1.031
  185   1HB   ASP  27          2HB       ASP  27  57.977   5.572  -0.232
  186   2HB   ASP  27          1HB       ASP  27  56.249   5.583  -0.566
  187    H    ASP  28           H        ASP  28  55.560   8.264  -0.811
  188    HA   ASP  28           HA       ASP  28  53.277   8.734   0.993
  189   1HB   ASP  28          2HB       ASP  28  54.732  10.713   0.950
  190   2HB   ASP  28          1HB       ASP  28  54.627  10.758  -0.803
  191    H    ASP  29           H        ASP  29  51.793   7.410   0.016
  192    HA   ASP  29           HA       ASP  29  51.209   8.042  -2.795
  193   1HB   ASP  29          2HB       ASP  29  50.347   5.826  -3.124
  194   2HB   ASP  29          1HB       ASP  29  51.950   5.696  -2.414
  195    H    CYS  30           H        CYS  30  49.836   7.452   0.351
  196    HA   CYS  30           HA       CYS  30  47.285   8.542  -0.629
  197   1HB   CYS  30          2HB       CYS  30  47.850   6.938   1.872
  198   2HB   CYS  30          1HB       CYS  30  46.287   7.632   1.456
  199    H    GLY  31           H        GLY  31  49.964   9.098   1.486
  200   1HA   GLY  31          2HA       GLY  31  50.607  11.261   2.138
  201   2HA   GLY  31          1HA       GLY  31  48.960  11.811   1.864
  202    H    ASP  32           H        ASP  32  50.601   9.420   3.940
  203    HA   ASP  32           HA       ASP  32  50.747   9.222   6.207
  204   1HB   ASP  32          2HB       ASP  32  51.120  11.501   6.592
  205   2HB   ASP  32          1HB       ASP  32  49.501  11.953   6.079
  206    H    ARG  33           H        ARG  33  47.770   9.640   4.614
  207    HA   ARG  33           HA       ARG  33  46.120   8.890   6.862
  208   1HB   ARG  33          2HB       ARG  33  45.373   9.197   3.955
  209   2HB   ARG  33          1HB       ARG  33  44.259   9.090   5.312
  210   1HG   ARG  33          2HG       ARG  33  46.300  11.263   5.000
  211   2HG   ARG  33          1HG       ARG  33  44.643  11.390   4.410
  212   1HD   ARG  33          2HD       ARG  33  44.621  12.454   6.506
  213   2HD   ARG  33          1HD       ARG  33  43.920  10.863   6.796
  214    HE   ARG  33           HE       ARG  33  46.784  11.278   7.331
  215   1HH1  ARG  33          1HH1      ARG  33  43.548  10.764   8.574
  216   2HH1  ARG  33          2HH1      ARG  33  44.091  10.333  10.157
  217   1HH2  ARG  33          1HH2      ARG  33  47.508  10.751   9.385
  218   2HH2  ARG  33          2HH2      ARG  33  46.364  10.324  10.630
  219    H    SER  34           H        SER  34  47.183   6.897   7.270
  220    HA   SER  34           HA       SER  34  46.695   4.699   7.622
  221   1HB   SER  34          2HB       SER  34  45.036   4.891   5.106
  222   2HB   SER  34          1HB       SER  34  45.155   3.458   6.128
  223    HG   SER  34           HG       SER  34  44.154   4.542   7.768
  224    H    ASP  35           H        ASP  35  48.174   6.068   4.931
  225    HA   ASP  35           HA       ASP  35  49.267   3.545   4.003
  226   1HB   ASP  35          2HB       ASP  35  50.504   4.940   2.370
  227   2HB   ASP  35          1HB       ASP  35  48.766   5.200   2.316
  228    H    GLU  36           H        GLU  36  50.305   6.369   5.747
  229    HA   GLU  36           HA       GLU  36  52.849   5.014   6.304
  230   1HB   GLU  36          2HB       GLU  36  52.090   7.854   6.015
  231   2HB   GLU  36          1HB       GLU  36  53.269   7.491   7.271
  232   1HG   GLU  36          2HG       GLU  36  53.529   6.604   4.415
  233   2HG   GLU  36          1HG       GLU  36  54.254   8.071   5.070
  234    H    SER  37           H        SER  37  52.491   3.754   7.948
  235    HA   SER  37           HA       SER  37  52.611   3.178  10.138
  236   1HB   SER  37          2HB       SER  37  53.852   5.291  10.459
  237   2HB   SER  37          1HB       SER  37  52.326   6.127  10.749
  238    HG   SER  37           HG       SER  37  52.194   4.200  12.410
  239    H    ALA  38           H        ALA  38  49.948   5.108   9.047
  240    HA   ALA  38           HA       ALA  38  48.296   4.559  11.348
  241   1HB   ALA  38          1HB       ALA  38  47.587   5.780   8.686
  242   2HB   ALA  38          2HB       ALA  38  48.055   6.657  10.143
  243   3HB   ALA  38          3HB       ALA  38  46.551   5.740  10.115
  244    H    SER  39           H        SER  39  49.310   2.252  10.085
  245    HA   SER  39           HA       SER  39  46.945   0.694   9.984
  246   1HB   SER  39          2HB       SER  39  46.903   1.580   7.661
  247   2HB   SER  39          1HB       SER  39  48.510   0.908   7.390
  248    HG   SER  39           HG       SER  39  47.529  -0.870   6.888
  249    H    CYS  40           H        CYS  40  50.278   0.688   8.736
  250    HA   CYS  40           HA       CYS  40  50.727  -1.947   9.891
  251   1HB   CYS  40          2HB       CYS  40  52.660  -0.251   8.311
  252   2HB   CYS  40          1HB       CYS  40  52.768  -1.976   8.629
  253    H    ALA  41           H        ALA  41  51.973  -2.313  11.652
  254    HA   ALA  41           HA       ALA  41  52.550  -0.063  13.340
  255   1HB   ALA  41          1HB       ALA  41  53.146  -1.740  15.012
  256   2HB   ALA  41          2HB       ALA  41  53.058  -3.002  13.780
  257   3HB   ALA  41          3HB       ALA  41  51.601  -2.122  14.246
  258    H    TYR  42           H        TYR  42  54.271  -1.740  11.004
  259    HA   TYR  42           HA       TYR  42  56.400  -1.724  10.247
  260   1HB   TYR  42          2HB       TYR  42  56.643   0.689  12.053
  261   2HB   TYR  42          1HB       TYR  42  57.867   0.192  10.892
  262    HD1  TYR  42           HD1      TYR  42  56.939   2.874  10.657
  263    HD2  TYR  42           HD2      TYR  42  55.126  -0.675   9.165
  264    HE1  TYR  42           HE1      TYR  42  55.783   4.191   8.925
  265    HE2  TYR  42           HE2      TYR  42  53.976   0.633   7.442
  266    HH   TYR  42           HH       TYR  42  54.756   3.829   6.673
  267    HA   PRO  43           HA       PRO  43  58.176  -4.002  13.823
  268   1HB   PRO  43          2HB       PRO  43  58.744  -6.039  11.810
  269   2HB   PRO  43          1HB       PRO  43  57.812  -6.183  13.300
  270   1HG   PRO  43          2HG       PRO  43  56.674  -6.290  10.841
  271   2HG   PRO  43          1HG       PRO  43  55.831  -5.664  12.270
  272   1HD   PRO  43          2HD       PRO  43  57.162  -4.166  10.043
  273   2HD   PRO  43          1HD       PRO  43  55.631  -3.818  10.876
  274    H    THR  44           H        THR  44  59.134  -3.565  10.496
  275    HA   THR  44           HA       THR  44  61.603  -2.354  11.068
  276    HB   THR  44           HB       THR  44  62.328  -4.649  11.632
  277    HG1  THR  44           HG1      THR  44  63.360  -3.522   9.236
  278   1HG2  THR  44          1HG2      THR  44  62.393  -6.407   9.930
  279   2HG2  THR  44          2HG2      THR  44  61.562  -5.346   8.790
  280   3HG2  THR  44          3HG2      THR  44  60.736  -5.898  10.248
  281    H    CYS  45           H        CYS  45  59.272  -1.880   9.589
  282    HA   CYS  45           HA       CYS  45  58.359  -1.416   7.568
  283   1HB   CYS  45          2HB       CYS  45  61.229  -1.664   6.638
  284   2HB   CYS  45          1HB       CYS  45  59.909  -1.144   5.600
  285    H    PHE  46           H        PHE  46  58.870  -2.459   5.034
  286    HA   PHE  46           HA       PHE  46  58.565  -4.238   3.696
  287   1HB   PHE  46          2HB       PHE  46  60.768  -4.889   4.488
  288   2HB   PHE  46          1HB       PHE  46  60.063  -5.675   5.895
  289    HD1  PHE  46           HD1      PHE  46  60.832  -7.870   5.570
  290    HD2  PHE  46           HD2      PHE  46  58.786  -5.856   2.429
  291    HE1  PHE  46           HE1      PHE  46  60.663  -9.983   4.329
  292    HE2  PHE  46           HE2      PHE  46  58.618  -7.965   1.181
  293    HZ   PHE  46           HZ       PHE  46  59.559 -10.039   2.131
  294    HA   PRO  47           HA       PRO  47  54.994  -6.276   5.596
  295   1HB   PRO  47          2HB       PRO  47  53.037  -4.432   5.249
  296   2HB   PRO  47          1HB       PRO  47  54.018  -4.517   6.715
  297   1HG   PRO  47          2HG       PRO  47  53.994  -2.483   4.645
  298   2HG   PRO  47          1HG       PRO  47  54.782  -2.449   6.228
  299   1HD   PRO  47          2HD       PRO  47  55.924  -3.073   3.595
  300   2HD   PRO  47          1HD       PRO  47  56.754  -2.666   5.112
  301    H    LEU  48           H        LEU  48  56.241  -5.430   2.836
  302    HA   LEU  48           HA       LEU  48  54.104  -6.478   1.185
  303   1HB   LEU  48          2HB       LEU  48  54.784  -4.584  -0.509
  304   2HB   LEU  48          1HB       LEU  48  53.549  -4.316   0.708
  305    HG   LEU  48           HG       LEU  48  56.038  -3.644   1.866
  306   1HD1  LEU  48          1HD1      LEU  48  55.581  -2.272  -0.777
  307   2HD1  LEU  48          2HD1      LEU  48  56.870  -3.427  -0.454
  308   3HD1  LEU  48          3HD1      LEU  48  56.831  -1.881   0.398
  309   1HD2  LEU  48          1HD2      LEU  48  53.746  -1.913   0.919
  310   2HD2  LEU  48          2HD2      LEU  48  55.001  -1.424   2.057
  311   3HD2  LEU  48          3HD2      LEU  48  53.871  -2.705   2.491
  312    H    THR  49           H        THR  49  57.198  -4.860   0.558
  313    HA   THR  49           HA       THR  49  58.721  -7.069  -0.074
  314    HB   THR  49           HB       THR  49  57.107  -7.509  -1.860
  315    HG1  THR  49           HG1      THR  49  58.611  -7.829  -3.427
  316   1HG2  THR  49          1HG2      THR  49  56.313  -5.234  -2.274
  317   2HG2  THR  49          2HG2      THR  49  56.839  -6.021  -3.761
  318   3HG2  THR  49          3HG2      THR  49  57.873  -4.822  -2.987
  319    H    GLN  50           H        GLN  50  60.427  -6.049   0.695
  320    HA   GLN  50           HA       GLN  50  61.222  -3.448  -0.368
  321   1HB   GLN  50          2HB       GLN  50  60.689  -4.063   2.540
  322   2HB   GLN  50          1HB       GLN  50  61.617  -2.675   2.000
  323   1HG   GLN  50          2HG       GLN  50  58.760  -3.199   1.231
  324   2HG   GLN  50          1HG       GLN  50  59.264  -2.180   2.580
  325   1HE2  GLN  50          1HE2      GLN  50  60.376  -0.249   2.136
  326   2HE2  GLN  50          2HE2      GLN  50  60.243   0.535   0.604
  327    H    PHE  51           H        PHE  51  63.387  -2.884   0.105
  328    HA   PHE  51           HA       PHE  51  65.069  -5.030   1.225
  329   1HB   PHE  51          2HB       PHE  51  65.621  -4.256  -1.100
  330   2HB   PHE  51          1HB       PHE  51  65.903  -2.644  -0.462
  331    HD1  PHE  51           HD1      PHE  51  67.189  -6.065  -0.664
  332    HD2  PHE  51           HD2      PHE  51  67.917  -2.136   0.771
  333    HE1  PHE  51           HE1      PHE  51  69.532  -6.660  -0.216
  334    HE2  PHE  51           HE2      PHE  51  70.248  -2.713   1.220
  335    HZ   PHE  51           HZ       PHE  51  71.070  -4.984   0.727
  336    H    THR  52           H        THR  52  66.830  -4.216   2.703
  337    HA   THR  52           HA       THR  52  65.725  -2.063   4.352
  338    HB   THR  52           HB       THR  52  67.665  -4.221   5.203
  339    HG1  THR  52           HG1      THR  52  65.403  -4.751   6.298
  340   1HG2  THR  52          1HG2      THR  52  65.927  -2.313   6.779
  341   2HG2  THR  52          2HG2      THR  52  67.681  -2.227   6.609
  342   3HG2  THR  52          3HG2      THR  52  66.944  -3.581   7.465
  343    H    CYS  53           H        CYS  53  66.678  -0.223   3.810
  344    HA   CYS  53           HA       CYS  53  69.289   0.124   2.844
  345   1HB   CYS  53          2HB       CYS  53  67.553   1.767   2.505
  346   2HB   CYS  53          1HB       CYS  53  67.393   2.016   4.240
  347    H    ASN  54           H        ASN  54  71.206   0.116   3.846
  348    HA   ASN  54           HA       ASN  54  71.471  -0.629   6.530
  349   1HB   ASN  54          2HB       ASN  54  73.806  -0.566   6.224
  350   2HB   ASN  54          1HB       ASN  54  73.154  -0.982   4.646
  351   1HD2  ASN  54          1HD2      ASN  54  72.364   1.612   3.835
  352   2HD2  ASN  54          2HD2      ASN  54  73.778   2.572   3.610
  353    H    ASN  55           H        ASN  55  71.151   2.510   5.142
  354    HA   ASN  55           HA       ASN  55  72.444   3.966   7.193
  355   1HB   ASN  55          2HB       ASN  55  71.787   4.650   4.750
  356   2HB   ASN  55          1HB       ASN  55  70.272   5.140   5.500
  357   1HD2  ASN  55          1HD2      ASN  55  73.649   5.748   5.191
  358   2HD2  ASN  55          2HD2      ASN  55  73.664   7.286   5.991
  359    H    GLY  56           H        GLY  56  69.678   2.166   7.279
  360   1HA   GLY  56          2HA       GLY  56  68.572   2.019   9.436
  361   2HA   GLY  56          1HA       GLY  56  68.647   3.773   9.528
  362    H    ARG  57           H        ARG  57  67.901   3.384   6.437
  363    HA   ARG  57           HA       ARG  57  65.049   3.685   6.984
  364   1HB   ARG  57          2HB       ARG  57  66.337   3.947   4.276
  365   2HB   ARG  57          1HB       ARG  57  64.798   4.594   4.814
  366   1HG   ARG  57          2HG       ARG  57  65.981   6.505   4.893
  367   2HG   ARG  57          1HG       ARG  57  66.422   5.893   6.491
  368   1HD   ARG  57          2HD       ARG  57  68.484   5.036   5.685
  369   2HD   ARG  57          1HD       ARG  57  68.020   5.315   4.008
  370    HE   ARG  57           HE       ARG  57  68.409   7.556   5.875
  371   1HH1  ARG  57          1HH1      ARG  57  69.206   5.873   2.906
  372   2HH1  ARG  57          2HH1      ARG  57  70.204   7.151   2.297
  373   1HH2  ARG  57          1HH2      ARG  57  69.741   9.246   5.076
  374   2HH2  ARG  57          2HH2      ARG  57  70.509   9.068   3.534
  375    H    CYS  58           H        CYS  58  63.652   2.774   5.092
  376    HA   CYS  58           HA       CYS  58  64.620   0.118   4.276
  377   1HB   CYS  58          2HB       CYS  58  62.125  -0.481   4.277
  378   2HB   CYS  58          1HB       CYS  58  62.913  -0.341   5.845
  379    H    ILE  59           H        ILE  59  64.571  -0.217   2.118
  380    HA   ILE  59           HA       ILE  59  63.425   1.968   0.528
  381    HB   ILE  59           HB       ILE  59  65.106   1.267  -1.235
  382   1HG1  ILE  59          2HG1      ILE  59  66.421  -0.085   1.131
  383   2HG1  ILE  59          1HG1      ILE  59  65.635  -0.930  -0.196
  384   1HG2  ILE  59          1HG2      ILE  59  66.926   2.541  -0.171
  385   2HG2  ILE  59          2HG2      ILE  59  66.090   2.409   1.376
  386   3HG2  ILE  59          3HG2      ILE  59  65.352   3.304   0.046
  387   1HD1  ILE  59          1HD1      ILE  59  68.097  -0.842  -0.398
  388   2HD1  ILE  59          2HD1      ILE  59  67.997   0.911  -0.523
  389   3HD1  ILE  59          3HD1      ILE  59  67.261  -0.107  -1.764
  390    H    ASN  60           H        ASN  60  62.626   1.398  -1.608
  391    HA   ASN  60           HA       ASN  60  60.845  -0.794  -1.494
  392   1HB   ASN  60          2HB       ASN  60  61.689   0.979  -3.788
  393   2HB   ASN  60          1HB       ASN  60  60.470  -0.277  -3.951
  394   1HD2  ASN  60          1HD2      ASN  60  59.246   0.105  -1.401
  395   2HD2  ASN  60          2HD2      ASN  60  58.410   1.626  -1.450
  396    H    ILE  61           H        ILE  61  60.825  -2.712  -2.715
  397    HA   ILE  61           HA       ILE  61  63.400  -3.917  -2.960
  398    HB   ILE  61           HB       ILE  61  61.256  -5.061  -2.241
  399   1HG1  ILE  61          2HG1      ILE  61  61.903  -7.216  -3.264
  400   2HG1  ILE  61          1HG1      ILE  61  62.919  -6.352  -4.413
  401   1HG2  ILE  61          1HG2      ILE  61  60.805  -5.232  -5.216
  402   2HG2  ILE  61          2HG2      ILE  61  59.864  -4.250  -4.095
  403   3HG2  ILE  61          3HG2      ILE  61  59.838  -6.008  -3.956
  404   1HD1  ILE  61          1HD1      ILE  61  64.295  -5.533  -2.573
  405   2HD1  ILE  61          2HD1      ILE  61  64.239  -7.295  -2.615
  406   3HD1  ILE  61          3HD1      ILE  61  63.279  -6.408  -1.430
  407    H    ASN  62           H        ASN  62  61.941  -1.798  -4.939
  408    HA   ASN  62           HA       ASN  62  62.862  -3.089  -7.414
  409   1HB   ASN  62          2HB       ASN  62  61.286  -1.517  -8.585
  410   2HB   ASN  62          1HB       ASN  62  60.508  -2.722  -7.569
  411   1HD2  ASN  62          1HD2      ASN  62  58.660  -1.631  -7.209
  412   2HD2  ASN  62          2HD2      ASN  62  58.565  -0.165  -6.301
  413    H    TRP  63           H        TRP  63  64.503  -1.600  -5.524
  414    HA   TRP  63           HA       TRP  63  65.377   0.637  -7.239
  415   1HB   TRP  63          2HB       TRP  63  66.011  -0.020  -4.347
  416   2HB   TRP  63          1HB       TRP  63  66.831   1.247  -5.253
  417    HD1  TRP  63           HD1      TRP  63  63.065   0.778  -5.668
  418    HE1  TRP  63           HE1      TRP  63  61.842   2.812  -4.674
  419    HE3  TRP  63           HE3      TRP  63  67.032   3.096  -3.447
  420    HZ2  TRP  63           HZ2      TRP  63  62.476   5.086  -3.143
  421    HZ3  TRP  63           HZ3      TRP  63  66.635   5.200  -2.236
  422    HH2  TRP  63           HH2      TRP  63  64.407   6.174  -2.086
  423    H    ARG  64           H        ARG  64  65.662  -2.464  -6.983
  424    HA   ARG  64           HA       ARG  64  68.385  -3.055  -7.452
  425   1HB   ARG  64          2HB       ARG  64  65.887  -4.364  -8.569
  426   2HB   ARG  64          1HB       ARG  64  67.496  -5.061  -8.601
  427   1HG   ARG  64          2HG       ARG  64  66.306  -4.330  -5.975
  428   2HG   ARG  64          1HG       ARG  64  65.740  -5.781  -6.803
  429   1HD   ARG  64          2HD       ARG  64  68.649  -5.208  -6.286
  430   2HD   ARG  64          1HD       ARG  64  67.636  -6.096  -5.154
  431    HE   ARG  64           HE       ARG  64  67.591  -7.898  -6.616
  432   1HH1  ARG  64          1HH1      ARG  64  69.264  -5.202  -8.120
  433   2HH1  ARG  64          2HH1      ARG  64  70.076  -6.198  -9.285
  434   1HH2  ARG  64          1HH2      ARG  64  68.666  -9.196  -8.168
  435   2HH2  ARG  64          2HH2      ARG  64  69.727  -8.452  -9.317
  436    H    CYS  65           H        CYS  65  69.175  -1.320  -8.876
  437    HA   CYS  65           HA       CYS  65  67.863  -1.164 -11.462
  438   1HB   CYS  65          2HB       CYS  65  69.270   0.731 -11.952
  439   2HB   CYS  65          1HB       CYS  65  68.590   0.927 -10.342
  440    H    ASP  66           H        ASP  66  70.849  -2.318 -10.081
  441    HA   ASP  66           HA       ASP  66  71.291  -3.815 -12.544
  442   1HB   ASP  66          2HB       ASP  66  73.712  -3.272 -12.550
  443   2HB   ASP  66          1HB       ASP  66  72.683  -1.884 -12.863
  444    H    ASN  67           H        ASN  67  73.407  -3.455  -9.673
  445    HA   ASN  67           HA       ASN  67  73.885  -6.256  -9.694
  446   1HB   ASN  67          2HB       ASN  67  75.624  -4.645  -9.007
  447   2HB   ASN  67          1HB       ASN  67  74.657  -4.218  -7.599
  448   1HD2  ASN  67          1HD2      ASN  67  74.724  -5.477  -5.809
  449   2HD2  ASN  67          2HD2      ASN  67  75.690  -6.912  -5.679
  450    H    ASP  68           H        ASP  68  72.760  -4.296  -6.936
  451    HA   ASP  68           HA       ASP  68  70.531  -6.169  -6.637
  452   1HB   ASP  68          2HB       ASP  68  72.433  -6.794  -5.045
  453   2HB   ASP  68          1HB       ASP  68  72.096  -5.278  -4.213
  454    H    ASN  69           H        ASN  69  70.231  -4.507  -3.927
  455    HA   ASN  69           HA       ASN  69  68.608  -2.446  -5.307
  456   1HB   ASN  69          2HB       ASN  69  67.576  -4.460  -4.004
  457   2HB   ASN  69          1HB       ASN  69  68.006  -3.533  -2.573
  458   1HD2  ASN  69          1HD2      ASN  69  66.983  -1.555  -2.210
  459   2HD2  ASN  69          2HD2      ASN  69  65.471  -1.171  -2.960
  460    H    ASP  70           H        ASP  70  69.117  -0.339  -4.877
  461    HA   ASP  70           HA       ASP  70  70.897   0.092  -2.575
  462   1HB   ASP  70          2HB       ASP  70  71.976   1.782  -3.694
  463   2HB   ASP  70          1HB       ASP  70  71.723   0.554  -4.925
  464    H    CYS  71           H        CYS  71  71.000   2.537  -2.016
  465    HA   CYS  71           HA       CYS  71  68.273   3.398  -1.343
  466   1HB   CYS  71          2HB       CYS  71  69.102   2.017   0.487
  467   2HB   CYS  71          1HB       CYS  71  70.586   2.956   0.558
  468    H    GLY  72           H        GLY  72  71.221   4.224  -2.620
  469   1HA   GLY  72          2HA       GLY  72  71.742   6.368  -3.427
  470   2HA   GLY  72          1HA       GLY  72  70.659   7.060  -2.233
  471    H    ASP  73           H        ASP  73  72.229   5.131  -0.262
  472    HA   ASP  73           HA       ASP  73  74.336   7.122   0.208
  473   1HB   ASP  73          2HB       ASP  73  74.191   6.603   2.562
  474   2HB   ASP  73          1HB       ASP  73  72.576   6.949   1.956
  475    H    ASN  74           H        ASN  74  73.771   3.643   0.846
  476    HA   ASN  74           HA       ASN  74  76.144   2.749  -0.360
  477   1HB   ASN  74          2HB       ASN  74  77.009   4.021   1.731
  478   2HB   ASN  74          1HB       ASN  74  76.331   2.692   2.656
  479   1HD2  ASN  74          1HD2      ASN  74  77.033   0.669   0.658
  480   2HD2  ASN  74          2HD2      ASN  74  78.744   0.469   0.761
  481    H    SER  75           H        SER  75  73.782   1.777  -0.758
  482    HA   SER  75           HA       SER  75  73.100  -0.230   1.221
  483   1HB   SER  75          2HB       SER  75  71.353   1.223   0.182
  484   2HB   SER  75          1HB       SER  75  71.673   0.411  -1.351
  485    HG   SER  75           HG       SER  75  70.716  -1.368  -0.638
  486    H    ASP  76           H        ASP  76  72.405  -0.917  -2.052
  487    HA   ASP  76           HA       ASP  76  73.595  -3.443  -2.104
  488   1HB   ASP  76          2HB       ASP  76  71.900  -3.029  -3.679
  489   2HB   ASP  76          1HB       ASP  76  72.668  -1.546  -4.243
  490    H    GLU  77           H        GLU  77  74.604  -0.472  -3.733
  491    HA   GLU  77           HA       GLU  77  77.394  -1.313  -3.411
  492   1HB   GLU  77          2HB       GLU  77  77.595   0.340  -5.540
  493   2HB   GLU  77          1HB       GLU  77  77.434  -1.401  -5.674
  494   1HG   GLU  77          2HG       GLU  77  75.962  -0.241  -7.230
  495   2HG   GLU  77          1HG       GLU  77  75.042  -1.175  -6.055
  496    H    ALA  78           H        ALA  78  75.307   1.425  -3.954
  497    HA   ALA  78           HA       ALA  78  76.163   2.888  -1.705
  498   1HB   ALA  78          1HB       ALA  78  77.311   4.751  -2.826
  499   2HB   ALA  78          2HB       ALA  78  77.275   3.849  -4.341
  500   3HB   ALA  78          3HB       ALA  78  78.209   3.241  -2.976
  501    H    GLY  79           H        GLY  79  75.450   4.005  -5.011
  502   1HA   GLY  79          2HA       GLY  79  72.749   4.722  -4.265
  503   2HA   GLY  79          1HA       GLY  79  73.846   6.087  -4.421
  504    H    CYS  80           H        CYS  80  71.864   3.865  -6.036
  505    HA   CYS  80           HA       CYS  80  72.904   4.582  -8.681
  506   1HB   CYS  80          2HB       CYS  80  72.356   2.221  -8.186
  507   2HB   CYS  80          1HB       CYS  80  70.698   2.682  -7.844
  508    H    SER  81           H        SER  81  70.845   5.742  -6.397
  509    HA   SER  81           HA       SER  81  68.720   6.655  -8.141
  510   1HB   SER  81          2HB       SER  81  69.217   7.128  -5.192
  511   2HB   SER  81          1HB       SER  81  67.758   7.582  -6.072
  512    HG   SER  81           HG       SER  81  68.757   4.934  -5.805
  513    H    HIS  82           HN       HIS  82  71.189   7.657  -8.920
  514    HA   HIS  82           HA       HIS  82  72.033   9.580  -9.775
  515   1HB   HIS  82          2HB       HIS  82  69.687  10.912  -8.423
  516   2HB   HIS  82          1HB       HIS  82  70.818  11.735  -9.488
  517    HD1  HIS  82           HD1      HIS  82  67.799   9.596  -9.521
  518    HD2  HIS  82           HD2      HIS  82  70.660  10.931 -12.221
  519    HE1  HIS  82           HE1      HIS  82  66.844   9.187 -11.826
  Start of MODEL   10
    1   1H    SER   1          1HT       SER   1  38.515  -6.160  -3.332
    2   2H    SER   1          2HT       SER   1  38.262  -4.488  -3.380
    3   3H    SER   1          3HT       SER   1  37.676  -5.468  -4.629
    4    HA   SER   1           HA       SER   1  36.174  -6.570  -3.101
    5   1HB   SER   1          2HB       SER   1  37.611  -6.146  -1.085
    6   2HB   SER   1          1HB       SER   1  37.100  -4.461  -1.123
    7    HG   SER   1           HG       SER   1  35.909  -6.289   0.181
    8    H    ALA   2           H        ALA   2  34.435  -4.784  -1.719
    9    HA   ALA   2           HA       ALA   2  33.059  -3.645  -3.877
   10   1HB   ALA   2          1HB       ALA   2  31.942  -4.320  -1.834
   11   2HB   ALA   2          2HB       ALA   2  31.613  -2.622  -2.183
   12   3HB   ALA   2          3HB       ALA   2  32.787  -3.058  -0.941
   13    H    ARG   3           H        ARG   3  35.446  -2.344  -1.756
   14    HA   ARG   3           HA       ARG   3  35.674  -0.026  -3.486
   15   1HB   ARG   3          2HB       ARG   3  34.215   0.775  -1.685
   16   2HB   ARG   3          1HB       ARG   3  35.398   0.264  -0.486
   17   1HG   ARG   3          2HG       ARG   3  35.446   2.693  -0.939
   18   2HG   ARG   3          1HG       ARG   3  36.983   1.896  -1.286
   19   1HD   ARG   3          2HD       ARG   3  36.187   1.739  -3.691
   20   2HD   ARG   3          1HD       ARG   3  34.891   2.842  -3.233
   21    HE   ARG   3           HE       ARG   3  36.829   4.347  -2.501
   22   1HH1  ARG   3          1HH1      ARG   3  37.007   2.088  -5.158
   23   2HH1  ARG   3          2HH1      ARG   3  38.155   3.025  -6.051
   24   1HH2  ARG   3          1HH2      ARG   3  38.341   5.581  -3.647
   25   2HH2  ARG   3          2HH2      ARG   3  38.931   5.025  -5.181
   26    H    THR   4           H        THR   4  36.969  -1.878  -0.777
   27    HA   THR   4           HA       THR   4  39.530  -0.718  -0.827
   28    HB   THR   4           HB       THR   4  40.093  -3.049   0.301
   29    HG1  THR   4           HG1      THR   4  38.007  -3.658   1.385
   30   1HG2  THR   4          1HG2      THR   4  39.359  -2.120   2.438
   31   2HG2  THR   4          2HG2      THR   4  38.317  -0.977   1.593
   32   3HG2  THR   4          3HG2      THR   4  40.068  -0.858   1.425
   33    H    CYS   5           H        CYS   5  41.417  -1.372  -1.653
   34    HA   CYS   5           HA       CYS   5  41.438  -2.348  -4.263
   35   1HB   CYS   5          2HB       CYS   5  43.647  -1.853  -2.266
   36   2HB   CYS   5          1HB       CYS   5  43.936  -2.271  -3.956
   37    HA   PRO   6           HA       PRO   6  41.968  -6.780  -4.032
   38   1HB   PRO   6          2HB       PRO   6  44.412  -6.457  -5.687
   39   2HB   PRO   6          1HB       PRO   6  42.966  -7.425  -5.994
   40   1HG   PRO   6          2HG       PRO   6  43.419  -5.166  -7.340
   41   2HG   PRO   6          1HG       PRO   6  41.779  -5.617  -6.837
   42   1HD   PRO   6          2HD       PRO   6  43.646  -3.608  -5.655
   43   2HD   PRO   6          1HD       PRO   6  41.885  -3.525  -5.867
   44    HA   PRO   7           HA       PRO   7  44.780  -7.699  -0.788
   45   1HB   PRO   7          2HB       PRO   7  45.410 -10.269  -2.121
   46   2HB   PRO   7          1HB       PRO   7  44.734  -9.969  -0.516
   47   1HG   PRO   7          2HG       PRO   7  43.201 -10.888  -2.492
   48   2HG   PRO   7          1HG       PRO   7  42.580  -9.697  -1.334
   49   1HD   PRO   7          2HD       PRO   7  43.531  -9.294  -4.143
   50   2HD   PRO   7          1HD       PRO   7  42.141  -8.569  -3.310
   51    H    ASN   8           H        ASN   8  45.951  -7.684  -4.016
   52    HA   ASN   8           HA       ASN   8  48.726  -8.108  -3.303
   53   1HB   ASN   8          2HB       ASN   8  47.477  -8.560  -5.595
   54   2HB   ASN   8          1HB       ASN   8  47.883  -6.874  -5.893
   55   1HD2  ASN   8          1HD2      ASN   8  50.421  -7.005  -4.437
   56   2HD2  ASN   8          2HD2      ASN   8  51.493  -7.918  -5.442
   57    H    GLN   9           H        GLN   9  46.563  -5.635  -2.960
   58    HA   GLN   9           HA       GLN   9  48.671  -3.682  -2.612
   59   1HB   GLN   9          2HB       GLN   9  47.196  -1.946  -3.817
   60   2HB   GLN   9          1HB       GLN   9  48.159  -3.037  -4.800
   61   1HG   GLN   9          2HG       GLN   9  45.527  -4.112  -4.274
   62   2HG   GLN   9          1HG       GLN   9  45.450  -2.524  -5.038
   63   1HE2  GLN   9          1HE2      GLN   9  48.132  -4.677  -5.544
   64   2HE2  GLN   9          2HE2      GLN   9  47.771  -5.067  -7.186
   65    H    PHE  10           H        PHE  10  46.990  -1.493  -2.233
   66    HA   PHE  10           HA       PHE  10  45.272  -2.207   0.011
   67   1HB   PHE  10          2HB       PHE  10  47.401  -2.187   1.077
   68   2HB   PHE  10          1HB       PHE  10  47.908  -0.747   0.211
   69    HD1  PHE  10           HD1      PHE  10  47.501   1.389   1.055
   70    HD2  PHE  10           HD2      PHE  10  45.663  -1.990   2.876
   71    HE1  PHE  10           HE1      PHE  10  46.806   2.789   2.941
   72    HE2  PHE  10           HE2      PHE  10  44.956  -0.579   4.776
   73    HZ   PHE  10           HZ       PHE  10  45.531   1.824   4.804
   74    H    SER  11           H        SER  11  44.180  -0.203   0.849
   75    HA   SER  11           HA       SER  11  43.751   1.637  -1.357
   76   1HB   SER  11          2HB       SER  11  41.889   0.777   0.852
   77   2HB   SER  11          1HB       SER  11  41.522   2.052  -0.314
   78    HG   SER  11           HG       SER  11  41.825   0.466  -1.963
   79    H    CYS  12           H        CYS  12  45.035   3.321  -0.982
   80    HA   CYS  12           HA       CYS  12  45.354   4.586   1.495
   81   1HB   CYS  12          2HB       CYS  12  46.862   5.285  -0.169
   82   2HB   CYS  12          1HB       CYS  12  45.574   5.584  -1.331
   83    H    ALA  13           H        ALA  13  44.230   6.180   2.497
   84    HA   ALA  13           HA       ALA  13  41.731   5.858   3.072
   85   1HB   ALA  13          1HB       ALA  13  43.169   7.552   4.083
   86   2HB   ALA  13          2HB       ALA  13  41.529   8.140   3.813
   87   3HB   ALA  13          3HB       ALA  13  42.835   8.633   2.731
   88    H    SER  14           H        SER  14  40.234   5.253   1.666
   89    HA   SER  14           HA       SER  14  38.198   5.609   0.764
   90   1HB   SER  14          2HB       SER  14  38.971   8.525   0.739
   91   2HB   SER  14          1HB       SER  14  37.356   7.890   0.427
   92    HG   SER  14           HG       SER  14  37.438   8.447   2.571
   93    H    GLY  15           H        GLY  15  40.781   7.393  -0.939
   94   1HA   GLY  15          2HA       GLY  15  39.196   7.006  -3.400
   95   2HA   GLY  15          1HA       GLY  15  40.296   8.343  -3.138
   96    H    ARG  16           H        ARG  16  42.413   6.472  -2.079
   97    HA   ARG  16           HA       ARG  16  43.434   6.137  -4.799
   98   1HB   ARG  16          2HB       ARG  16  44.943   6.250  -2.189
   99   2HB   ARG  16          1HB       ARG  16  45.670   6.131  -3.782
  100   1HG   ARG  16          2HG       ARG  16  45.871   8.380  -3.250
  101   2HG   ARG  16          1HG       ARG  16  44.449   8.332  -4.290
  102   1HD   ARG  16          2HD       ARG  16  43.003   8.368  -2.316
  103   2HD   ARG  16          1HD       ARG  16  44.424   8.402  -1.275
  104    HE   ARG  16           HE       ARG  16  43.776  10.566  -3.170
  105   1HH1  ARG  16          1HH1      ARG  16  44.906   9.436  -0.060
  106   2HH1  ARG  16          2HH1      ARG  16  45.108  11.028   0.594
  107   1HH2  ARG  16          1HH2      ARG  16  44.027  12.681  -2.303
  108   2HH2  ARG  16          2HH2      ARG  16  44.603  12.876  -0.683
  109    H    CYS  17           H        CYS  17  45.162   4.405  -5.026
  110    HA   CYS  17           HA       CYS  17  44.458   1.895  -3.681
  111   1HB   CYS  17          2HB       CYS  17  43.260   2.316  -5.999
  112   2HB   CYS  17          1HB       CYS  17  44.840   1.890  -6.657
  113    H    ILE  18           H        ILE  18  46.456   1.702  -2.701
  114    HA   ILE  18           HA       ILE  18  48.834   2.177  -4.378
  115    HB   ILE  18           HB       ILE  18  50.028   2.858  -2.414
  116   1HG1  ILE  18          2HG1      ILE  18  48.225   3.041  -0.328
  117   2HG1  ILE  18          1HG1      ILE  18  47.878   1.460  -1.017
  118   1HG2  ILE  18          1HG2      ILE  18  47.281   4.078  -2.306
  119   2HG2  ILE  18          2HG2      ILE  18  48.567   4.549  -3.423
  120   3HG2  ILE  18          3HG2      ILE  18  48.771   4.797  -1.687
  121   1HD1  ILE  18          1HD1      ILE  18  49.487   1.199   0.719
  122   2HD1  ILE  18          2HD1      ILE  18  50.516   2.453   0.025
  123   3HD1  ILE  18          3HD1      ILE  18  50.290   0.921  -0.829
  124    HA   PRO  19           HA       PRO  19  49.723  -2.144  -4.044
  125   1HB   PRO  19          2HB       PRO  19  52.573  -1.294  -4.087
  126   2HB   PRO  19          1HB       PRO  19  51.713  -2.421  -5.143
  127   1HG   PRO  19          2HG       PRO  19  52.370   0.009  -6.011
  128   2HG   PRO  19          1HG       PRO  19  50.813  -0.720  -6.447
  129   1HD   PRO  19          2HD       PRO  19  51.412   1.377  -4.396
  130   2HD   PRO  19          1HD       PRO  19  50.047   1.263  -5.527
  131    H    ILE  20           H        ILE  20  50.519  -3.670  -2.580
  132    HA   ILE  20           HA       ILE  20  50.520  -2.948   0.125
  133    HB   ILE  20           HB       ILE  20  51.153  -5.408  -1.409
  134   1HG1  ILE  20          2HG1      ILE  20  48.830  -4.789  -0.928
  135   2HG1  ILE  20          1HG1      ILE  20  49.266  -6.312  -0.156
  136   1HG2  ILE  20          1HG2      ILE  20  51.608  -5.195   1.545
  137   2HG2  ILE  20          2HG2      ILE  20  52.830  -5.507   0.316
  138   3HG2  ILE  20          3HG2      ILE  20  51.566  -6.698   0.617
  139   1HD1  ILE  20          1HD1      ILE  20  49.124  -3.623   1.196
  140   2HD1  ILE  20          2HD1      ILE  20  49.548  -5.152   1.969
  141   3HD1  ILE  20          3HD1      ILE  20  47.926  -4.914   1.315
  142    H    SER  21           H        SER  21  52.123  -2.990   1.702
  143    HA   SER  21           HA       SER  21  54.158  -2.822   2.685
  144   1HB   SER  21          2HB       SER  21  55.344  -3.254  -0.054
  145   2HB   SER  21          1HB       SER  21  56.231  -3.254   1.472
  146    HG   SER  21           HG       SER  21  55.367  -5.336   0.430
  147    H    TRP  22           H        TRP  22  53.148  -0.990   0.072
  148    HA   TRP  22           HA       TRP  22  55.010   1.147   0.160
  149   1HB   TRP  22          2HB       TRP  22  52.149   0.997  -0.729
  150   2HB   TRP  22          1HB       TRP  22  53.014   2.525  -0.730
  151    HD1  TRP  22           HD1      TRP  22  54.157  -0.971  -1.988
  152    HE1  TRP  22           HE1      TRP  22  54.886  -0.703  -4.433
  153    HE3  TRP  22           HE3      TRP  22  53.086   3.980  -2.619
  154    HZ2  TRP  22           HZ2      TRP  22  55.021   1.351  -6.381
  155    HZ3  TRP  22           HZ3      TRP  22  53.544   5.025  -4.791
  156    HH2  TRP  22           HH2      TRP  22  54.491   3.737  -6.638
  157    H    THR  23           H        THR  23  52.165   0.430   1.972
  158    HA   THR  23           HA       THR  23  51.696   2.896   3.156
  159    HB   THR  23           HB       THR  23  49.875   1.639   3.555
  160    HG1  THR  23           HG1      THR  23  51.131   2.041   5.711
  161   1HG2  THR  23          1HG2      THR  23  50.626  -0.380   2.488
  162   2HG2  THR  23          2HG2      THR  23  49.918  -0.812   4.046
  163   3HG2  THR  23          3HG2      THR  23  51.670  -0.770   3.857
  164    H    CYS  24           H        CYS  24  53.293   0.133   4.673
  165    HA   CYS  24           HA       CYS  24  54.553   1.887   6.566
  166   1HB   CYS  24          2HB       CYS  24  54.935  -1.075   6.180
  167   2HB   CYS  24          1HB       CYS  24  55.447  -0.119   7.567
  168    H    ASP  25           H        ASP  25  55.966   3.120   5.284
  169    HA   ASP  25           HA       ASP  25  58.056   1.647   3.796
  170   1HB   ASP  25          2HB       ASP  25  56.672   2.964   2.291
  171   2HB   ASP  25          1HB       ASP  25  56.907   4.397   3.282
  172    H    LEU  26           H        LEU  26  57.566   4.836   5.280
  173    HA   LEU  26           HA       LEU  26  59.371   4.531   7.374
  174   1HB   LEU  26          2HB       LEU  26  60.855   4.810   5.097
  175   2HB   LEU  26          1HB       LEU  26  60.666   6.488   5.564
  176    HG   LEU  26           HG       LEU  26  61.867   4.298   7.259
  177   1HD1  LEU  26          1HD1      LEU  26  63.152   6.712   5.985
  178   2HD1  LEU  26          2HD1      LEU  26  63.257   5.067   5.363
  179   3HD1  LEU  26          3HD1      LEU  26  63.957   5.459   6.933
  180   1HD2  LEU  26          1HD2      LEU  26  60.708   5.910   8.651
  181   2HD2  LEU  26          2HD2      LEU  26  61.540   7.237   7.841
  182   3HD2  LEU  26          3HD2      LEU  26  62.454   6.089   8.820
  183    H    ASP  27           H        ASP  27  58.005   6.713   5.004
  184    HA   ASP  27           HA       ASP  27  56.939   8.313   7.237
  185   1HB   ASP  27          2HB       ASP  27  58.708   9.396   5.567
  186   2HB   ASP  27          1HB       ASP  27  57.289   9.558   4.539
  187    H    ASP  28           H        ASP  28  54.835   9.463   6.469
  188    HA   ASP  28           HA       ASP  28  53.055   7.348   5.859
  189   1HB   ASP  28          2HB       ASP  28  52.256   9.126   7.257
  190   2HB   ASP  28          1HB       ASP  28  52.599  10.331   6.024
  191    H    ASP  29           H        ASP  29  52.590   6.478   3.973
  192    HA   ASP  29           HA       ASP  29  53.088   7.799   1.485
  193   1HB   ASP  29          2HB       ASP  29  52.993   5.262   1.914
  194   2HB   ASP  29          1HB       ASP  29  51.244   5.448   1.905
  195    H    CYS  30           H        CYS  30  49.985   6.401   2.185
  196    HA   CYS  30           HA       CYS  30  48.907   8.676   3.423
  197   1HB   CYS  30          2HB       CYS  30  47.257   9.379   1.809
  198   2HB   CYS  30          1HB       CYS  30  48.891   9.667   1.234
  199    H    GLY  31           H        GLY  31  48.967   5.604   3.294
  200   1HA   GLY  31          2HA       GLY  31  46.644   4.413   2.538
  201   2HA   GLY  31          1HA       GLY  31  47.572   3.902   3.937
  202    H    ASP  32           H        ASP  32  47.156   5.786   5.786
  203    HA   ASP  32           HA       ASP  32  44.257   6.252   5.849
  204   1HB   ASP  32          2HB       ASP  32  44.877   4.256   7.267
  205   2HB   ASP  32          1HB       ASP  32  45.814   5.349   8.282
  206    H    ARG  33           H        ARG  33  46.499   7.930   5.135
  207    HA   ARG  33           HA       ARG  33  47.206  10.094   5.436
  208   1HB   ARG  33          2HB       ARG  33  45.075  10.321   7.568
  209   2HB   ARG  33          1HB       ARG  33  45.739  11.606   6.558
  210   1HG   ARG  33          2HG       ARG  33  44.473  11.051   4.770
  211   2HG   ARG  33          1HG       ARG  33  44.500   9.327   5.170
  212   1HD   ARG  33          2HD       ARG  33  42.920  11.385   6.722
  213   2HD   ARG  33          1HD       ARG  33  42.248  10.459   5.379
  214    HE   ARG  33           HE       ARG  33  43.151   8.492   6.936
  215   1HH1  ARG  33          1HH1      ARG  33  41.337  11.359   7.803
  216   2HH1  ARG  33          2HH1      ARG  33  40.521  10.590   9.120
  217   1HH2  ARG  33          1HH2      ARG  33  42.100   7.469   8.649
  218   2HH2  ARG  33          2HH2      ARG  33  40.973   8.372   9.626
  219    H    SER  34           H        SER  34  48.054   7.841   6.942
  220    HA   SER  34           HA       SER  34  49.959   8.690   8.677
  221   1HB   SER  34          2HB       SER  34  48.069   9.536  10.097
  222   2HB   SER  34          1HB       SER  34  47.440   7.891  10.187
  223    HG   SER  34           HG       SER  34  49.449   7.299  11.172
  224    H    ASP  35           H        ASP  35  49.373   6.756   6.624
  225    HA   ASP  35           HA       ASP  35  48.881   4.169   7.775
  226   1HB   ASP  35          2HB       ASP  35  49.551   3.212   5.671
  227   2HB   ASP  35          1HB       ASP  35  48.509   4.598   5.406
  228    H    GLU  36           H        GLU  36  51.292   5.937   8.663
  229    HA   GLU  36           HA       GLU  36  53.313   3.805   8.763
  230   1HB   GLU  36          2HB       GLU  36  53.366   6.776   9.093
  231   2HB   GLU  36          1HB       GLU  36  54.579   5.814   9.926
  232   1HG   GLU  36          2HG       GLU  36  54.068   5.634   6.976
  233   2HG   GLU  36          1HG       GLU  36  55.261   6.715   7.698
  234    H    SER  37           H        SER  37  50.694   4.634  10.387
  235    HA   SER  37           HA       SER  37  51.714   3.635  12.908
  236   1HB   SER  37          2HB       SER  37  50.264   6.289  12.707
  237   2HB   SER  37          1HB       SER  37  50.665   5.456  14.209
  238    HG   SER  37           HG       SER  37  52.848   5.691  12.641
  239    H    ALA  38           H        ALA  38  50.142   2.686  14.177
  240    HA   ALA  38           HA       ALA  38  48.243   1.626  14.711
  241   1HB   ALA  38          1HB       ALA  38  47.126   3.813  14.456
  242   2HB   ALA  38          2HB       ALA  38  46.076   2.459  14.039
  243   3HB   ALA  38          3HB       ALA  38  46.816   3.424  12.763
  244    H    SER  39           H        SER  39  49.519   1.652  11.673
  245    HA   SER  39           HA       SER  39  48.171  -0.873  11.048
  246   1HB   SER  39          2HB       SER  39  49.488  -0.585   8.849
  247   2HB   SER  39          1HB       SER  39  48.169   0.556   9.127
  248    HG   SER  39           HG       SER  39  50.323   1.425   8.439
  249    H    CYS  40           H        CYS  40  51.411   0.489  10.607
  250    HA   CYS  40           HA       CYS  40  52.576  -1.925  11.765
  251   1HB   CYS  40          2HB       CYS  40  53.727   0.362  10.190
  252   2HB   CYS  40          1HB       CYS  40  54.746  -0.821  11.013
  253    H    ALA  41           H        ALA  41  53.805  -1.943  13.612
  254    HA   ALA  41           HA       ALA  41  53.864   0.530  15.192
  255   1HB   ALA  41          1HB       ALA  41  54.427  -0.924  17.084
  256   2HB   ALA  41          2HB       ALA  41  54.438  -2.319  16.004
  257   3HB   ALA  41          3HB       ALA  41  52.936  -1.442  16.293
  258    H    TYR  42           H        TYR  42  55.635  -1.061  13.011
  259    HA   TYR  42           HA       TYR  42  57.760  -1.161  12.321
  260   1HB   TYR  42          2HB       TYR  42  57.467   1.514  13.511
  261   2HB   TYR  42          1HB       TYR  42  59.128   0.977  13.258
  262    HD1  TYR  42           HD1      TYR  42  55.870   0.946  11.411
  263    HD2  TYR  42           HD2      TYR  42  60.091   1.499  11.219
  264    HE1  TYR  42           HE1      TYR  42  55.693   1.456   9.006
  265    HE2  TYR  42           HE2      TYR  42  59.917   2.006   8.828
  266    HH   TYR  42           HH       TYR  42  57.053   2.765   7.322
  267    HA   PRO  43           HA       PRO  43  59.893  -2.919  15.924
  268   1HB   PRO  43          2HB       PRO  43  60.015  -5.447  15.015
  269   2HB   PRO  43          1HB       PRO  43  58.607  -4.853  15.902
  270   1HG   PRO  43          2HG       PRO  43  58.968  -5.234  12.963
  271   2HG   PRO  43          1HG       PRO  43  57.549  -5.566  13.973
  272   1HD   PRO  43          2HD       PRO  43  57.866  -3.312  12.409
  273   2HD   PRO  43          1HD       PRO  43  56.808  -3.410  13.828
  274    H    THR  44           H        THR  44  60.081  -3.065  12.475
  275    HA   THR  44           HA       THR  44  62.936  -2.559  12.572
  276    HB   THR  44           HB       THR  44  63.169  -4.098  10.517
  277    HG1  THR  44           HG1      THR  44  61.466  -5.943  11.253
  278   1HG2  THR  44          1HG2      THR  44  63.640  -6.056  11.888
  279   2HG2  THR  44          2HG2      THR  44  62.715  -5.362  13.219
  280   3HG2  THR  44          3HG2      THR  44  64.210  -4.591  12.689
  281    H    CYS  45           H        CYS  45  60.877  -3.420   9.911
  282    HA   CYS  45           HA       CYS  45  60.477  -0.708   9.025
  283   1HB   CYS  45          2HB       CYS  45  62.254  -2.561   7.434
  284   2HB   CYS  45          1HB       CYS  45  61.540  -1.090   6.789
  285    H    PHE  46           H        PHE  46  60.632  -3.961   7.687
  286    HA   PHE  46           HA       PHE  46  58.635  -3.375   5.762
  287   1HB   PHE  46          2HB       PHE  46  59.182  -5.367   4.777
  288   2HB   PHE  46          1HB       PHE  46  60.639  -5.097   5.721
  289    HD1  PHE  46           HD1      PHE  46  57.739  -7.165   5.202
  290    HD2  PHE  46           HD2      PHE  46  61.007  -6.389   7.809
  291    HE1  PHE  46           HE1      PHE  46  57.403  -9.360   6.245
  292    HE2  PHE  46           HE2      PHE  46  60.686  -8.590   8.863
  293    HZ   PHE  46           HZ       PHE  46  58.886 -10.082   8.082
  294    HA   PRO  47           HA       PRO  47  55.136  -5.102   7.974
  295   1HB   PRO  47          2HB       PRO  47  53.242  -4.261   6.315
  296   2HB   PRO  47          1HB       PRO  47  54.088  -3.105   7.352
  297   1HG   PRO  47          2HG       PRO  47  54.490  -3.692   4.445
  298   2HG   PRO  47          1HG       PRO  47  54.490  -2.129   5.281
  299   1HD   PRO  47          2HD       PRO  47  56.757  -3.575   4.581
  300   2HD   PRO  47          1HD       PRO  47  56.704  -2.305   5.822
  301    H    LEU  48           H        LEU  48  56.200  -5.510   4.725
  302    HA   LEU  48           HA       LEU  48  55.074  -8.151   4.500
  303   1HB   LEU  48          2HB       LEU  48  54.120  -5.855   2.775
  304   2HB   LEU  48          1HB       LEU  48  53.986  -7.537   2.267
  305    HG   LEU  48           HG       LEU  48  52.913  -7.403   4.877
  306   1HD1  LEU  48          1HD1      LEU  48  51.106  -5.777   4.581
  307   2HD1  LEU  48          2HD1      LEU  48  51.846  -5.227   3.078
  308   3HD1  LEU  48          3HD1      LEU  48  52.689  -5.000   4.611
  309   1HD2  LEU  48          1HD2      LEU  48  50.852  -8.076   3.745
  310   2HD2  LEU  48          2HD2      LEU  48  52.249  -8.963   3.133
  311   3HD2  LEU  48          3HD2      LEU  48  51.563  -7.639   2.190
  312    H    THR  49           H        THR  49  56.346  -5.642   2.282
  313    HA   THR  49           HA       THR  49  58.599  -7.353   1.640
  314    HB   THR  49           HB       THR  49  58.216  -6.968  -0.829
  315    HG1  THR  49           HG1      THR  49  56.255  -6.293  -1.532
  316   1HG2  THR  49          1HG2      THR  49  56.153  -8.656   0.583
  317   2HG2  THR  49          2HG2      THR  49  57.802  -9.150   0.199
  318   3HG2  THR  49          3HG2      THR  49  56.654  -8.824  -1.100
  319    H    GLN  50           H        GLN  50  59.913  -5.890   2.528
  320    HA   GLN  50           HA       GLN  50  60.251  -3.325   1.159
  321   1HB   GLN  50          2HB       GLN  50  60.255  -3.798   4.143
  322   2HB   GLN  50          1HB       GLN  50  60.893  -2.345   3.396
  323   1HG   GLN  50          2HG       GLN  50  58.059  -3.239   3.002
  324   2HG   GLN  50          1HG       GLN  50  58.560  -2.232   4.360
  325   1HE2  GLN  50          1HE2      GLN  50  59.288  -0.141   3.970
  326   2HE2  GLN  50          2HE2      GLN  50  58.943   0.690   2.498
  327    H    PHE  51           H        PHE  51  62.385  -2.544   1.163
  328    HA   PHE  51           HA       PHE  51  64.471  -4.450   2.000
  329   1HB   PHE  51          2HB       PHE  51  64.419  -3.784  -0.418
  330   2HB   PHE  51          1HB       PHE  51  64.648  -2.115   0.065
  331    HD1  PHE  51           HD1      PHE  51  66.829  -1.580   1.366
  332    HD2  PHE  51           HD2      PHE  51  66.244  -5.121  -0.908
  333    HE1  PHE  51           HE1      PHE  51  69.260  -1.865   1.202
  334    HE2  PHE  51           HE2      PHE  51  68.669  -5.417  -1.077
  335    HZ   PHE  51           HZ       PHE  51  70.189  -3.793  -0.021
  336    H    THR  52           H        THR  52  66.172  -3.599   3.327
  337    HA   THR  52           HA       THR  52  65.510  -1.029   4.580
  338    HB   THR  52           HB       THR  52  67.134  -3.292   5.764
  339    HG1  THR  52           HG1      THR  52  64.441  -2.959   5.501
  340   1HG2  THR  52          1HG2      THR  52  67.608  -1.068   6.702
  341   2HG2  THR  52          2HG2      THR  52  66.797  -2.108   7.872
  342   3HG2  THR  52          3HG2      THR  52  65.889  -0.849   7.036
  343    H    CYS  53           H        CYS  53  66.724   0.482   3.522
  344    HA   CYS  53           HA       CYS  53  69.295   0.201   2.500
  345   1HB   CYS  53          2HB       CYS  53  68.050   2.588   3.851
  346   2HB   CYS  53          1HB       CYS  53  69.561   2.651   2.954
  347    H    ASN  54           H        ASN  54  71.297   0.052   3.310
  348    HA   ASN  54           HA       ASN  54  71.675  -0.945   5.866
  349   1HB   ASN  54          2HB       ASN  54  74.150  -0.494   5.406
  350   2HB   ASN  54          1HB       ASN  54  73.286  -1.561   4.306
  351   1HD2  ASN  54          1HD2      ASN  54  73.142  -1.054   2.215
  352   2HD2  ASN  54          2HD2      ASN  54  73.842   0.361   1.501
  353    H    ASN  55           H        ASN  55  71.733   2.387   4.837
  354    HA   ASN  55           HA       ASN  55  73.143   3.284   7.144
  355   1HB   ASN  55          2HB       ASN  55  72.019   4.517   4.742
  356   2HB   ASN  55          1HB       ASN  55  71.948   5.536   6.175
  357   1HD2  ASN  55          1HD2      ASN  55  74.053   3.800   3.997
  358   2HD2  ASN  55          2HD2      ASN  55  75.494   4.654   4.412
  359    H    GLY  56           H        GLY  56  70.191   1.981   7.003
  360   1HA   GLY  56          2HA       GLY  56  69.052   1.760   9.108
  361   2HA   GLY  56          1HA       GLY  56  69.454   3.436   9.454
  362    H    ARG  57           H        ARG  57  68.493   3.147   6.281
  363    HA   ARG  57           HA       ARG  57  65.887   4.275   6.936
  364   1HB   ARG  57          2HB       ARG  57  67.254   4.051   4.245
  365   2HB   ARG  57          1HB       ARG  57  65.736   4.869   4.548
  366   1HG   ARG  57          2HG       ARG  57  67.424   6.513   4.350
  367   2HG   ARG  57          1HG       ARG  57  66.969   6.428   6.051
  368   1HD   ARG  57          2HD       ARG  57  68.966   5.517   6.679
  369   2HD   ARG  57          1HD       ARG  57  69.214   4.719   5.129
  370    HE   ARG  57           HE       ARG  57  70.022   6.769   4.234
  371   1HH1  ARG  57          1HH1      ARG  57  69.466   6.860   7.695
  372   2HH1  ARG  57          2HH1      ARG  57  70.587   8.148   7.967
  373   1HH2  ARG  57          1HH2      ARG  57  71.534   8.402   4.582
  374   2HH2  ARG  57          2HH2      ARG  57  71.763   9.047   6.184
  375    H    CYS  58           H        CYS  58  63.971   3.462   6.008
  376    HA   CYS  58           HA       CYS  58  64.125   0.664   5.118
  377   1HB   CYS  58          2HB       CYS  58  61.652   2.146   6.029
  378   2HB   CYS  58          1HB       CYS  58  61.894   0.408   5.921
  379    H    ILE  59           H        ILE  59  63.438   0.186   3.047
  380    HA   ILE  59           HA       ILE  59  62.060   2.310   1.599
  381    HB   ILE  59           HB       ILE  59  63.332   1.712  -0.470
  382   1HG1  ILE  59          2HG1      ILE  59  65.325   0.485   1.433
  383   2HG1  ILE  59          1HG1      ILE  59  64.163  -0.477   0.528
  384   1HG2  ILE  59          1HG2      ILE  59  63.770   3.735   0.778
  385   2HG2  ILE  59          2HG2      ILE  59  65.266   3.077   0.113
  386   3HG2  ILE  59          3HG2      ILE  59  64.891   2.870   1.825
  387   1HD1  ILE  59          1HD1      ILE  59  65.106   0.320  -1.564
  388   2HD1  ILE  59          2HD1      ILE  59  66.342  -0.436  -0.558
  389   3HD1  ILE  59          3HD1      ILE  59  66.260   1.322  -0.677
  390    H    ASN  60           H        ASN  60  60.968   1.527  -0.399
  391    HA   ASN  60           HA       ASN  60  59.458  -0.812   0.119
  392   1HB   ASN  60          2HB       ASN  60  59.777   0.722  -2.467
  393   2HB   ASN  60          1HB       ASN  60  58.579  -0.530  -2.186
  394   1HD2  ASN  60          1HD2      ASN  60  57.990   0.310   0.530
  395   2HD2  ASN  60          2HD2      ASN  60  57.113   1.799   0.402
  396    H    ILE  61           H        ILE  61  59.461  -2.834  -0.930
  397    HA   ILE  61           HA       ILE  61  61.997  -3.816  -1.787
  398    HB   ILE  61           HB       ILE  61  60.042  -5.150  -0.726
  399   1HG1  ILE  61          2HG1      ILE  61  60.794  -7.224  -1.901
  400   2HG1  ILE  61          1HG1      ILE  61  61.624  -6.210  -3.075
  401   1HG2  ILE  61          1HG2      ILE  61  58.642  -6.326  -2.414
  402   2HG2  ILE  61          2HG2      ILE  61  59.235  -5.198  -3.630
  403   3HG2  ILE  61          3HG2      ILE  61  58.287  -4.604  -2.266
  404   1HD1  ILE  61          1HD1      ILE  61  63.182  -7.047  -1.439
  405   2HD1  ILE  61          2HD1      ILE  61  62.215  -6.362  -0.133
  406   3HD1  ILE  61          3HD1      ILE  61  63.022  -5.299  -1.287
  407    H    ASN  62           H        ASN  62  59.903  -1.817  -3.261
  408    HA   ASN  62           HA       ASN  62  59.920  -3.031  -5.928
  409   1HB   ASN  62          2HB       ASN  62  58.334  -0.724  -4.778
  410   2HB   ASN  62          1HB       ASN  62  58.169  -1.341  -6.419
  411   1HD2  ASN  62          1HD2      ASN  62  56.452  -1.231  -3.869
  412   2HD2  ASN  62          2HD2      ASN  62  55.796  -2.829  -3.765
  413    H    TRP  63           H        TRP  63  62.165  -1.466  -4.549
  414    HA   TRP  63           HA       TRP  63  62.461   0.707  -6.517
  415   1HB   TRP  63          2HB       TRP  63  63.784   0.252  -3.832
  416   2HB   TRP  63          1HB       TRP  63  64.285   1.512  -4.954
  417    HD1  TRP  63           HD1      TRP  63  60.546   0.880  -4.595
  418    HE1  TRP  63           HE1      TRP  63  59.470   2.874  -3.365
  419    HE3  TRP  63           HE3      TRP  63  64.797   3.345  -3.164
  420    HZ2  TRP  63           HZ2      TRP  63  60.307   5.177  -1.988
  421    HZ3  TRP  63           HZ3      TRP  63  64.563   5.445  -1.893
  422    HH2  TRP  63           HH2      TRP  63  62.367   6.337  -1.319
  423    H    ARG  64           H        ARG  64  63.010  -2.295  -6.596
  424    HA   ARG  64           HA       ARG  64  65.732  -2.773  -7.053
  425   1HB   ARG  64          2HB       ARG  64  63.331  -4.022  -8.413
  426   2HB   ARG  64          1HB       ARG  64  64.966  -4.660  -8.467
  427   1HG   ARG  64          2HG       ARG  64  63.508  -4.276  -5.874
  428   2HG   ARG  64          1HG       ARG  64  63.316  -5.732  -6.848
  429   1HD   ARG  64          2HD       ARG  64  65.738  -6.123  -6.724
  430   2HD   ARG  64          1HD       ARG  64  65.922  -4.673  -5.735
  431    HE   ARG  64           HE       ARG  64  64.229  -5.996  -4.232
  432   1HH1  ARG  64          1HH1      ARG  64  66.930  -7.313  -6.036
  433   2HH1  ARG  64          2HH1      ARG  64  67.369  -8.443  -4.792
  434   1HH2  ARG  64          1HH2      ARG  64  64.780  -7.530  -2.623
  435   2HH2  ARG  64          2HH2      ARG  64  66.138  -8.574  -2.864
  436    H    CYS  65           H        CYS  65  66.615  -0.988  -8.200
  437    HA   CYS  65           HA       CYS  65  65.613  -0.358 -10.826
  438   1HB   CYS  65          2HB       CYS  65  68.095   0.528  -9.356
  439   2HB   CYS  65          1HB       CYS  65  67.635   1.118 -10.947
  440    H    ASP  66           H        ASP  66  68.322  -2.019  -9.417
  441    HA   ASP  66           HA       ASP  66  69.128  -2.938 -12.094
  442   1HB   ASP  66          2HB       ASP  66  70.946  -2.367  -9.739
  443   2HB   ASP  66          1HB       ASP  66  71.440  -2.831 -11.366
  444    H    ASN  67           H        ASN  67  69.819  -3.748  -8.677
  445    HA   ASN  67           HA       ASN  67  69.307  -6.544  -9.358
  446   1HB   ASN  67          2HB       ASN  67  71.661  -6.431  -9.178
  447   2HB   ASN  67          1HB       ASN  67  71.582  -5.366  -7.781
  448   1HD2  ASN  67          1HD2      ASN  67  71.426  -6.192  -5.795
  449   2HD2  ASN  67          2HD2      ASN  67  71.417  -7.884  -5.433
  450    H    ASP  68           H        ASP  68  69.984  -4.696  -6.418
  451    HA   ASP  68           HA       ASP  68  67.562  -5.835  -5.199
  452   1HB   ASP  68          2HB       ASP  68  70.266  -5.293  -4.177
  453   2HB   ASP  68          1HB       ASP  68  68.981  -4.709  -3.124
  454    H    ASN  69           H        ASN  69  67.763  -3.761  -3.047
  455    HA   ASN  69           HA       ASN  69  66.561  -1.578  -4.631
  456   1HB   ASN  69          2HB       ASN  69  65.897  -2.320  -1.779
  457   2HB   ASN  69          1HB       ASN  69  65.074  -1.135  -2.780
  458   1HD2  ASN  69          1HD2      ASN  69  63.798  -1.860  -4.485
  459   2HD2  ASN  69          2HD2      ASN  69  63.121  -3.456  -4.481
  460    H    ASP  70           H        ASP  70  67.087   0.546  -4.143
  461    HA   ASP  70           HA       ASP  70  68.758   1.004  -1.779
  462   1HB   ASP  70          2HB       ASP  70  70.454   2.014  -2.899
  463   2HB   ASP  70          1HB       ASP  70  69.939   0.907  -4.160
  464    H    CYS  71           H        CYS  71  69.104   3.725  -1.988
  465    HA   CYS  71           HA       CYS  71  66.453   4.865  -2.289
  466   1HB   CYS  71          2HB       CYS  71  66.674   5.820   0.095
  467   2HB   CYS  71          1HB       CYS  71  66.124   4.161  -0.098
  468    H    GLY  72           H        GLY  72  69.357   5.843  -0.453
  469   1HA   GLY  72          2HA       GLY  72  70.186   7.639  -2.539
  470   2HA   GLY  72          1HA       GLY  72  69.455   8.467  -1.175
  471    H    ASP  73           H        ASP  73  71.079   5.628  -0.269
  472    HA   ASP  73           HA       ASP  73  73.383   7.236   0.591
  473   1HB   ASP  73          2HB       ASP  73  72.577   4.551   1.721
  474   2HB   ASP  73          1HB       ASP  73  73.671   5.738   2.420
  475    H    ASN  74           H        ASN  74  72.892   3.776   0.213
  476    HA   ASN  74           HA       ASN  74  74.211   3.293  -2.157
  477   1HB   ASN  74          2HB       ASN  74  76.174   4.265  -0.769
  478   2HB   ASN  74          1HB       ASN  74  76.100   2.762   0.141
  479   1HD2  ASN  74          1HD2      ASN  74  75.449   1.103  -2.170
  480   2HD2  ASN  74          2HD2      ASN  74  76.889   1.006  -3.114
  481    H    SER  75           H        SER  75  72.175   2.024  -1.708
  482    HA   SER  75           HA       SER  75  72.568  -0.209   0.089
  483   1HB   SER  75          2HB       SER  75  70.091   0.457  -1.474
  484   2HB   SER  75          1HB       SER  75  70.224  -0.665  -0.118
  485    HG   SER  75           HG       SER  75  69.432   1.598   0.270
  486    H    ASP  76           H        ASP  76  70.729  -0.465  -2.857
  487    HA   ASP  76           HA       ASP  76  71.895  -2.925  -3.572
  488   1HB   ASP  76          2HB       ASP  76  69.691  -2.290  -4.386
  489   2HB   ASP  76          1HB       ASP  76  70.397  -0.968  -5.318
  490    H    GLU  77           H        GLU  77  72.173   0.279  -5.070
  491    HA   GLU  77           HA       GLU  77  74.924  -0.261  -5.822
  492   1HB   GLU  77          2HB       GLU  77  74.657  -0.073  -8.130
  493   2HB   GLU  77          1HB       GLU  77  73.293  -1.059  -7.643
  494   1HG   GLU  77          2HG       GLU  77  73.280   1.837  -8.452
  495   2HG   GLU  77          1HG       GLU  77  72.522   0.477  -9.271
  496    H    ALA  78           H        ALA  78  72.298   1.969  -5.523
  497    HA   ALA  78           HA       ALA  78  72.181   4.140  -4.919
  498   1HB   ALA  78          1HB       ALA  78  74.024   3.682  -3.360
  499   2HB   ALA  78          2HB       ALA  78  74.080   5.319  -4.013
  500   3HB   ALA  78          3HB       ALA  78  75.180   4.086  -4.631
  501    H    GLY  79           H        GLY  79  71.732   3.850  -7.402
  502   1HA   GLY  79          2HA       GLY  79  72.083   6.242  -8.599
  503   2HA   GLY  79          1HA       GLY  79  73.562   5.400  -9.036
  504    H    CYS  80           H        CYS  80  70.042   4.820  -8.968
  505    HA   CYS  80           HA       CYS  80  69.856   2.875 -10.908
  506   1HB   CYS  80          2HB       CYS  80  67.882   5.142 -10.566
  507   2HB   CYS  80          1HB       CYS  80  67.549   3.553 -11.237
  508    H    SER  81           H        SER  81  70.605   6.222 -11.336
  509    HA   SER  81           HA       SER  81  71.125   5.779 -14.136
  510   1HB   SER  81          2HB       SER  81  69.155   7.920 -13.292
  511   2HB   SER  81          1HB       SER  81  69.786   7.695 -14.923
  512    HG   SER  81           HG       SER  81  68.827   5.358 -14.150
  513    H    HIS  82           HN       HIS  82  70.766   8.313 -11.670
  514    HA   HIS  82           HA       HIS  82  73.555   8.921 -11.747
  515   1HB   HIS  82          2HB       HIS  82  73.168  11.375 -12.270
  516   2HB   HIS  82          1HB       HIS  82  73.043  10.275 -13.634
  517    HD1  HIS  82           HD1      HIS  82  70.344  11.260 -11.114
  518    HD2  HIS  82           HD2      HIS  82  71.170  11.405 -15.188
  519    HE1  HIS  82           HE1      HIS  82  68.293  12.254 -12.227
  Start of MODEL   11
    1   1H    SER   1          1HT       SER   1  34.418   0.493 -11.067
    2   2H    SER   1          2HT       SER   1  35.114  -0.983 -10.623
    3   3H    SER   1          3HT       SER   1  36.070   0.412 -10.699
    4    HA   SER   1           HA       SER   1  34.987   1.368  -8.847
    5   1HB   SER   1          2HB       SER   1  33.227  -1.097  -8.831
    6   2HB   SER   1          1HB       SER   1  33.116   0.283  -7.737
    7    HG   SER   1           HG       SER   1  31.619   0.238  -9.601
    8    H    ALA   2           H        ALA   2  35.783   0.967  -6.759
    9    HA   ALA   2           HA       ALA   2  36.760  -1.670  -6.080
   10   1HB   ALA   2          1HB       ALA   2  38.683   0.637  -6.387
   11   2HB   ALA   2          2HB       ALA   2  38.611  -0.793  -7.416
   12   3HB   ALA   2          3HB       ALA   2  39.072  -0.951  -5.722
   13    H    ARG   3           H        ARG   3  37.706  -1.675  -3.862
   14    HA   ARG   3           HA       ARG   3  37.021   0.633  -2.223
   15   1HB   ARG   3          2HB       ARG   3  35.677  -2.001  -2.071
   16   2HB   ARG   3          1HB       ARG   3  36.165  -1.297  -0.534
   17   1HG   ARG   3          2HG       ARG   3  34.923   0.759  -1.136
   18   2HG   ARG   3          1HG       ARG   3  34.366  -0.052  -2.603
   19   1HD   ARG   3          2HD       ARG   3  33.199  -1.700  -1.333
   20   2HD   ARG   3          1HD       ARG   3  33.916  -1.128   0.172
   21    HE   ARG   3           HE       ARG   3  32.522   0.999  -0.974
   22   1HH1  ARG   3          1HH1      ARG   3  31.843  -2.141   0.405
   23   2HH1  ARG   3          2HH1      ARG   3  30.279  -1.693   0.999
   24   1HH2  ARG   3          1HH2      ARG   3  30.454   1.609  -0.187
   25   2HH2  ARG   3          2HH2      ARG   3  29.487   0.451   0.664
   26    H    THR   4           H        THR   4  38.556  -2.538  -2.462
   27    HA   THR   4           HA       THR   4  40.440  -1.696  -0.369
   28    HB   THR   4           HB       THR   4  40.998  -4.173  -0.259
   29    HG1  THR   4           HG1      THR   4  40.093  -5.192  -1.915
   30   1HG2  THR   4          1HG2      THR   4  39.649  -3.074   1.453
   31   2HG2  THR   4          2HG2      THR   4  39.046  -4.701   1.140
   32   3HG2  THR   4          3HG2      THR   4  38.197  -3.303   0.479
   33    H    CYS   5           H        CYS   5  40.225  -1.580  -3.543
   34    HA   CYS   5           HA       CYS   5  41.695  -1.347  -5.250
   35   1HB   CYS   5          2HB       CYS   5  43.196  -0.788  -2.962
   36   2HB   CYS   5          1HB       CYS   5  44.180  -1.946  -3.853
   37    HA   PRO   6           HA       PRO   6  42.548  -5.465  -6.671
   38   1HB   PRO   6          2HB       PRO   6  44.586  -5.140  -8.425
   39   2HB   PRO   6          1HB       PRO   6  42.942  -4.589  -8.765
   40   1HG   PRO   6          2HG       PRO   6  45.307  -3.024  -7.812
   41   2HG   PRO   6          1HG       PRO   6  44.102  -2.596  -9.041
   42   1HD   PRO   6          2HD       PRO   6  44.030  -1.647  -6.500
   43   2HD   PRO   6          1HD       PRO   6  42.570  -1.905  -7.475
   44    HA   PRO   7           HA       PRO   7  45.815  -7.605  -4.519
   45   1HB   PRO   7          2HB       PRO   7  46.772  -8.610  -7.162
   46   2HB   PRO   7          1HB       PRO   7  46.410  -9.505  -5.681
   47   1HG   PRO   7          2HG       PRO   7  44.712  -9.540  -7.728
   48   2HG   PRO   7          1HG       PRO   7  44.118  -9.461  -6.059
   49   1HD   PRO   7          2HD       PRO   7  44.273  -7.313  -8.122
   50   2HD   PRO   7          1HD       PRO   7  43.055  -7.581  -6.860
   51    H    ASN   8           H        ASN   8  47.806  -7.119  -3.845
   52    HA   ASN   8           HA       ASN   8  49.889  -6.235  -3.684
   53   1HB   ASN   8          2HB       ASN   8  50.120  -7.361  -6.008
   54   2HB   ASN   8          1HB       ASN   8  49.957  -5.730  -6.650
   55   1HD2  ASN   8          1HD2      ASN   8  51.623  -4.252  -6.347
   56   2HD2  ASN   8          2HD2      ASN   8  53.189  -4.727  -5.790
   57    H    GLN   9           H        GLN   9  47.306  -4.677  -3.907
   58    HA   GLN   9           HA       GLN   9  48.561  -2.033  -4.133
   59   1HB   GLN   9          2HB       GLN   9  46.266  -3.059  -5.562
   60   2HB   GLN   9          1HB       GLN   9  45.812  -1.681  -4.572
   61   1HG   GLN   9          2HG       GLN   9  46.383  -0.886  -6.727
   62   2HG   GLN   9          1HG       GLN   9  47.648  -0.395  -5.606
   63   1HE2  GLN   9          1HE2      GLN   9  47.337  -3.637  -6.855
   64   2HE2  GLN   9          2HE2      GLN   9  48.756  -3.610  -7.825
   65    H    PHE  10           H        PHE  10  46.832  -0.404  -3.127
   66    HA   PHE  10           HA       PHE  10  45.637  -1.422  -0.686
   67   1HB   PHE  10          2HB       PHE  10  47.941  -1.111   0.008
   68   2HB   PHE  10          1HB       PHE  10  47.980   0.499  -0.695
   69    HD1  PHE  10           HD1      PHE  10  47.397   2.354   0.554
   70    HD2  PHE  10           HD2      PHE  10  46.390  -1.521   1.986
   71    HE1  PHE  10           HE1      PHE  10  46.706   3.332   2.696
   72    HE2  PHE  10           HE2      PHE  10  45.706  -0.548   4.150
   73    HZ   PHE  10           HZ       PHE  10  45.863   1.888   4.501
   74    H    SER  11           H        SER  11  43.976  -0.090  -0.031
   75    HA   SER  11           HA       SER  11  43.481   2.201  -1.726
   76   1HB   SER  11          2HB       SER  11  41.614   0.379  -0.247
   77   2HB   SER  11          1HB       SER  11  41.088   1.957  -0.833
   78    HG   SER  11           HG       SER  11  41.780   1.278  -2.931
   79    H    CYS  12           H        CYS  12  43.971   4.047  -0.907
   80    HA   CYS  12           HA       CYS  12  44.194   4.774   1.761
   81   1HB   CYS  12          2HB       CYS  12  45.061   6.129  -0.097
   82   2HB   CYS  12          1HB       CYS  12  43.417   6.479  -0.613
   83    H    ALA  13           H        ALA  13  42.782   5.690   3.211
   84    HA   ALA  13           HA       ALA  13  40.580   4.472   3.869
   85   1HB   ALA  13          1HB       ALA  13  40.810   7.458   4.117
   86   2HB   ALA  13          2HB       ALA  13  41.574   6.275   5.181
   87   3HB   ALA  13          3HB       ALA  13  39.815   6.398   5.115
   88    H    SER  14           H        SER  14  39.175   3.746   2.437
   89    HA   SER  14           HA       SER  14  37.376   3.643   1.061
   90   1HB   SER  14          2HB       SER  14  36.506   5.892   2.875
   91   2HB   SER  14          1HB       SER  14  35.438   4.882   1.904
   92    HG   SER  14           HG       SER  14  36.791   4.307   4.254
   93    H    GLY  15           H        GLY  15  38.647   4.443  -0.814
   94   1HA   GLY  15          2HA       GLY  15  37.112   5.717  -2.555
   95   2HA   GLY  15          1HA       GLY  15  37.779   7.091  -1.691
   96    H    ARG  16           H        ARG  16  40.418   6.130  -1.321
   97    HA   ARG  16           HA       ARG  16  41.297   6.708  -4.041
   98   1HB   ARG  16          2HB       ARG  16  42.887   6.782  -1.470
   99   2HB   ARG  16          1HB       ARG  16  43.429   7.348  -3.040
  100   1HG   ARG  16          2HG       ARG  16  42.851   9.290  -1.884
  101   2HG   ARG  16          1HG       ARG  16  41.473   8.989  -2.941
  102   1HD   ARG  16          2HD       ARG  16  40.297   7.923  -1.034
  103   2HD   ARG  16          1HD       ARG  16  41.658   8.334   0.008
  104    HE   ARG  16           HE       ARG  16  40.953  10.727  -1.021
  105   1HH1  ARG  16          1HH1      ARG  16  39.116   8.204   0.586
  106   2HH1  ARG  16          2HH1      ARG  16  37.938   9.300   1.218
  107   1HH2  ARG  16          1HH2      ARG  16  39.392  12.174  -0.179
  108   2HH2  ARG  16          2HH2      ARG  16  38.097  11.548   0.794
  109    H    CYS  17           H        CYS  17  43.652   5.668  -4.425
  110    HA   CYS  17           HA       CYS  17  43.768   2.908  -3.630
  111   1HB   CYS  17          2HB       CYS  17  42.239   3.604  -5.923
  112   2HB   CYS  17          1HB       CYS  17  43.721   2.842  -6.494
  113    H    ILE  18           H        ILE  18  45.838   2.762  -3.217
  114    HA   ILE  18           HA       ILE  18  47.766   3.888  -5.139
  115    HB   ILE  18           HB       ILE  18  49.210   4.446  -3.322
  116   1HG1  ILE  18          2HG1      ILE  18  47.320   3.130  -1.384
  117   2HG1  ILE  18          1HG1      ILE  18  48.654   2.246  -2.124
  118   1HG2  ILE  18          1HG2      ILE  18  47.312   5.990  -3.563
  119   2HG2  ILE  18          2HG2      ILE  18  47.830   5.878  -1.880
  120   3HG2  ILE  18          3HG2      ILE  18  46.379   5.022  -2.415
  121   1HD1  ILE  18          1HD1      ILE  18  50.248   3.761  -1.139
  122   2HD1  ILE  18          2HD1      ILE  18  49.193   3.092   0.108
  123   3HD1  ILE  18          3HD1      ILE  18  48.938   4.738  -0.470
  124    HA   PRO  19           HA       PRO  19  49.429  -0.301  -5.131
  125   1HB   PRO  19          2HB       PRO  19  52.190   0.563  -5.212
  126   2HB   PRO  19          1HB       PRO  19  51.200  -0.091  -6.519
  127   1HG   PRO  19          2HG       PRO  19  52.077   2.499  -6.431
  128   2HG   PRO  19          1HG       PRO  19  50.611   1.978  -7.281
  129   1HD   PRO  19          2HD       PRO  19  50.885   3.282  -4.598
  130   2HD   PRO  19          1HD       PRO  19  49.674   3.559  -5.871
  131    H    ILE  20           H        ILE  20  50.701  -1.825  -3.876
  132    HA   ILE  20           HA       ILE  20  50.907  -1.081  -1.108
  133    HB   ILE  20           HB       ILE  20  50.228  -3.386  -2.173
  134   1HG1  ILE  20          2HG1      ILE  20  50.835  -4.501  -0.058
  135   2HG1  ILE  20          1HG1      ILE  20  51.914  -3.159   0.316
  136   1HG2  ILE  20          1HG2      ILE  20  53.197  -3.740  -1.864
  137   2HG2  ILE  20          2HG2      ILE  20  52.284  -3.810  -3.371
  138   3HG2  ILE  20          3HG2      ILE  20  52.034  -5.039  -2.131
  139   1HD1  ILE  20          1HD1      ILE  20  49.822  -2.954   1.520
  140   2HD1  ILE  20          2HD1      ILE  20  48.925  -3.002   0.002
  141   3HD1  ILE  20          3HD1      ILE  20  49.992  -1.643   0.352
  142    H    SER  21           H        SER  21  52.976  -1.959   0.058
  143    HA   SER  21           HA       SER  21  55.182  -1.717   0.511
  144   1HB   SER  21          2HB       SER  21  55.557  -2.686  -1.801
  145   2HB   SER  21          1HB       SER  21  55.644  -1.032  -2.403
  146    HG   SER  21           HG       SER  21  57.473  -2.497  -0.925
  147    H    TRP  22           H        TRP  22  53.031   0.485  -0.228
  148    HA   TRP  22           HA       TRP  22  54.829   2.808  -0.056
  149   1HB   TRP  22          2HB       TRP  22  51.912   2.601  -0.786
  150   2HB   TRP  22          1HB       TRP  22  52.744   4.134  -0.559
  151    HD1  TRP  22           HD1      TRP  22  53.865   1.008  -2.572
  152    HE1  TRP  22           HE1      TRP  22  54.377   1.766  -4.957
  153    HE3  TRP  22           HE3      TRP  22  52.600   5.940  -2.164
  154    HZ2  TRP  22           HZ2      TRP  22  54.285   4.134  -6.490
  155    HZ3  TRP  22           HZ3      TRP  22  52.845   7.385  -4.138
  156    HH2  TRP  22           HH2      TRP  22  53.668   6.501  -6.254
  157    H    THR  23           H        THR  23  52.510   1.047   1.770
  158    HA   THR  23           HA       THR  23  51.418   3.174   3.221
  159    HB   THR  23           HB       THR  23  50.393   1.471   4.641
  160    HG1  THR  23           HG1      THR  23  51.385  -0.372   4.882
  161   1HG2  THR  23          1HG2      THR  23  49.381   1.927   2.482
  162   2HG2  THR  23          2HG2      THR  23  49.219   0.219   2.894
  163   3HG2  THR  23          3HG2      THR  23  50.432   0.727   1.719
  164    H    CYS  24           H        CYS  24  53.211   0.562   4.654
  165    HA   CYS  24           HA       CYS  24  53.751   2.185   6.967
  166   1HB   CYS  24          2HB       CYS  24  54.258  -0.737   6.484
  167   2HB   CYS  24          1HB       CYS  24  54.232   0.084   8.041
  168    H    ASP  25           H        ASP  25  55.571   3.514   6.071
  169    HA   ASP  25           HA       ASP  25  58.020   2.073   6.585
  170   1HB   ASP  25          2HB       ASP  25  59.152   3.117   4.514
  171   2HB   ASP  25          1HB       ASP  25  58.205   1.650   4.330
  172    H    LEU  26           H        LEU  26  57.684   5.287   4.974
  173    HA   LEU  26           HA       LEU  26  58.786   6.416   7.434
  174   1HB   LEU  26          2HB       LEU  26  60.335   6.184   4.885
  175   2HB   LEU  26          1HB       LEU  26  60.661   7.492   6.007
  176    HG   LEU  26           HG       LEU  26  60.822   4.546   6.672
  177   1HD1  LEU  26          1HD1      LEU  26  62.994   6.589   6.206
  178   2HD1  LEU  26          2HD1      LEU  26  62.592   5.237   5.145
  179   3HD1  LEU  26          3HD1      LEU  26  63.237   4.933   6.759
  180   1HD2  LEU  26          1HD2      LEU  26  61.866   5.325   8.748
  181   2HD2  LEU  26          2HD2      LEU  26  60.203   5.893   8.596
  182   3HD2  LEU  26          3HD2      LEU  26  61.545   6.994   8.281
  183    H    ASP  27           H        ASP  27  57.328   7.131   4.245
  184    HA   ASP  27           HA       ASP  27  57.197   9.888   5.243
  185   1HB   ASP  27          2HB       ASP  27  57.411  10.799   2.977
  186   2HB   ASP  27          1HB       ASP  27  58.831   9.913   3.501
  187    H    ASP  28           H        ASP  28  55.625   9.914   2.253
  188    HA   ASP  28           HA       ASP  28  53.259  10.400   3.958
  189   1HB   ASP  28          2HB       ASP  28  54.483  12.448   3.307
  190   2HB   ASP  28          1HB       ASP  28  54.189  12.061   1.617
  191    H    ASP  29           H        ASP  29  52.182   8.473   3.376
  192    HA   ASP  29           HA       ASP  29  50.765   8.827   0.825
  193   1HB   ASP  29          2HB       ASP  29  51.731   6.388   2.179
  194   2HB   ASP  29          1HB       ASP  29  50.084   6.298   1.559
  195    H    CYS  30           H        CYS  30  48.830   6.724   2.043
  196    HA   CYS  30           HA       CYS  30  47.692   7.914   4.303
  197   1HB   CYS  30          2HB       CYS  30  45.664   8.887   3.375
  198   2HB   CYS  30          1HB       CYS  30  47.083   9.709   2.744
  199    H    GLY  31           H        GLY  31  47.552   5.819   5.019
  200   1HA   GLY  31          2HA       GLY  31  45.578   4.073   3.798
  201   2HA   GLY  31          1HA       GLY  31  46.340   3.855   5.380
  202    H    ASP  32           H        ASP  32  45.929   6.331   6.396
  203    HA   ASP  32           HA       ASP  32  43.270   7.311   5.977
  204   1HB   ASP  32          2HB       ASP  32  42.733   5.475   7.561
  205   2HB   ASP  32          1HB       ASP  32  43.881   6.148   8.714
  206    H    ARG  33           H        ARG  33  44.928   8.834   5.358
  207    HA   ARG  33           HA       ARG  33  46.132  10.717   5.545
  208   1HB   ARG  33          2HB       ARG  33  45.486  12.306   7.045
  209   2HB   ARG  33          1HB       ARG  33  44.127  11.204   7.190
  210   1HG   ARG  33          2HG       ARG  33  45.679  10.185   9.098
  211   2HG   ARG  33          1HG       ARG  33  46.271  11.849   9.120
  212   1HD   ARG  33          2HD       ARG  33  44.468  11.625  10.703
  213   2HD   ARG  33          1HD       ARG  33  43.937  12.636   9.360
  214    HE   ARG  33           HE       ARG  33  43.226   9.769   9.608
  215   1HH1  ARG  33          1HH1      ARG  33  42.396  13.078   8.805
  216   2HH1  ARG  33          2HH1      ARG  33  40.755  12.687   8.381
  217   1HH2  ARG  33          1HH2      ARG  33  41.106   9.243   9.036
  218   2HH2  ARG  33          2HH2      ARG  33  40.027  10.499   8.496
  219    H    SER  34           H        SER  34  46.500   8.449   8.185
  220    HA   SER  34           HA       SER  34  49.383   8.685   7.857
  221   1HB   SER  34          2HB       SER  34  48.041   8.713  10.573
  222   2HB   SER  34          1HB       SER  34  49.778   8.731  10.267
  223    HG   SER  34           HG       SER  34  48.864  10.722   8.881
  224    H    ASP  35           H        ASP  35  49.059   6.729   6.705
  225    HA   ASP  35           HA       ASP  35  48.340   4.331   8.192
  226   1HB   ASP  35          2HB       ASP  35  49.186   3.154   6.118
  227   2HB   ASP  35          1HB       ASP  35  47.793   4.203   5.898
  228    H    GLU  36           H        GLU  36  50.317   5.967   9.248
  229    HA   GLU  36           HA       GLU  36  52.797   4.439   8.896
  230   1HB   GLU  36          2HB       GLU  36  52.176   7.254   9.602
  231   2HB   GLU  36          1HB       GLU  36  53.558   6.528  10.411
  232   1HG   GLU  36          2HG       GLU  36  53.182   6.589   7.431
  233   2HG   GLU  36          1HG       GLU  36  54.137   7.758   8.347
  234    H    SER  37           H        SER  37  52.777   2.805  10.202
  235    HA   SER  37           HA       SER  37  52.938   1.567  12.088
  236   1HB   SER  37          2HB       SER  37  52.980   4.246  13.497
  237   2HB   SER  37          1HB       SER  37  53.380   2.697  14.241
  238    HG   SER  37           HG       SER  37  54.719   3.854  12.013
  239    H    ALA  38           H        ALA  38  50.313   2.860  11.053
  240    HA   ALA  38           HA       ALA  38  48.646   2.448  13.411
  241   1HB   ALA  38          1HB       ALA  38  46.827   3.376  12.077
  242   2HB   ALA  38          2HB       ALA  38  47.879   3.421  10.662
  243   3HB   ALA  38          3HB       ALA  38  48.226   4.448  12.054
  244    H    SER  39           H        SER  39  50.073   0.422  11.627
  245    HA   SER  39           HA       SER  39  48.026  -1.569  11.721
  246   1HB   SER  39          2HB       SER  39  48.299  -2.126   9.240
  247   2HB   SER  39          1HB       SER  39  47.356  -0.679   9.601
  248    HG   SER  39           HG       SER  39  49.528  -0.876   8.100
  249    H    CYS  40           H        CYS  40  51.131  -0.739  10.223
  250    HA   CYS  40           HA       CYS  40  52.106  -3.447  10.713
  251   1HB   CYS  40          2HB       CYS  40  53.594  -1.231   9.328
  252   2HB   CYS  40          1HB       CYS  40  53.853  -2.966   9.195
  253    H    ALA  41           H        ALA  41  53.351  -3.959  12.367
  254    HA   ALA  41           HA       ALA  41  54.710  -1.876  13.887
  255   1HB   ALA  41          1HB       ALA  41  55.322  -3.666  15.424
  256   2HB   ALA  41          2HB       ALA  41  54.645  -4.866  14.323
  257   3HB   ALA  41          3HB       ALA  41  53.587  -3.692  15.109
  258    H    TYR  42           H        TYR  42  56.301  -1.145  12.585
  259    HA   TYR  42           HA       TYR  42  57.696  -2.559  10.648
  260   1HB   TYR  42          2HB       TYR  42  58.814  -0.177  12.139
  261   2HB   TYR  42          1HB       TYR  42  59.243  -0.705  10.522
  262    HD1  TYR  42           HD1      TYR  42  58.717   2.003  10.595
  263    HD2  TYR  42           HD2      TYR  42  55.847  -1.134  10.590
  264    HE1  TYR  42           HE1      TYR  42  57.027   3.555   9.702
  265    HE2  TYR  42           HE2      TYR  42  54.162   0.405   9.698
  266    HH   TYR  42           HH       TYR  42  54.918   3.538   8.526
  267    HA   PRO  43           HA       PRO  43  60.755  -4.587  13.296
  268   1HB   PRO  43          2HB       PRO  43  61.099  -6.764  11.762
  269   2HB   PRO  43          1HB       PRO  43  59.698  -6.594  12.822
  270   1HG   PRO  43          2HG       PRO  43  59.883  -6.307   9.873
  271   2HG   PRO  43          1HG       PRO  43  58.541  -6.895  10.866
  272   1HD   PRO  43          2HD       PRO  43  58.810  -4.315   9.761
  273   2HD   PRO  43          1HD       PRO  43  57.629  -4.824  10.984
  274    H    THR  44           H        THR  44  60.658  -3.652  10.010
  275    HA   THR  44           HA       THR  44  63.290  -2.663   9.906
  276    HB   THR  44           HB       THR  44  63.886  -5.056   9.748
  277    HG1  THR  44           HG1      THR  44  64.217  -3.433   7.447
  278   1HG2  THR  44          1HG2      THR  44  62.187  -5.071   7.245
  279   2HG2  THR  44          2HG2      THR  44  61.793  -5.884   8.759
  280   3HG2  THR  44          3HG2      THR  44  63.196  -6.399   7.825
  281    H    CYS  45           H        CYS  45  60.454  -2.065   9.308
  282    HA   CYS  45           HA       CYS  45  59.064  -1.145   7.788
  283   1HB   CYS  45          2HB       CYS  45  61.641  -0.742   6.275
  284   2HB   CYS  45          1HB       CYS  45  60.087  -0.134   5.718
  285    H    PHE  46           H        PHE  46  57.612  -2.199   6.683
  286    HA   PHE  46           HA       PHE  46  58.135  -3.689   4.354
  287   1HB   PHE  46          2HB       PHE  46  59.007  -5.277   6.107
  288   2HB   PHE  46          1HB       PHE  46  57.373  -5.376   6.746
  289    HD1  PHE  46           HD1      PHE  46  59.565  -6.237   3.937
  290    HD2  PHE  46           HD2      PHE  46  55.683  -6.677   5.628
  291    HE1  PHE  46           HE1      PHE  46  59.094  -8.071   2.374
  292    HE2  PHE  46           HE2      PHE  46  55.206  -8.517   4.066
  293    HZ   PHE  46           HZ       PHE  46  56.915  -9.216   2.436
  294    HA   PRO  47           HA       PRO  47  53.708  -2.487   4.816
  295   1HB   PRO  47          2HB       PRO  47  53.650  -0.818   2.713
  296   2HB   PRO  47          1HB       PRO  47  54.151  -0.267   4.314
  297   1HG   PRO  47          2HG       PRO  47  55.821  -0.984   1.953
  298   2HG   PRO  47          1HG       PRO  47  56.018   0.349   3.104
  299   1HD   PRO  47          2HD       PRO  47  57.438  -1.993   3.209
  300   2HD   PRO  47          1HD       PRO  47  57.117  -0.957   4.612
  301    H    LEU  48           H        LEU  48  54.716  -4.832   3.929
  302    HA   LEU  48           HA       LEU  48  54.556  -6.524   2.454
  303   1HB   LEU  48          2HB       LEU  48  52.680  -4.645   1.026
  304   2HB   LEU  48          1HB       LEU  48  53.079  -6.240   0.415
  305    HG   LEU  48           HG       LEU  48  52.243  -7.070   2.736
  306   1HD1  LEU  48          1HD1      LEU  48  50.464  -5.673   3.681
  307   2HD1  LEU  48          2HD1      LEU  48  50.886  -4.381   2.557
  308   3HD1  LEU  48          3HD1      LEU  48  52.042  -4.891   3.788
  309   1HD2  LEU  48          1HD2      LEU  48  51.193  -7.597   0.621
  310   2HD2  LEU  48          2HD2      LEU  48  50.383  -6.030   0.610
  311   3HD2  LEU  48          3HD2      LEU  48  49.967  -7.226   1.836
  312    H    THR  49           H        THR  49  56.308  -7.011   1.436
  313    HA   THR  49           HA       THR  49  57.963  -7.130  -0.066
  314    HB   THR  49           HB       THR  49  57.579  -6.450  -2.354
  315    HG1  THR  49           HG1      THR  49  55.902  -4.599  -1.183
  316   1HG2  THR  49          1HG2      THR  49  54.989  -7.349  -1.095
  317   2HG2  THR  49          2HG2      THR  49  56.333  -8.402  -1.542
  318   3HG2  THR  49          3HG2      THR  49  55.439  -7.532  -2.790
  319    H    GLN  50           H        GLN  50  59.430  -5.945   1.312
  320    HA   GLN  50           HA       GLN  50  60.346  -3.510   0.045
  321   1HB   GLN  50          2HB       GLN  50  59.034  -3.491   2.682
  322   2HB   GLN  50          1HB       GLN  50  60.559  -2.619   2.599
  323   1HG   GLN  50          2HG       GLN  50  59.342  -1.726   0.356
  324   2HG   GLN  50          1HG       GLN  50  57.957  -2.013   1.408
  325   1HE2  GLN  50          1HE2      GLN  50  57.643   0.282   1.271
  326   2HE2  GLN  50          2HE2      GLN  50  58.532   1.332   2.318
  327    H    PHE  51           H        PHE  51  62.261  -2.605   1.214
  328    HA   PHE  51           HA       PHE  51  63.981  -4.566   2.539
  329   1HB   PHE  51          2HB       PHE  51  64.412  -4.693   0.064
  330   2HB   PHE  51          1HB       PHE  51  64.799  -2.977   0.077
  331    HD1  PHE  51           HD1      PHE  51  65.876  -6.222   1.602
  332    HD2  PHE  51           HD2      PHE  51  66.987  -2.309   0.369
  333    HE1  PHE  51           HE1      PHE  51  68.235  -6.733   2.077
  334    HE2  PHE  51           HE2      PHE  51  69.319  -2.788   0.859
  335    HZ   PHE  51           HZ       PHE  51  69.965  -5.015   1.713
  336    H    THR  52           H        THR  52  66.173  -3.162   3.089
  337    HA   THR  52           HA       THR  52  65.366  -0.407   3.650
  338    HB   THR  52           HB       THR  52  64.880  -1.626   5.701
  339    HG1  THR  52           HG1      THR  52  66.160   0.532   5.601
  340   1HG2  THR  52          1HG2      THR  52  67.794  -2.409   5.702
  341   2HG2  THR  52          2HG2      THR  52  66.438  -3.502   5.424
  342   3HG2  THR  52          3HG2      THR  52  66.641  -2.727   6.997
  343    H    CYS  53           H        CYS  53  66.828   0.932   2.836
  344    HA   CYS  53           HA       CYS  53  69.447   0.280   2.070
  345   1HB   CYS  53          2HB       CYS  53  68.655   3.007   3.040
  346   2HB   CYS  53          1HB       CYS  53  69.859   2.587   1.829
  347    H    ASN  54           H        ASN  54  71.476   0.532   3.065
  348    HA   ASN  54           HA       ASN  54  71.573   0.172   5.882
  349   1HB   ASN  54          2HB       ASN  54  73.767   0.786   3.900
  350   2HB   ASN  54          1HB       ASN  54  74.058   0.465   5.607
  351   1HD2  ASN  54          1HD2      ASN  54  73.424  -0.871   2.532
  352   2HD2  ASN  54          2HD2      ASN  54  73.415  -2.533   3.000
  353    H    ASN  55           H        ASN  55  71.399   2.953   3.926
  354    HA   ASN  55           HA       ASN  55  72.530   4.879   5.615
  355   1HB   ASN  55          2HB       ASN  55  71.746   5.178   3.218
  356   2HB   ASN  55          1HB       ASN  55  70.110   5.283   3.854
  357   1HD2  ASN  55          1HD2      ASN  55  73.172   6.841   3.547
  358   2HD2  ASN  55          2HD2      ASN  55  72.679   8.393   4.125
  359    H    GLY  56           H        GLY  56  69.778   2.926   6.011
  360   1HA   GLY  56          2HA       GLY  56  68.530   2.902   8.060
  361   2HA   GLY  56          1HA       GLY  56  68.801   4.636   8.203
  362    H    ARG  57           H        ARG  57  68.101   3.715   5.062
  363    HA   ARG  57           HA       ARG  57  65.456   4.922   5.236
  364   1HB   ARG  57          2HB       ARG  57  67.184   4.118   2.900
  365   2HB   ARG  57          1HB       ARG  57  65.571   4.797   2.734
  366   1HG   ARG  57          2HG       ARG  57  66.227   6.882   3.370
  367   2HG   ARG  57          1HG       ARG  57  67.588   6.283   4.329
  368   1HD   ARG  57          2HD       ARG  57  68.826   5.734   2.340
  369   2HD   ARG  57          1HD       ARG  57  67.446   6.145   1.323
  370    HE   ARG  57           HE       ARG  57  68.046   8.418   2.790
  371   1HH1  ARG  57          1HH1      ARG  57  69.760   6.375   0.527
  372   2HH1  ARG  57          2HH1      ARG  57  70.594   7.698  -0.239
  373   1HH2  ARG  57          1HH2      ARG  57  69.185  10.166   1.813
  374   2HH2  ARG  57          2HH2      ARG  57  70.272   9.847   0.504
  375    H    CYS  58           H        CYS  58  63.599   3.922   4.343
  376    HA   CYS  58           HA       CYS  58  63.777   0.999   4.136
  377   1HB   CYS  58          2HB       CYS  58  61.316   2.698   4.602
  378   2HB   CYS  58          1HB       CYS  58  61.442   0.948   4.756
  379    H    ILE  59           H        ILE  59  63.489   0.122   2.139
  380    HA   ILE  59           HA       ILE  59  62.455   1.938   0.090
  381    HB   ILE  59           HB       ILE  59  64.031   0.766  -1.521
  382   1HG1  ILE  59          2HG1      ILE  59  65.451   0.157   1.082
  383   2HG1  ILE  59          1HG1      ILE  59  64.761  -1.033  -0.018
  384   1HG2  ILE  59          1HG2      ILE  59  64.241   3.069  -0.967
  385   2HG2  ILE  59          2HG2      ILE  59  65.849   2.337  -0.922
  386   3HG2  ILE  59          3HG2      ILE  59  64.993   2.677   0.582
  387   1HD1  ILE  59          1HD1      ILE  59  66.365  -0.554  -1.691
  388   2HD1  ILE  59          2HD1      ILE  59  67.252  -0.707  -0.172
  389   3HD1  ILE  59          3HD1      ILE  59  66.919   0.885  -0.841
  390    H    ASN  60           H        ASN  60  61.688   0.925  -1.871
  391    HA   ASN  60           HA       ASN  60  59.915  -1.233  -1.271
  392   1HB   ASN  60          2HB       ASN  60  60.574  -0.048  -3.979
  393   2HB   ASN  60          1HB       ASN  60  59.173  -1.031  -3.582
  394   1HD2  ASN  60          1HD2      ASN  60  58.624   0.270  -1.061
  395   2HD2  ASN  60          2HD2      ASN  60  58.010   1.842  -1.435
  396    H    ILE  61           H        ILE  61  59.913  -3.311  -2.297
  397    HA   ILE  61           HA       ILE  61  62.525  -4.442  -2.377
  398    HB   ILE  61           HB       ILE  61  60.403  -5.580  -1.556
  399   1HG1  ILE  61          2HG1      ILE  61  62.011  -7.161  -3.564
  400   2HG1  ILE  61          1HG1      ILE  61  62.626  -6.692  -1.983
  401   1HG2  ILE  61          1HG2      ILE  61  60.035  -5.981  -4.516
  402   2HG2  ILE  61          2HG2      ILE  61  58.960  -5.111  -3.420
  403   3HG2  ILE  61          3HG2      ILE  61  59.158  -6.857  -3.261
  404   1HD1  ILE  61          1HD1      ILE  61  61.822  -8.983  -2.006
  405   2HD1  ILE  61          2HD1      ILE  61  60.221  -8.423  -2.488
  406   3HD1  ILE  61          3HD1      ILE  61  60.871  -7.981  -0.908
  407    H    ASN  62           H        ASN  62  60.752  -2.830  -4.681
  408    HA   ASN  62           HA       ASN  62  61.637  -4.382  -6.970
  409   1HB   ASN  62          2HB       ASN  62  60.034  -1.824  -6.795
  410   2HB   ASN  62          1HB       ASN  62  60.399  -2.671  -8.294
  411   1HD2  ASN  62          1HD2      ASN  62  57.820  -2.061  -7.102
  412   2HD2  ASN  62          2HD2      ASN  62  57.024  -3.576  -6.872
  413    H    TRP  63           H        TRP  63  63.331  -2.617  -5.040
  414    HA   TRP  63           HA       TRP  63  64.696  -1.026  -7.111
  415   1HB   TRP  63          2HB       TRP  63  64.865  -0.854  -4.090
  416   2HB   TRP  63          1HB       TRP  63  65.779   0.151  -5.207
  417    HD1  TRP  63           HD1      TRP  63  62.020  -0.570  -5.674
  418    HE1  TRP  63           HE1      TRP  63  60.730   1.649  -5.445
  419    HE3  TRP  63           HE3      TRP  63  65.857   2.456  -4.205
  420    HZ2  TRP  63           HZ2      TRP  63  61.267   4.315  -4.738
  421    HZ3  TRP  63           HZ3      TRP  63  65.384   4.831  -3.766
  422    HH2  TRP  63           HH2      TRP  63  63.138   5.736  -4.024
  423    H    ARG  64           H        ARG  64  64.661  -3.936  -6.052
  424    HA   ARG  64           HA       ARG  64  67.438  -4.592  -5.695
  425   1HB   ARG  64          2HB       ARG  64  65.418  -5.943  -4.891
  426   2HB   ARG  64          1HB       ARG  64  65.159  -6.389  -6.567
  427   1HG   ARG  64          2HG       ARG  64  66.440  -8.151  -6.156
  428   2HG   ARG  64          1HG       ARG  64  67.806  -7.031  -6.124
  429   1HD   ARG  64          2HD       ARG  64  67.713  -8.472  -4.116
  430   2HD   ARG  64          1HD       ARG  64  67.588  -6.756  -3.729
  431    HE   ARG  64           HE       ARG  64  64.994  -7.655  -3.958
  432   1HH1  ARG  64          1HH1      ARG  64  67.783  -8.475  -1.968
  433   2HH1  ARG  64          2HH1      ARG  64  66.806  -8.946  -0.611
  434   1HH2  ARG  64          1HH2      ARG  64  63.732  -8.287  -2.152
  435   2HH2  ARG  64          2HH2      ARG  64  64.517  -8.844  -0.714
  436    H    CYS  65           H        CYS  65  68.707  -3.994  -7.439
  437    HA   CYS  65           HA       CYS  65  67.564  -4.458 -10.112
  438   1HB   CYS  65          2HB       CYS  65  69.414  -2.215  -9.330
  439   2HB   CYS  65          1HB       CYS  65  68.614  -2.432 -10.883
  440    H    ASP  66           H        ASP  66  70.691  -3.673  -8.715
  441    HA   ASP  66           HA       ASP  66  72.043  -4.837 -10.966
  442   1HB   ASP  66          2HB       ASP  66  73.309  -3.722  -8.465
  443   2HB   ASP  66          1HB       ASP  66  73.993  -3.804 -10.087
  444    H    ASN  67           H        ASN  67  72.508  -5.277  -7.462
  445    HA   ASN  67           HA       ASN  67  72.976  -8.109  -7.987
  446   1HB   ASN  67          2HB       ASN  67  75.040  -7.250  -7.217
  447   2HB   ASN  67          1HB       ASN  67  74.258  -6.248  -6.000
  448   1HD2  ASN  67          1HD2      ASN  67  73.786  -7.069  -4.040
  449   2HD2  ASN  67          2HD2      ASN  67  74.241  -8.668  -3.537
  450    H    ASP  68           H        ASP  68  71.938  -5.849  -5.517
  451    HA   ASP  68           HA       ASP  68  69.671  -7.589  -4.873
  452   1HB   ASP  68          2HB       ASP  68  71.595  -7.873  -3.204
  453   2HB   ASP  68          1HB       ASP  68  71.296  -6.208  -2.725
  454    H    ASN  69           H        ASN  69  69.323  -5.418  -2.593
  455    HA   ASN  69           HA       ASN  69  67.655  -3.797  -4.413
  456   1HB   ASN  69          2HB       ASN  69  66.662  -5.431  -2.714
  457   2HB   ASN  69          1HB       ASN  69  67.203  -4.310  -1.476
  458   1HD2  ASN  69          1HD2      ASN  69  66.586  -1.887  -2.842
  459   2HD2  ASN  69          2HD2      ASN  69  64.860  -1.782  -2.918
  460    H    ASP  70           H        ASP  70  67.914  -1.632  -4.485
  461    HA   ASP  70           HA       ASP  70  69.548  -0.379  -2.374
  462   1HB   ASP  70          2HB       ASP  70  70.603  -0.999  -4.739
  463   2HB   ASP  70          1HB       ASP  70  69.908   0.568  -5.143
  464    H    CYS  71           H        CYS  71  69.767   2.133  -3.457
  465    HA   CYS  71           HA       CYS  71  67.196   3.256  -4.034
  466   1HB   CYS  71          2HB       CYS  71  67.152   4.569  -1.843
  467   2HB   CYS  71          1HB       CYS  71  66.677   2.875  -1.764
  468    H    GLY  72           H        GLY  72  70.209   4.143  -2.302
  469   1HA   GLY  72          2HA       GLY  72  71.495   5.590  -4.190
  470   2HA   GLY  72          1HA       GLY  72  70.263   6.709  -3.627
  471    H    ASP  73           H        ASP  73  72.285   4.340  -1.903
  472    HA   ASP  73           HA       ASP  73  73.948   6.447  -0.846
  473   1HB   ASP  73          2HB       ASP  73  73.616   5.522   1.540
  474   2HB   ASP  73          1HB       ASP  73  72.386   6.600   0.898
  475    H    ASN  74           H        ASN  74  73.252   3.184   0.281
  476    HA   ASN  74           HA       ASN  74  75.185   1.840  -1.226
  477   1HB   ASN  74          2HB       ASN  74  76.656   3.200   0.422
  478   2HB   ASN  74          1HB       ASN  74  76.030   2.121   1.662
  479   1HD2  ASN  74          1HD2      ASN  74  75.967  -0.216  -0.128
  480   2HD2  ASN  74          2HD2      ASN  74  77.612  -0.685  -0.348
  481    H    SER  75           H        SER  75  72.770   1.179  -1.068
  482    HA   SER  75           HA       SER  75  72.045  -0.269   1.298
  483   1HB   SER  75          2HB       SER  75  70.380   1.007  -0.023
  484   2HB   SER  75          1HB       SER  75  70.635  -0.111  -1.362
  485    HG   SER  75           HG       SER  75  69.566  -1.644  -0.321
  486    H    ASP  76           H        ASP  76  71.977  -1.259  -2.029
  487    HA   ASP  76           HA       ASP  76  72.933  -3.920  -1.340
  488   1HB   ASP  76          2HB       ASP  76  71.166  -3.941  -2.914
  489   2HB   ASP  76          1HB       ASP  76  71.879  -2.630  -3.848
  490    H    GLU  77           H        GLU  77  73.652  -1.300  -3.581
  491    HA   GLU  77           HA       GLU  77  76.484  -1.447  -3.137
  492   1HB   GLU  77          2HB       GLU  77  76.922  -1.845  -5.662
  493   2HB   GLU  77          1HB       GLU  77  76.642  -3.214  -4.601
  494   1HG   GLU  77          2HG       GLU  77  75.475  -3.553  -6.649
  495   2HG   GLU  77          1HG       GLU  77  74.304  -3.286  -5.364
  496    H    ALA  78           H        ALA  78  73.846   0.313  -3.828
  497    HA   ALA  78           HA       ALA  78  73.566   2.536  -4.113
  498   1HB   ALA  78          1HB       ALA  78  75.447   4.059  -4.203
  499   2HB   ALA  78          2HB       ALA  78  76.552   2.711  -4.472
  500   3HB   ALA  78          3HB       ALA  78  75.689   2.853  -2.940
  501    H    GLY  79           H        GLY  79  73.615   0.544  -6.322
  502   1HA   GLY  79          2HA       GLY  79  74.263   2.310  -8.587
  503   2HA   GLY  79          1HA       GLY  79  74.018   0.572  -8.675
  504    H    CYS  80           H        CYS  80  72.306   0.120  -9.824
  505    HA   CYS  80           HA       CYS  80  70.322   0.319 -10.917
  506   1HB   CYS  80          2HB       CYS  80  69.647  -0.439  -8.622
  507   2HB   CYS  80          1HB       CYS  80  69.313   1.242  -8.216
  508    H    SER  81           H        SER  81  72.009   2.703 -10.945
  509    HA   SER  81           HA       SER  81  69.965   4.801 -11.202
  510   1HB   SER  81          2HB       SER  81  72.944   5.087 -10.755
  511   2HB   SER  81          1HB       SER  81  71.794   6.417 -10.886
  512    HG   SER  81           HG       SER  81  71.542   4.362  -8.944
  513    H    HIS  82           HN       HIS  82  70.972   2.667 -13.129
  514    HA   HIS  82           HA       HIS  82  71.079   4.369 -15.445
  515   1HB   HIS  82          2HB       HIS  82  73.468   4.288 -14.794
  516   2HB   HIS  82          1HB       HIS  82  73.418   2.531 -14.838
  517    HD1  HIS  82           HD1      HIS  82  72.777   1.547 -17.328
  518    HD2  HIS  82           HD2      HIS  82  74.259   5.418 -17.080
  519    HE1  HIS  82           HE1      HIS  82  73.653   2.120 -19.634
  Start of MODEL   12
    1   1H    SER   1          1HT       SER   1  41.150  -2.514  -7.257
    2   2H    SER   1          2HT       SER   1  40.424  -3.393  -6.006
    3   3H    SER   1          3HT       SER   1  39.501  -2.314  -6.923
    4    HA   SER   1           HA       SER   1  39.735  -3.644  -8.874
    5   1HB   SER   1          2HB       SER   1  41.314  -5.558  -7.139
    6   2HB   SER   1          1HB       SER   1  40.980  -5.722  -8.864
    7    HG   SER   1           HG       SER   1  42.740  -4.630  -9.159
    8    H    ALA   2           H        ALA   2  39.723  -5.497  -5.824
    9    HA   ALA   2           HA       ALA   2  36.998  -6.390  -6.351
   10   1HB   ALA   2          1HB       ALA   2  38.606  -8.013  -5.455
   11   2HB   ALA   2          2HB       ALA   2  37.296  -7.735  -4.308
   12   3HB   ALA   2          3HB       ALA   2  38.870  -6.983  -4.049
   13    H    ARG   3           H        ARG   3  36.694  -6.355  -3.249
   14    HA   ARG   3           HA       ARG   3  35.466  -3.825  -2.964
   15   1HB   ARG   3          2HB       ARG   3  34.937  -5.813  -1.547
   16   2HB   ARG   3          1HB       ARG   3  36.501  -5.633  -0.767
   17   1HG   ARG   3          2HG       ARG   3  34.768  -4.685   0.621
   18   2HG   ARG   3          1HG       ARG   3  35.836  -3.404   0.034
   19   1HD   ARG   3          2HD       ARG   3  34.212  -2.860  -1.716
   20   2HD   ARG   3          1HD       ARG   3  33.149  -4.141  -1.132
   21    HE   ARG   3           HE       ARG   3  33.526  -2.583   1.054
   22   1HH1  ARG   3          1HH1      ARG   3  32.514  -1.929  -2.225
   23   2HH1  ARG   3          2HH1      ARG   3  31.492  -0.600  -1.790
   24   1HH2  ARG   3          1HH2      ARG   3  32.165  -0.827   1.650
   25   2HH2  ARG   3          2HH2      ARG   3  31.286   0.025   0.426
   26    H    THR   4           H        THR   4  38.675  -5.016  -2.528
   27    HA   THR   4           HA       THR   4  39.623  -2.303  -1.952
   28    HB   THR   4           HB       THR   4  41.448  -3.397  -0.563
   29    HG1  THR   4           HG1      THR   4  40.964  -5.502   0.210
   30   1HG2  THR   4          1HG2      THR   4  39.567  -2.213   0.469
   31   2HG2  THR   4          2HG2      THR   4  40.063  -3.601   1.435
   32   3HG2  THR   4          3HG2      THR   4  38.616  -3.697   0.433
   33    H    CYS   5           H        CYS   5  42.401  -3.281  -1.949
   34    HA   CYS   5           HA       CYS   5  42.757  -3.448  -4.826
   35   1HB   CYS   5          2HB       CYS   5  44.658  -2.822  -2.560
   36   2HB   CYS   5          1HB       CYS   5  45.140  -2.913  -4.255
   37    HA   PRO   6           HA       PRO   6  44.182  -7.665  -5.064
   38   1HB   PRO   6          2HB       PRO   6  46.813  -6.667  -6.040
   39   2HB   PRO   6          1HB       PRO   6  45.711  -7.837  -6.774
   40   1HG   PRO   6          2HG       PRO   6  45.905  -5.378  -7.759
   41   2HG   PRO   6          1HG       PRO   6  44.331  -6.186  -7.649
   42   1HD   PRO   6          2HD       PRO   6  45.490  -4.052  -5.910
   43   2HD   PRO   6          1HD       PRO   6  43.821  -4.260  -6.479
   44    HA   PRO   7           HA       PRO   7  46.468  -8.716  -1.440
   45   1HB   PRO   7          2HB       PRO   7  47.822 -10.853  -2.988
   46   2HB   PRO   7          1HB       PRO   7  46.829 -10.972  -1.531
   47   1HG   PRO   7          2HG       PRO   7  45.881 -11.752  -3.901
   48   2HG   PRO   7          1HG       PRO   7  44.838 -10.918  -2.732
   49   1HD   PRO   7          2HD       PRO   7  46.175  -9.848  -5.186
   50   2HD   PRO   7          1HD       PRO   7  44.543  -9.529  -4.562
   51    H    ASN   8           H        ASN   8  48.302  -8.356  -4.419
   52    HA   ASN   8           HA       ASN   8  50.746  -7.889  -2.894
   53   1HB   ASN   8          2HB       ASN   8  51.932  -7.968  -4.985
   54   2HB   ASN   8          1HB       ASN   8  50.844  -9.347  -4.899
   55   1HD2  ASN   8          1HD2      ASN   8  51.702  -6.505  -6.577
   56   2HD2  ASN   8          2HD2      ASN   8  50.528  -6.637  -7.838
   57    H    GLN   9           H        GLN   9  48.268  -6.167  -3.196
   58    HA   GLN   9           HA       GLN   9  49.691  -3.646  -3.658
   59   1HB   GLN   9          2HB       GLN   9  47.494  -4.651  -5.158
   60   2HB   GLN   9          1HB       GLN   9  46.868  -3.369  -4.136
   61   1HG   GLN   9          2HG       GLN   9  47.500  -2.515  -6.308
   62   2HG   GLN   9          1HG       GLN   9  48.513  -1.824  -5.041
   63   1HE2  GLN   9          1HE2      GLN   9  48.905  -5.059  -6.206
   64   2HE2  GLN   9          2HE2      GLN   9  50.429  -4.813  -6.966
   65    H    PHE  10           H        PHE  10  48.206  -1.850  -2.621
   66    HA   PHE  10           HA       PHE  10  46.898  -2.881  -0.223
   67   1HB   PHE  10          2HB       PHE  10  49.150  -2.351   0.497
   68   2HB   PHE  10          1HB       PHE  10  49.052  -0.761  -0.251
   69    HD1  PHE  10           HD1      PHE  10  47.244  -2.830   2.283
   70    HD2  PHE  10           HD2      PHE  10  48.559   1.035   1.081
   71    HE1  PHE  10           HE1      PHE  10  46.337  -1.870   4.368
   72    HE2  PHE  10           HE2      PHE  10  47.665   1.990   3.159
   73    HZ   PHE  10           HZ       PHE  10  46.548   0.546   4.803
   74    H    SER  11           H        SER  11  45.187  -1.635   0.453
   75    HA   SER  11           HA       SER  11  44.363   0.357  -1.484
   76   1HB   SER  11          2HB       SER  11  42.987  -1.731  -1.307
   77   2HB   SER  11          1HB       SER  11  42.585  -1.258   0.340
   78    HG   SER  11           HG       SER  11  42.154   0.545  -1.777
   79    H    CYS  12           H        CYS  12  44.853   2.275  -0.697
   80    HA   CYS  12           HA       CYS  12  44.796   3.013   2.007
   81   1HB   CYS  12          2HB       CYS  12  45.981   4.351   0.357
   82   2HB   CYS  12          1HB       CYS  12  44.473   4.706  -0.473
   83    H    ALA  13           H        ALA  13  43.236   4.025   3.224
   84    HA   ALA  13           HA       ALA  13  41.021   2.741   3.617
   85   1HB   ALA  13          1HB       ALA  13  41.093   5.735   3.849
   86   2HB   ALA  13          2HB       ALA  13  41.758   4.591   5.019
   87   3HB   ALA  13          3HB       ALA  13  40.017   4.644   4.730
   88    H    SER  14           H        SER  14  39.916   1.913   1.998
   89    HA   SER  14           HA       SER  14  38.434   1.679   0.310
   90   1HB   SER  14          2HB       SER  14  36.233   2.839   0.840
   91   2HB   SER  14          1HB       SER  14  36.908   1.805   2.096
   92    HG   SER  14           HG       SER  14  37.662   4.480   2.153
   93    H    GLY  15           H        GLY  15  39.783   2.616  -1.338
   94   1HA   GLY  15          2HA       GLY  15  38.383   3.893  -3.218
   95   2HA   GLY  15          1HA       GLY  15  38.931   5.251  -2.248
   96    H    ARG  16           H        ARG  16  41.491   4.310  -1.597
   97    HA   ARG  16           HA       ARG  16  42.725   4.915  -4.166
   98   1HB   ARG  16          2HB       ARG  16  43.976   4.904  -1.416
   99   2HB   ARG  16          1HB       ARG  16  44.729   5.481  -2.892
  100   1HG   ARG  16          2HG       ARG  16  44.051   7.416  -1.778
  101   2HG   ARG  16          1HG       ARG  16  42.817   7.170  -3.017
  102   1HD   ARG  16          2HD       ARG  16  41.377   6.103  -1.316
  103   2HD   ARG  16          1HD       ARG  16  42.602   6.437  -0.091
  104    HE   ARG  16           HE       ARG  16  42.105   8.875  -1.126
  105   1HH1  ARG  16          1HH1      ARG  16  40.011   6.372   0.147
  106   2HH1  ARG  16          2HH1      ARG  16  38.788   7.481   0.660
  107   1HH2  ARG  16          1HH2      ARG  16  40.485  10.342  -0.435
  108   2HH2  ARG  16          2HH2      ARG  16  39.065   9.733   0.347
  109    H    CYS  17           H        CYS  17  44.901   3.832  -4.573
  110    HA   CYS  17           HA       CYS  17  44.959   1.043  -3.763
  111   1HB   CYS  17          2HB       CYS  17  43.431   1.620  -5.911
  112   2HB   CYS  17          1HB       CYS  17  44.995   1.424  -6.697
  113    H    ILE  18           H        ILE  18  46.996   1.213  -3.023
  114    HA   ILE  18           HA       ILE  18  49.079   2.174  -4.873
  115    HB   ILE  18           HB       ILE  18  50.326   2.948  -3.005
  116   1HG1  ILE  18          2HG1      ILE  18  48.403   1.496  -1.182
  117   2HG1  ILE  18          1HG1      ILE  18  49.950   0.822  -1.696
  118   1HG2  ILE  18          1HG2      ILE  18  48.323   4.330  -3.432
  119   2HG2  ILE  18          2HG2      ILE  18  48.807   4.364  -1.736
  120   3HG2  ILE  18          3HG2      ILE  18  47.435   3.375  -2.239
  121   1HD1  ILE  18          1HD1      ILE  18  51.101   2.693  -0.663
  122   2HD1  ILE  18          2HD1      ILE  18  50.116   1.794   0.497
  123   3HD1  ILE  18          3HD1      ILE  18  49.547   3.341  -0.129
  124    HA   PRO  19           HA       PRO  19  50.812  -1.986  -4.463
  125   1HB   PRO  19          2HB       PRO  19  53.493  -0.926  -3.872
  126   2HB   PRO  19          1HB       PRO  19  52.941  -1.878  -5.254
  127   1HG   PRO  19          2HG       PRO  19  53.595   0.736  -5.475
  128   2HG   PRO  19          1HG       PRO  19  52.323  -0.012  -6.460
  129   1HD   PRO  19          2HD       PRO  19  52.073   1.710  -4.023
  130   2HD   PRO  19          1HD       PRO  19  51.093   1.708  -5.504
  131    H    ILE  20           H        ILE  20  51.407  -3.449  -2.815
  132    HA   ILE  20           HA       ILE  20  50.899  -2.519  -0.176
  133    HB   ILE  20           HB       ILE  20  50.290  -4.804  -1.164
  134   1HG1  ILE  20          2HG1      ILE  20  51.624  -4.814   1.543
  135   2HG1  ILE  20          1HG1      ILE  20  50.043  -4.107   1.230
  136   1HG2  ILE  20          1HG2      ILE  20  51.921  -6.602  -0.806
  137   2HG2  ILE  20          2HG2      ILE  20  53.130  -5.394  -0.368
  138   3HG2  ILE  20          3HG2      ILE  20  52.475  -5.429  -2.004
  139   1HD1  ILE  20          1HD1      ILE  20  49.190  -6.292   0.572
  140   2HD1  ILE  20          2HD1      ILE  20  49.837  -6.312   2.210
  141   3HD1  ILE  20          3HD1      ILE  20  50.769  -7.010   0.883
  142    H    SER  21           H        SER  21  52.338  -3.133   1.643
  143    HA   SER  21           HA       SER  21  54.269  -2.931   2.799
  144   1HB   SER  21          2HB       SER  21  55.184  -4.487   0.980
  145   2HB   SER  21          1HB       SER  21  55.838  -3.030   0.231
  146    HG   SER  21           HG       SER  21  57.316  -2.923   1.709
  147    H    TRP  22           H        TRP  22  53.226  -0.883   0.388
  148    HA   TRP  22           HA       TRP  22  54.943   1.365   1.015
  149   1HB   TRP  22          2HB       TRP  22  52.352   1.061  -0.489
  150   2HB   TRP  22          1HB       TRP  22  52.987   2.649  -0.085
  151    HD1  TRP  22           HD1      TRP  22  54.370  -0.525  -1.823
  152    HE1  TRP  22           HE1      TRP  22  55.718   0.251  -3.848
  153    HE3  TRP  22           HE3      TRP  22  53.821   4.512  -1.281
  154    HZ2  TRP  22           HZ2      TRP  22  56.477   2.682  -5.085
  155    HZ3  TRP  22           HZ3      TRP  22  54.884   6.001  -2.931
  156    HH2  TRP  22           HH2      TRP  22  56.181   5.099  -4.791
  157    H    THR  23           H        THR  23  53.282  -0.195   3.049
  158    HA   THR  23           HA       THR  23  51.336   1.668   3.981
  159    HB   THR  23           HB       THR  23  51.043   0.037   5.829
  160    HG1  THR  23           HG1      THR  23  52.399  -1.655   6.056
  161   1HG2  THR  23          1HG2      THR  23  51.155  -1.174   3.051
  162   2HG2  THR  23          2HG2      THR  23  49.818  -0.230   3.716
  163   3HG2  THR  23          3HG2      THR  23  50.221  -1.799   4.414
  164    H    CYS  24           H        CYS  24  53.672   0.206   6.120
  165    HA   CYS  24           HA       CYS  24  54.421   2.812   7.075
  166   1HB   CYS  24          2HB       CYS  24  54.899   0.050   8.093
  167   2HB   CYS  24          1HB       CYS  24  55.779   1.435   8.745
  168    H    ASP  25           H        ASP  25  55.867   3.802   5.826
  169    HA   ASP  25           HA       ASP  25  58.207   2.284   4.859
  170   1HB   ASP  25          2HB       ASP  25  56.525   2.474   3.069
  171   2HB   ASP  25          1HB       ASP  25  56.497   4.218   3.271
  172    H    LEU  26           H        LEU  26  57.109   4.739   6.679
  173    HA   LEU  26           HA       LEU  26  58.148   6.390   7.829
  174   1HB   LEU  26          2HB       LEU  26  60.491   5.749   6.065
  175   2HB   LEU  26          1HB       LEU  26  60.500   7.120   7.156
  176    HG   LEU  26           HG       LEU  26  60.248   4.215   7.930
  177   1HD1  LEU  26          1HD1      LEU  26  62.396   4.579   9.017
  178   2HD1  LEU  26          2HD1      LEU  26  62.421   6.242   8.433
  179   3HD1  LEU  26          3HD1      LEU  26  62.499   4.905   7.286
  180   1HD2  LEU  26          1HD2      LEU  26  60.283   5.001  10.240
  181   2HD2  LEU  26          2HD2      LEU  26  58.868   5.608   9.381
  182   3HD2  LEU  26          3HD2      LEU  26  60.242   6.673   9.679
  183    H    ASP  27           H        ASP  27  56.933   6.486   4.922
  184    HA   ASP  27           HA       ASP  27  57.008   9.418   4.935
  185   1HB   ASP  27          2HB       ASP  27  58.428   8.398   3.035
  186   2HB   ASP  27          1HB       ASP  27  56.893   7.894   2.336
  187    H    ASP  28           H        ASP  28  55.037  10.202   5.137
  188    HA   ASP  28           HA       ASP  28  52.870   8.328   5.367
  189   1HB   ASP  28          2HB       ASP  28  53.327  10.197   6.997
  190   2HB   ASP  28          1HB       ASP  28  52.789  11.328   5.765
  191    H    ASP  29           H        ASP  29  52.071   7.663   3.436
  192    HA   ASP  29           HA       ASP  29  51.322   9.630   1.426
  193   1HB   ASP  29          2HB       ASP  29  51.591   6.690   1.483
  194   2HB   ASP  29          1HB       ASP  29  50.259   7.292   0.506
  195    H    CYS  30           H        CYS  30  49.561   6.910   2.798
  196    HA   CYS  30           HA       CYS  30  47.814   8.483   4.292
  197   1HB   CYS  30          2HB       CYS  30  45.677   8.100   3.128
  198   2HB   CYS  30          1HB       CYS  30  46.750   9.168   2.234
  199    H    GLY  31           H        GLY  31  47.503   5.526   2.326
  200   1HA   GLY  31          2HA       GLY  31  47.022   3.368   2.935
  201   2HA   GLY  31          1HA       GLY  31  47.987   3.707   4.361
  202    H    ASP  32           H        ASP  32  47.014   4.136   6.283
  203    HA   ASP  32           HA       ASP  32  44.259   3.267   6.580
  204   1HB   ASP  32          2HB       ASP  32  45.952   4.557   8.730
  205   2HB   ASP  32          1HB       ASP  32  44.625   3.424   8.935
  206    H    ARG  33           H        ARG  33  46.105   6.073   6.368
  207    HA   ARG  33           HA       ARG  33  44.517   8.093   5.744
  208   1HB   ARG  33          2HB       ARG  33  42.994   8.134   7.528
  209   2HB   ARG  33          1HB       ARG  33  44.175   7.505   8.671
  210   1HG   ARG  33          2HG       ARG  33  43.755   9.775   9.251
  211   2HG   ARG  33          1HG       ARG  33  45.373   9.672   8.534
  212   1HD   ARG  33          2HD       ARG  33  44.462  10.447   6.395
  213   2HD   ARG  33          1HD       ARG  33  42.861  10.583   7.121
  214    HE   ARG  33           HE       ARG  33  43.564  12.468   8.291
  215   1HH1  ARG  33          1HH1      ARG  33  46.241  11.069   6.488
  216   2HH1  ARG  33          2HH1      ARG  33  47.219  12.496   6.607
  217   1HH2  ARG  33          1HH2      ARG  33  44.853  14.345   8.423
  218   2HH2  ARG  33          2HH2      ARG  33  46.425  14.357   7.702
  219    H    SER  34           H        SER  34  46.515   7.201   8.402
  220    HA   SER  34           HA       SER  34  48.800   8.537   7.193
  221   1HB   SER  34          2HB       SER  34  48.040   8.557  10.130
  222   2HB   SER  34          1HB       SER  34  49.657   8.952   9.546
  223    HG   SER  34           HG       SER  34  48.690  10.607   8.277
  224    H    ASP  35           H        ASP  35  49.399   6.691   6.305
  225    HA   ASP  35           HA       ASP  35  49.018   4.116   7.359
  226   1HB   ASP  35          2HB       ASP  35  50.707   3.470   5.474
  227   2HB   ASP  35          1HB       ASP  35  49.103   4.068   5.079
  228    H    GLU  36           H        GLU  36  50.993   6.096   8.764
  229    HA   GLU  36           HA       GLU  36  53.081   4.089   9.279
  230   1HB   GLU  36          2HB       GLU  36  52.898   7.027   9.997
  231   2HB   GLU  36          1HB       GLU  36  54.159   5.959  10.596
  232   1HG   GLU  36          2HG       GLU  36  53.641   6.531   7.688
  233   2HG   GLU  36          1HG       GLU  36  54.847   7.352   8.676
  234    H    SER  37           H        SER  37  50.465   3.590  10.096
  235    HA   SER  37           HA       SER  37  50.700   3.843  13.014
  236   1HB   SER  37          2HB       SER  37  48.097   3.927  11.476
  237   2HB   SER  37          1HB       SER  37  48.314   4.160  13.211
  238    HG   SER  37           HG       SER  37  49.201   5.839  11.100
  239    H    ALA  38           H        ALA  38  48.583   2.066  10.700
  240    HA   ALA  38           HA       ALA  38  48.231   0.040  12.715
  241   1HB   ALA  38          1HB       ALA  38  47.129   0.155   9.921
  242   2HB   ALA  38          2HB       ALA  38  46.370   0.849  11.354
  243   3HB   ALA  38          3HB       ALA  38  46.576  -0.899  11.227
  244    H    SER  39           H        SER  39  50.450   0.359  10.173
  245    HA   SER  39           HA       SER  39  50.707  -2.564   9.949
  246   1HB   SER  39          2HB       SER  39  50.298  -1.372   7.829
  247   2HB   SER  39          1HB       SER  39  51.745  -0.403   8.101
  248    HG   SER  39           HG       SER  39  52.324  -3.027   8.306
  249    H    CYS  40           H        CYS  40  52.216   0.245  11.127
  250    HA   CYS  40           HA       CYS  40  54.910  -0.458  10.982
  251   1HB   CYS  40          2HB       CYS  40  53.437   1.343  12.902
  252   2HB   CYS  40          1HB       CYS  40  55.190   1.212  12.834
  253    H    ALA  41           H        ALA  41  55.201  -2.612  11.613
  254    HA   ALA  41           HA       ALA  41  55.211  -3.024  14.512
  255   1HB   ALA  41          1HB       ALA  41  55.869  -5.334  14.006
  256   2HB   ALA  41          2HB       ALA  41  55.907  -4.942  12.287
  257   3HB   ALA  41          3HB       ALA  41  54.381  -4.892  13.170
  258    H    TYR  42           H        TYR  42  57.215  -2.697  11.724
  259    HA   TYR  42           HA       TYR  42  59.413  -2.323  11.355
  260   1HB   TYR  42          2HB       TYR  42  58.733  -0.590  13.689
  261   2HB   TYR  42          1HB       TYR  42  60.393  -0.642  13.107
  262    HD1  TYR  42           HD1      TYR  42  61.043   0.670  11.299
  263    HD2  TYR  42           HD2      TYR  42  56.901  -0.016  11.962
  264    HE1  TYR  42           HE1      TYR  42  60.496   2.296   9.535
  265    HE2  TYR  42           HE2      TYR  42  56.345   1.608  10.206
  266    HH   TYR  42           HH       TYR  42  57.340   3.534   9.081
  267    HA   PRO  43           HA       PRO  43  61.553  -5.235  14.200
  268   1HB   PRO  43          2HB       PRO  43  62.015  -6.785  11.771
  269   2HB   PRO  43          1HB       PRO  43  61.305  -7.312  13.299
  270   1HG   PRO  43          2HG       PRO  43  59.872  -7.085  11.006
  271   2HG   PRO  43          1HG       PRO  43  59.170  -6.857  12.616
  272   1HD   PRO  43          2HD       PRO  43  60.025  -4.798  10.615
  273   2HD   PRO  43          1HD       PRO  43  58.598  -4.819  11.675
  274    H    THR  44           H        THR  44  61.817  -3.579  11.251
  275    HA   THR  44           HA       THR  44  64.353  -2.534  11.781
  276    HB   THR  44           HB       THR  44  65.460  -4.440  11.038
  277    HG1  THR  44           HG1      THR  44  66.156  -2.575   9.876
  278   1HG2  THR  44          1HG2      THR  44  63.363  -5.540  10.134
  279   2HG2  THR  44          2HG2      THR  44  64.860  -5.877   9.268
  280   3HG2  THR  44          3HG2      THR  44  63.706  -4.723   8.607
  281    H    CYS  45           H        CYS  45  62.662  -3.384   8.815
  282    HA   CYS  45           HA       CYS  45  61.491  -0.773   8.585
  283   1HB   CYS  45          2HB       CYS  45  63.769  -1.608   6.846
  284   2HB   CYS  45          1HB       CYS  45  62.432  -0.743   6.091
  285    H    PHE  46           H        PHE  46  61.447  -4.032   8.142
  286    HA   PHE  46           HA       PHE  46  59.617  -3.949   5.873
  287   1HB   PHE  46          2HB       PHE  46  60.810  -5.726   5.209
  288   2HB   PHE  46          1HB       PHE  46  61.648  -5.807   6.749
  289    HD1  PHE  46           HD1      PHE  46  58.372  -6.754   5.211
  290    HD2  PHE  46           HD2      PHE  46  61.417  -7.693   8.033
  291    HE1  PHE  46           HE1      PHE  46  57.233  -8.868   5.727
  292    HE2  PHE  46           HE2      PHE  46  60.280  -9.810   8.558
  293    HZ   PHE  46           HZ       PHE  46  58.186 -10.402   7.401
  294    HA   PRO  47           HA       PRO  47  56.354  -5.122   8.702
  295   1HB   PRO  47          2HB       PRO  47  54.406  -3.678   7.553
  296   2HB   PRO  47          1HB       PRO  47  55.571  -2.950   8.662
  297   1HG   PRO  47          2HG       PRO  47  55.357  -2.688   5.729
  298   2HG   PRO  47          1HG       PRO  47  56.077  -1.586   6.913
  299   1HD   PRO  47          2HD       PRO  47  57.417  -3.489   5.237
  300   2HD   PRO  47          1HD       PRO  47  58.130  -2.403   6.444
  301    H    LEU  48           H        LEU  48  56.854  -5.275   5.321
  302    HA   LEU  48           HA       LEU  48  55.080  -7.558   5.054
  303   1HB   LEU  48          2HB       LEU  48  54.781  -5.031   3.432
  304   2HB   LEU  48          1HB       LEU  48  54.083  -6.571   2.957
  305    HG   LEU  48           HG       LEU  48  53.492  -5.366   5.637
  306   1HD1  LEU  48          1HD1      LEU  48  52.908  -3.675   3.982
  307   2HD1  LEU  48          2HD1      LEU  48  51.462  -4.402   4.684
  308   3HD1  LEU  48          3HD1      LEU  48  51.992  -4.874   3.070
  309   1HD2  LEU  48          1HD2      LEU  48  51.446  -6.721   5.413
  310   2HD2  LEU  48          2HD2      LEU  48  52.911  -7.699   5.334
  311   3HD2  LEU  48          3HD2      LEU  48  52.028  -7.312   3.858
  312    H    THR  49           H        THR  49  57.203  -5.346   3.187
  313    HA   THR  49           HA       THR  49  59.107  -7.296   2.633
  314    HB   THR  49           HB       THR  49  57.356  -8.326   1.257
  315    HG1  THR  49           HG1      THR  49  58.692  -8.751  -0.369
  316   1HG2  THR  49          1HG2      THR  49  56.047  -6.370   0.622
  317   2HG2  THR  49          2HG2      THR  49  56.554  -7.269  -0.808
  318   3HG2  THR  49          3HG2      THR  49  57.384  -5.777  -0.364
  319    H    GLN  50           H        GLN  50  60.626  -5.802   2.981
  320    HA   GLN  50           HA       GLN  50  60.648  -3.340   1.412
  321   1HB   GLN  50          2HB       GLN  50  60.641  -3.526   4.418
  322   2HB   GLN  50          1HB       GLN  50  61.181  -2.096   3.557
  323   1HG   GLN  50          2HG       GLN  50  58.456  -3.252   3.123
  324   2HG   GLN  50          1HG       GLN  50  58.798  -2.149   4.455
  325   1HE2  GLN  50          1HE2      GLN  50  59.283  -0.021   4.022
  326   2HE2  GLN  50          2HE2      GLN  50  58.967   0.725   2.493
  327    H    PHE  51           H        PHE  51  62.619  -2.024   2.009
  328    HA   PHE  51           HA       PHE  51  64.929  -3.622   2.876
  329   1HB   PHE  51          2HB       PHE  51  64.940  -3.436   0.389
  330   2HB   PHE  51          1HB       PHE  51  64.866  -1.686   0.532
  331    HD1  PHE  51           HD1      PHE  51  66.983  -4.644   0.845
  332    HD2  PHE  51           HD2      PHE  51  66.818  -0.410   1.190
  333    HE1  PHE  51           HE1      PHE  51  69.438  -4.554   0.837
  334    HE2  PHE  51           HE2      PHE  51  69.271  -0.305   1.211
  335    HZ   PHE  51           HZ       PHE  51  70.586  -2.381   1.034
  336    H    THR  52           H        THR  52  66.572  -2.233   3.940
  337    HA   THR  52           HA       THR  52  65.363   0.311   4.782
  338    HB   THR  52           HB       THR  52  65.725  -1.302   6.631
  339    HG1  THR  52           HG1      THR  52  65.848   0.978   7.033
  340   1HG2  THR  52          1HG2      THR  52  67.984  -1.792   7.400
  341   2HG2  THR  52          2HG2      THR  52  68.653  -0.918   6.021
  342   3HG2  THR  52          3HG2      THR  52  67.738  -2.406   5.765
  343    H    CYS  53           H        CYS  53  66.184   2.029   3.797
  344    HA   CYS  53           HA       CYS  53  68.702   2.336   2.674
  345   1HB   CYS  53          2HB       CYS  53  67.038   4.329   4.193
  346   2HB   CYS  53          1HB       CYS  53  68.512   4.751   3.328
  347    H    ASN  54           H        ASN  54  70.734   2.434   3.432
  348    HA   ASN  54           HA       ASN  54  71.291   1.962   6.182
  349   1HB   ASN  54          2HB       ASN  54  73.058   2.683   3.842
  350   2HB   ASN  54          1HB       ASN  54  73.696   2.461   5.468
  351   1HD2  ASN  54          1HD2      ASN  54  72.173   0.905   2.755
  352   2HD2  ASN  54          2HD2      ASN  54  72.553  -0.713   3.215
  353    H    ASN  55           H        ASN  55  70.693   4.737   4.319
  354    HA   ASN  55           HA       ASN  55  71.853   6.722   5.920
  355   1HB   ASN  55          2HB       ASN  55  70.861   7.033   3.632
  356   2HB   ASN  55          1HB       ASN  55  69.266   6.884   4.358
  357   1HD2  ASN  55          1HD2      ASN  55  71.951   8.917   3.770
  358   2HD2  ASN  55          2HD2      ASN  55  71.294  10.353   4.473
  359    H    GLY  56           H        GLY  56  69.252   4.558   6.470
  360   1HA   GLY  56          2HA       GLY  56  68.531   4.357   8.792
  361   2HA   GLY  56          1HA       GLY  56  68.458   6.110   8.852
  362    H    ARG  57           H        ARG  57  67.314   5.178   5.886
  363    HA   ARG  57           HA       ARG  57  64.566   5.626   6.796
  364   1HB   ARG  57          2HB       ARG  57  65.661   5.638   3.979
  365   2HB   ARG  57          1HB       ARG  57  64.016   6.045   4.444
  366   1HG   ARG  57          2HG       ARG  57  64.679   8.154   4.534
  367   2HG   ARG  57          1HG       ARG  57  65.600   7.724   5.977
  368   1HD   ARG  57          2HD       ARG  57  67.065   8.815   4.417
  369   2HD   ARG  57          1HD       ARG  57  67.502   7.108   4.524
  370    HE   ARG  57           HE       ARG  57  65.813   7.182   2.408
  371   1HH1  ARG  57          1HH1      ARG  57  68.643   9.043   3.257
  372   2HH1  ARG  57          2HH1      ARG  57  69.215   9.170   1.616
  373   1HH2  ARG  57          1HH2      ARG  57  66.572   7.381   0.220
  374   2HH2  ARG  57          2HH2      ARG  57  68.049   8.253  -0.078
  375    H    CYS  58           H        CYS  58  62.905   4.467   5.321
  376    HA   CYS  58           HA       CYS  58  63.724   1.680   4.870
  377   1HB   CYS  58          2HB       CYS  58  60.940   2.716   5.496
  378   2HB   CYS  58          1HB       CYS  58  61.416   1.029   5.329
  379    H    ILE  59           H        ILE  59  63.255   0.823   2.839
  380    HA   ILE  59           HA       ILE  59  61.586   2.437   1.091
  381    HB   ILE  59           HB       ILE  59  63.012   1.999  -0.865
  382   1HG1  ILE  59          2HG1      ILE  59  65.173   1.224   1.086
  383   2HG1  ILE  59          1HG1      ILE  59  64.203   0.039   0.215
  384   1HG2  ILE  59          1HG2      ILE  59  63.119   4.144   0.219
  385   2HG2  ILE  59          2HG2      ILE  59  64.719   3.681  -0.366
  386   3HG2  ILE  59          3HG2      ILE  59  64.331   3.545   1.350
  387   1HD1  ILE  59          1HD1      ILE  59  66.344   0.440  -0.882
  388   2HD1  ILE  59          2HD1      ILE  59  65.937   2.146  -1.059
  389   3HD1  ILE  59          3HD1      ILE  59  64.991   0.920  -1.911
  390    H    ASN  60           H        ASN  60  61.060   1.159  -0.970
  391    HA   ASN  60           HA       ASN  60  59.867  -1.310  -0.321
  392   1HB   ASN  60          2HB       ASN  60  60.295   0.242  -2.825
  393   2HB   ASN  60          1HB       ASN  60  59.911  -1.465  -2.990
  394   1HD2  ASN  60          1HD2      ASN  60  58.689   0.529  -0.369
  395   2HD2  ASN  60          2HD2      ASN  60  57.048   0.529  -0.909
  396    H    ILE  61           H        ILE  61  60.397  -3.428  -0.892
  397    HA   ILE  61           HA       ILE  61  63.212  -3.996  -1.126
  398    HB   ILE  61           HB       ILE  61  61.506  -5.391   0.167
  399   1HG1  ILE  61          2HG1      ILE  61  63.347  -6.774  -1.806
  400   2HG1  ILE  61          1HG1      ILE  61  63.828  -6.100  -0.252
  401   1HG2  ILE  61          1HG2      ILE  61  60.370  -7.142  -1.100
  402   2HG2  ILE  61          2HG2      ILE  61  60.970  -6.444  -2.605
  403   3HG2  ILE  61          3HG2      ILE  61  59.834  -5.539  -1.604
  404   1HD1  ILE  61          1HD1      ILE  61  61.931  -8.395  -0.679
  405   2HD1  ILE  61          2HD1      ILE  61  62.399  -7.722   0.883
  406   3HD1  ILE  61          3HD1      ILE  61  63.606  -8.505  -0.139
  407    H    ASN  62           H        ASN  62  60.887  -3.146  -3.315
  408    HA   ASN  62           HA       ASN  62  61.593  -5.050  -5.403
  409   1HB   ASN  62          2HB       ASN  62  59.220  -4.319  -4.908
  410   2HB   ASN  62          1HB       ASN  62  59.648  -2.741  -5.557
  411   1HD2  ASN  62          1HD2      ASN  62  60.877  -5.752  -6.843
  412   2HD2  ASN  62          2HD2      ASN  62  60.019  -5.682  -8.338
  413    H    TRP  63           H        TRP  63  63.363  -2.755  -4.351
  414    HA   TRP  63           HA       TRP  63  63.744  -1.370  -6.913
  415   1HB   TRP  63          2HB       TRP  63  64.408  -0.500  -4.106
  416   2HB   TRP  63          1HB       TRP  63  64.983   0.351  -5.541
  417    HD1  TRP  63           HD1      TRP  63  61.889  -0.545  -6.813
  418    HE1  TRP  63           HE1      TRP  63  60.011   1.146  -6.347
  419    HE3  TRP  63           HE3      TRP  63  64.087   2.026  -3.032
  420    HZ2  TRP  63           HZ2      TRP  63  59.539   3.311  -4.601
  421    HZ3  TRP  63           HZ3      TRP  63  62.866   3.908  -2.002
  422    HH2  TRP  63           HH2      TRP  63  60.638   4.532  -2.775
  423    H    ARG  64           H        ARG  64  64.809  -3.950  -5.428
  424    HA   ARG  64           HA       ARG  64  67.632  -3.804  -5.606
  425   1HB   ARG  64          2HB       ARG  64  66.426  -5.577  -4.381
  426   2HB   ARG  64          1HB       ARG  64  65.783  -6.183  -5.898
  427   1HG   ARG  64          2HG       ARG  64  67.539  -7.620  -5.333
  428   2HG   ARG  64          1HG       ARG  64  68.183  -6.575  -6.598
  429   1HD   ARG  64          2HD       ARG  64  69.827  -6.832  -4.849
  430   2HD   ARG  64          1HD       ARG  64  69.238  -5.171  -4.856
  431    HE   ARG  64           HE       ARG  64  67.666  -6.415  -3.020
  432   1HH1  ARG  64          1HH1      ARG  64  71.110  -6.273  -3.504
  433   2HH1  ARG  64          2HH1      ARG  64  71.494  -6.112  -1.816
  434   1HH2  ARG  64          1HH2      ARG  64  68.147  -6.309  -0.763
  435   2HH2  ARG  64          2HH2      ARG  64  69.799  -6.190  -0.252
  436    H    CYS  65           H        CYS  65  68.509  -3.081  -7.520
  437    HA   CYS  65           HA       CYS  65  67.412  -4.227  -9.996
  438   1HB   CYS  65          2HB       CYS  65  68.611  -1.502  -9.552
  439   2HB   CYS  65          1HB       CYS  65  68.136  -2.136 -11.123
  440    H    ASP  66           H        ASP  66  70.319  -2.387  -9.334
  441    HA   ASP  66           HA       ASP  66  71.778  -3.806 -11.308
  442   1HB   ASP  66          2HB       ASP  66  72.809  -1.880  -9.215
  443   2HB   ASP  66          1HB       ASP  66  73.634  -2.357 -10.695
  444    H    ASN  67           H        ASN  67  72.867  -3.353  -7.935
  445    HA   ASN  67           HA       ASN  67  73.157  -6.235  -7.804
  446   1HB   ASN  67          2HB       ASN  67  75.292  -6.051  -6.576
  447   2HB   ASN  67          1HB       ASN  67  75.399  -5.478  -8.227
  448   1HD2  ASN  67          1HD2      ASN  67  74.179  -3.708  -5.378
  449   2HD2  ASN  67          2HD2      ASN  67  75.395  -2.488  -5.436
  450    H    ASP  68           H        ASP  68  72.383  -3.268  -6.218
  451    HA   ASP  68           HA       ASP  68  71.359  -4.907  -4.005
  452   1HB   ASP  68          2HB       ASP  68  73.460  -3.468  -3.463
  453   2HB   ASP  68          1HB       ASP  68  72.327  -2.116  -3.467
  454    H    ASN  69           H        ASN  69  70.108  -2.646  -2.678
  455    HA   ASN  69           HA       ASN  69  67.793  -2.577  -4.519
  456   1HB   ASN  69          2HB       ASN  69  67.691  -3.913  -2.350
  457   2HB   ASN  69          1HB       ASN  69  67.740  -2.372  -1.507
  458   1HD2  ASN  69          1HD2      ASN  69  66.020  -0.894  -1.872
  459   2HD2  ASN  69          2HD2      ASN  69  64.442  -1.492  -2.271
  460    H    ASP  70           H        ASP  70  67.591  -0.643  -5.417
  461    HA   ASP  70           HA       ASP  70  69.128   1.553  -4.791
  462   1HB   ASP  70          2HB       ASP  70  67.635   0.907  -6.890
  463   2HB   ASP  70          1HB       ASP  70  66.535   2.050  -6.118
  464    H    CYS  71           H        CYS  71  69.105   2.723  -3.042
  465    HA   CYS  71           HA       CYS  71  66.548   3.586  -1.884
  466   1HB   CYS  71          2HB       CYS  71  67.853   2.646  -0.179
  467   2HB   CYS  71          1HB       CYS  71  69.340   3.346  -0.808
  468    H    GLY  72           H        GLY  72  69.587   4.726  -3.257
  469   1HA   GLY  72          2HA       GLY  72  69.158   6.734  -4.695
  470   2HA   GLY  72          1HA       GLY  72  68.434   7.442  -3.266
  471    H    ASP  73           H        ASP  73  70.649   6.310  -1.523
  472    HA   ASP  73           HA       ASP  73  72.901   7.830  -2.454
  473   1HB   ASP  73          2HB       ASP  73  72.933   9.336  -0.454
  474   2HB   ASP  73          1HB       ASP  73  71.653   9.671  -1.613
  475    H    ASN  74           H        ASN  74  74.075   6.054  -2.274
  476    HA   ASN  74           HA       ASN  74  75.962   5.198  -1.334
  477   1HB   ASN  74          2HB       ASN  74  75.144   6.752   1.123
  478   2HB   ASN  74          1HB       ASN  74  76.687   5.939   0.910
  479   1HD2  ASN  74          1HD2      ASN  74  74.766   8.688   0.117
  480   2HD2  ASN  74          2HD2      ASN  74  75.996   9.569  -0.718
  481    H    SER  75           H        SER  75  73.016   4.226  -0.624
  482    HA   SER  75           HA       SER  75  73.687   2.475   1.584
  483   1HB   SER  75          2HB       SER  75  71.125   2.822   0.030
  484   2HB   SER  75          1HB       SER  75  71.308   1.787   1.449
  485    HG   SER  75           HG       SER  75  71.899   4.562   1.499
  486    H    ASP  76           H        ASP  76  71.879   1.874  -1.249
  487    HA   ASP  76           HA       ASP  76  72.707  -0.819  -1.608
  488   1HB   ASP  76          2HB       ASP  76  71.357  -0.403  -3.773
  489   2HB   ASP  76          1HB       ASP  76  70.509  -0.237  -2.235
  490    H    GLU  77           H        GLU  77  73.010   2.083  -3.586
  491    HA   GLU  77           HA       GLU  77  75.600   1.945  -4.429
  492   1HB   GLU  77          2HB       GLU  77  75.610   0.841  -6.564
  493   2HB   GLU  77          1HB       GLU  77  74.989  -0.303  -5.386
  494   1HG   GLU  77          2HG       GLU  77  72.857   1.210  -6.611
  495   2HG   GLU  77          1HG       GLU  77  73.852   0.398  -7.817
  496    H    ALA  78           H        ALA  78  72.291   2.526  -5.170
  497    HA   ALA  78           HA       ALA  78  71.132   4.165  -6.211
  498   1HB   ALA  78          1HB       ALA  78  72.021   6.426  -6.211
  499   2HB   ALA  78          2HB       ALA  78  73.633   5.811  -5.842
  500   3HB   ALA  78          3HB       ALA  78  72.328   5.631  -4.666
  501    H    GLY  79           H        GLY  79  70.930   3.098  -8.189
  502   1HA   GLY  79          2HA       GLY  79  72.299   4.386 -10.387
  503   2HA   GLY  79          1HA       GLY  79  72.793   2.721 -10.146
  504    H    CYS  80           H        CYS  80  69.778   2.447  -9.178
  505    HA   CYS  80           HA       CYS  80  68.986   1.192 -11.597
  506   1HB   CYS  80          2HB       CYS  80  68.280   0.403  -9.366
  507   2HB   CYS  80          1HB       CYS  80  67.311   1.859  -9.164
  508    H    SER  81           H        SER  81  68.550   2.357 -13.343
  509    HA   SER  81           HA       SER  81  66.412   4.333 -13.212
  510   1HB   SER  81          2HB       SER  81  68.565   5.578 -13.000
  511   2HB   SER  81          1HB       SER  81  69.076   4.901 -14.545
  512    HG   SER  81           HG       SER  81  67.617   6.128 -15.586
  513    H    HIS  82           HN       HIS  82  65.905   5.045 -15.566
  514    HA   HIS  82           HA       HIS  82  66.197   2.741 -17.371
  515   1HB   HIS  82          2HB       HIS  82  63.903   2.898 -16.292
  516   2HB   HIS  82          1HB       HIS  82  63.696   4.436 -17.120
  517    HD1  HIS  82           HD1      HIS  82  64.778   3.655 -19.928
  518    HD2  HIS  82           HD2      HIS  82  62.205   1.315 -17.647
  519    HE1  HIS  82           HE1      HIS  82  63.548   2.151 -21.554
  Start of MODEL   13
    1   1H    SER   1          1HT       SER   1  27.258  -3.050  -5.021
    2   2H    SER   1          2HT       SER   1  27.197  -2.188  -6.473
    3   3H    SER   1          3HT       SER   1  27.454  -1.365  -5.019
    4    HA   SER   1           HA       SER   1  29.292  -3.255  -6.361
    5   1HB   SER   1          2HB       SER   1  29.566  -0.314  -5.685
    6   2HB   SER   1          1HB       SER   1  30.768  -1.305  -6.516
    7    HG   SER   1           HG       SER   1  29.051   0.084  -7.718
    8    H    ALA   2           H        ALA   2  31.609  -2.611  -5.202
    9    HA   ALA   2           HA       ALA   2  31.169  -3.186  -2.347
   10   1HB   ALA   2          1HB       ALA   2  33.345  -4.285  -4.129
   11   2HB   ALA   2          2HB       ALA   2  31.939  -5.174  -3.542
   12   3HB   ALA   2          3HB       ALA   2  33.161  -4.604  -2.405
   13    H    ARG   3           H        ARG   3  33.712  -3.049  -1.412
   14    HA   ARG   3           HA       ARG   3  34.766  -0.423  -2.178
   15   1HB   ARG   3          2HB       ARG   3  33.736  -1.235   0.522
   16   2HB   ARG   3          1HB       ARG   3  35.063  -0.092   0.407
   17   1HG   ARG   3          2HG       ARG   3  33.654   1.384  -0.974
   18   2HG   ARG   3          1HG       ARG   3  32.318   0.247  -0.782
   19   1HD   ARG   3          2HD       ARG   3  32.216   0.626   1.561
   20   2HD   ARG   3          1HD       ARG   3  33.743   1.507   1.548
   21    HE   ARG   3           HE       ARG   3  31.822   2.785  -0.109
   22   1HH1  ARG   3          1HH1      ARG   3  32.631   2.255   3.265
   23   2HH1  ARG   3          2HH1      ARG   3  31.976   3.774   3.785
   24   1HH2  ARG   3          1HH2      ARG   3  30.937   4.777   0.571
   25   2HH2  ARG   3          2HH2      ARG   3  31.011   5.212   2.253
   26    H    THR   4           H        THR   4  36.596  -0.236  -0.080
   27    HA   THR   4           HA       THR   4  38.648  -0.788   0.605
   28    HB   THR   4           HB       THR   4  39.170  -3.114   1.209
   29    HG1  THR   4           HG1      THR   4  37.220  -3.668  -0.586
   30   1HG2  THR   4          1HG2      THR   4  36.389  -2.221   1.980
   31   2HG2  THR   4          2HG2      THR   4  37.896  -1.721   2.746
   32   3HG2  THR   4          3HG2      THR   4  37.371  -3.399   2.851
   33    H    CYS   5           H        CYS   5  40.399  -2.894  -0.025
   34    HA   CYS   5           HA       CYS   5  40.920  -2.489  -2.885
   35   1HB   CYS   5          2HB       CYS   5  41.981  -0.733  -1.260
   36   2HB   CYS   5          1HB       CYS   5  43.069  -2.035  -0.817
   37    HA   PRO   6           HA       PRO   6  41.922  -6.780  -2.590
   38   1HB   PRO   6          2HB       PRO   6  43.869  -6.495  -4.759
   39   2HB   PRO   6          1HB       PRO   6  42.313  -7.325  -4.757
   40   1HG   PRO   6          2HG       PRO   6  42.746  -5.032  -6.125
   41   2HG   PRO   6          1HG       PRO   6  41.167  -5.456  -5.438
   42   1HD   PRO   6          2HD       PRO   6  43.238  -3.556  -4.417
   43   2HD   PRO   6          1HD       PRO   6  41.467  -3.407  -4.416
   44    HA   PRO   7           HA       PRO   7  45.824  -7.753  -0.569
   45   1HB   PRO   7          2HB       PRO   7  46.322  -9.770  -2.697
   46   2HB   PRO   7          1HB       PRO   7  46.333  -9.961  -0.939
   47   1HG   PRO   7          2HG       PRO   7  44.298 -10.874  -2.396
   48   2HG   PRO   7          1HG       PRO   7  44.023 -10.116  -0.818
   49   1HD   PRO   7          2HD       PRO   7  43.587  -9.009  -3.556
   50   2HD   PRO   7          1HD       PRO   7  42.635  -8.775  -2.075
   51    H    ASN   8           H        ASN   8  48.102  -7.523  -0.807
   52    HA   ASN   8           HA       ASN   8  50.012  -6.547  -1.581
   53   1HB   ASN   8          2HB       ASN   8  49.682  -7.972  -3.635
   54   2HB   ASN   8          1HB       ASN   8  48.800  -6.629  -4.359
   55   1HD2  ASN   8          1HD2      ASN   8  50.145  -5.992  -5.947
   56   2HD2  ASN   8          2HD2      ASN   8  51.783  -5.506  -5.719
   57    H    GLN   9           H        GLN   9  47.086  -5.298  -1.488
   58    HA   GLN   9           HA       GLN   9  47.921  -2.593  -2.203
   59   1HB   GLN   9          2HB       GLN   9  45.744  -4.159  -3.361
   60   2HB   GLN   9          1HB       GLN   9  45.198  -2.632  -2.697
   61   1HG   GLN   9          2HG       GLN   9  45.657  -2.192  -4.931
   62   2HG   GLN   9          1HG       GLN   9  47.024  -1.532  -4.039
   63   1HE2  GLN   9          1HE2      GLN   9  46.640  -4.962  -4.611
   64   2HE2  GLN   9          2HE2      GLN   9  47.931  -5.116  -5.734
   65    H    PHE  10           H        PHE  10  46.549  -0.987  -1.255
   66    HA   PHE  10           HA       PHE  10  45.359  -1.772   1.287
   67   1HB   PHE  10          2HB       PHE  10  47.533  -1.182   1.990
   68   2HB   PHE  10          1HB       PHE  10  47.664   0.103   0.796
   69    HD1  PHE  10           HD1      PHE  10  45.859  -0.864   3.890
   70    HD2  PHE  10           HD2      PHE  10  47.245   2.296   1.396
   71    HE1  PHE  10           HE1      PHE  10  45.142   0.794   5.580
   72    HE2  PHE  10           HE2      PHE  10  46.532   3.945   3.067
   73    HZ   PHE  10           HZ       PHE  10  45.457   3.211   5.147
   74    H    SER  11           H        SER  11  43.571  -0.660   1.692
   75    HA   SER  11           HA       SER  11  42.863   1.564  -0.002
   76   1HB   SER  11          2HB       SER  11  40.532   1.156   0.898
   77   2HB   SER  11          1HB       SER  11  41.190  -0.161  -0.076
   78    HG   SER  11           HG       SER  11  41.438  -0.102   2.743
   79    H    CYS  12           H        CYS  12  43.306   3.397   0.784
   80    HA   CYS  12           HA       CYS  12  44.283   3.892   3.332
   81   1HB   CYS  12          2HB       CYS  12  45.068   5.311   1.698
   82   2HB   CYS  12          1HB       CYS  12  43.486   5.534   0.969
   83    H    ALA  13           H        ALA  13  42.023   6.304   2.690
   84    HA   ALA  13           HA       ALA  13  40.501   5.681   5.069
   85   1HB   ALA  13          1HB       ALA  13  40.321   8.037   3.190
   86   2HB   ALA  13          2HB       ALA  13  41.279   7.969   4.668
   87   3HB   ALA  13          3HB       ALA  13  39.519   7.899   4.761
   88    H    SER  14           H        SER  14  40.025   3.724   3.418
   89    HA   SER  14           HA       SER  14  38.683   2.580   2.018
   90   1HB   SER  14          2HB       SER  14  36.252   2.835   2.408
   91   2HB   SER  14          1HB       SER  14  37.177   2.731   3.901
   92    HG   SER  14           HG       SER  14  37.000   5.292   3.292
   93    H    GLY  15           H        GLY  15  39.725   5.275   1.111
   94   1HA   GLY  15          2HA       GLY  15  37.879   5.650  -1.159
   95   2HA   GLY  15          1HA       GLY  15  38.863   6.940  -0.475
   96    H    ARG  16           H        ARG  16  41.331   6.169  -0.361
   97    HA   ARG  16           HA       ARG  16  42.124   5.700  -3.074
   98   1HB   ARG  16          2HB       ARG  16  43.647   6.124  -0.524
   99   2HB   ARG  16          1HB       ARG  16  44.476   5.569  -1.971
  100   1HG   ARG  16          2HG       ARG  16  44.784   7.778  -2.272
  101   2HG   ARG  16          1HG       ARG  16  43.178   7.681  -2.987
  102   1HD   ARG  16          2HD       ARG  16  42.173   8.365  -0.893
  103   2HD   ARG  16          1HD       ARG  16  43.755   8.403  -0.119
  104    HE   ARG  16           HE       ARG  16  42.726  10.311  -2.085
  105   1HH1  ARG  16          1HH1      ARG  16  45.338   9.304   0.027
  106   2HH1  ARG  16          2HH1      ARG  16  46.155  10.830  -0.046
  107   1HH2  ARG  16          1HH2      ARG  16  43.803  12.331  -2.178
  108   2HH2  ARG  16          2HH2      ARG  16  45.276  12.554  -1.294
  109    H    CYS  17           H        CYS  17  42.794   3.899  -3.998
  110    HA   CYS  17           HA       CYS  17  43.143   1.485  -2.354
  111   1HB   CYS  17          2HB       CYS  17  41.135   1.417  -3.786
  112   2HB   CYS  17          1HB       CYS  17  42.127   1.717  -5.201
  113    H    ILE  18           H        ILE  18  45.302   1.403  -2.114
  114    HA   ILE  18           HA       ILE  18  47.023   2.171  -4.387
  115    HB   ILE  18           HB       ILE  18  48.424   3.413  -2.852
  116   1HG1  ILE  18          2HG1      ILE  18  47.140   3.513  -0.410
  117   2HG1  ILE  18          1HG1      ILE  18  46.991   1.815  -0.844
  118   1HG2  ILE  18          1HG2      ILE  18  46.903   5.125  -2.072
  119   2HG2  ILE  18          2HG2      ILE  18  45.548   3.992  -2.145
  120   3HG2  ILE  18          3HG2      ILE  18  46.344   4.525  -3.636
  121   1HD1  ILE  18          1HD1      ILE  18  49.443   1.749  -1.154
  122   2HD1  ILE  18          2HD1      ILE  18  48.934   2.110   0.494
  123   3HD1  ILE  18          3HD1      ILE  18  49.520   3.405  -0.549
  124    HA   PRO  19           HA       PRO  19  49.163  -1.686  -3.459
  125   1HB   PRO  19          2HB       PRO  19  51.648  -0.381  -4.332
  126   2HB   PRO  19          1HB       PRO  19  50.829  -1.796  -4.999
  127   1HG   PRO  19          2HG       PRO  19  50.881   0.581  -6.286
  128   2HG   PRO  19          1HG       PRO  19  49.520  -0.547  -6.411
  129   1HD   PRO  19          2HD       PRO  19  49.750   1.975  -4.824
  130   2HD   PRO  19          1HD       PRO  19  48.346   1.293  -5.670
  131    H    ILE  20           H        ILE  20  50.234  -2.395  -1.632
  132    HA   ILE  20           HA       ILE  20  50.290  -0.552   0.501
  133    HB   ILE  20           HB       ILE  20  51.428  -3.357   0.435
  134   1HG1  ILE  20          2HG1      ILE  20  48.692  -2.215   0.965
  135   2HG1  ILE  20          1HG1      ILE  20  49.147  -3.518  -0.123
  136   1HG2  ILE  20          1HG2      ILE  20  51.152  -3.317   2.874
  137   2HG2  ILE  20          2HG2      ILE  20  50.591  -1.648   2.798
  138   3HG2  ILE  20          3HG2      ILE  20  52.251  -2.040   2.354
  139   1HD1  ILE  20          1HD1      ILE  20  49.619  -4.941   1.821
  140   2HD1  ILE  20          2HD1      ILE  20  47.944  -4.380   1.772
  141   3HD1  ILE  20          3HD1      ILE  20  49.090  -3.630   2.879
  142    H    SER  21           H        SER  21  52.727  -1.272  -1.764
  143    HA   SER  21           HA       SER  21  54.954  -0.490  -0.102
  144   1HB   SER  21          2HB       SER  21  54.667  -0.816  -3.098
  145   2HB   SER  21          1HB       SER  21  56.188  -0.468  -2.277
  146    HG   SER  21           HG       SER  21  56.201  -2.454  -1.419
  147    H    TRP  22           H        TRP  22  52.528   1.262  -0.564
  148    HA   TRP  22           HA       TRP  22  53.994   3.706  -1.312
  149   1HB   TRP  22          2HB       TRP  22  51.037   3.150  -1.584
  150   2HB   TRP  22          1HB       TRP  22  51.778   4.718  -1.867
  151    HD1  TRP  22           HD1      TRP  22  53.322   1.443  -3.144
  152    HE1  TRP  22           HE1      TRP  22  53.294   1.475  -5.696
  153    HE3  TRP  22           HE3      TRP  22  50.621   5.710  -3.852
  154    HZ2  TRP  22           HZ2      TRP  22  52.263   3.108  -7.774
  155    HZ3  TRP  22           HZ3      TRP  22  50.153   6.442  -6.153
  156    HH2  TRP  22           HH2      TRP  22  50.956   5.167  -8.075
  157    H    THR  23           H        THR  23  52.366   2.101   1.201
  158    HA   THR  23           HA       THR  23  51.609   4.548   2.560
  159    HB   THR  23           HB       THR  23  49.837   3.175   2.935
  160    HG1  THR  23           HG1      THR  23  50.905   3.672   5.001
  161   1HG2  THR  23          1HG2      THR  23  51.679   0.783   3.136
  162   2HG2  THR  23          2HG2      THR  23  50.757   1.247   1.708
  163   3HG2  THR  23          3HG2      THR  23  49.917   0.747   3.176
  164    H    CYS  24           H        CYS  24  53.006   1.653   3.964
  165    HA   CYS  24           HA       CYS  24  54.300   3.079   6.024
  166   1HB   CYS  24          2HB       CYS  24  54.621   0.194   5.197
  167   2HB   CYS  24          1HB       CYS  24  55.091   0.898   6.740
  168    H    ASP  25           H        ASP  25  55.373   4.249   3.858
  169    HA   ASP  25           HA       ASP  25  57.970   2.923   3.392
  170   1HB   ASP  25          2HB       ASP  25  56.342   4.585   1.460
  171   2HB   ASP  25          1HB       ASP  25  57.932   3.903   1.123
  172    H    LEU  26           H        LEU  26  57.003   5.072   5.299
  173    HA   LEU  26           HA       LEU  26  58.072   6.727   6.412
  174   1HB   LEU  26          2HB       LEU  26  60.166   6.435   4.259
  175   2HB   LEU  26          1HB       LEU  26  60.303   7.553   5.604
  176    HG   LEU  26           HG       LEU  26  60.088   4.544   5.860
  177   1HD1  LEU  26          1HD1      LEU  26  62.428   4.646   6.530
  178   2HD1  LEU  26          2HD1      LEU  26  62.452   6.385   6.223
  179   3HD1  LEU  26          3HD1      LEU  26  62.218   5.254   4.888
  180   1HD2  LEU  26          1HD2      LEU  26  60.630   6.666   7.938
  181   2HD2  LEU  26          2HD2      LEU  26  60.612   4.923   8.204
  182   3HD2  LEU  26          3HD2      LEU  26  59.126   5.760   7.759
  183    H    ASP  27           H        ASP  27  56.103   7.056   4.359
  184    HA   ASP  27           HA       ASP  27  56.075   9.900   4.319
  185   1HB   ASP  27          2HB       ASP  27  57.444   9.434   2.257
  186   2HB   ASP  27          1HB       ASP  27  56.061   8.562   1.600
  187    H    ASP  28           H        ASP  28  54.158   9.984   5.238
  188    HA   ASP  28           HA       ASP  28  52.172   7.988   5.051
  189   1HB   ASP  28          2HB       ASP  28  52.686   9.735   6.919
  190   2HB   ASP  28          1HB       ASP  28  51.655  10.809   5.986
  191    H    ASP  29           H        ASP  29  51.174   7.637   3.101
  192    HA   ASP  29           HA       ASP  29  50.583   9.760   1.300
  193   1HB   ASP  29          2HB       ASP  29  49.461   8.138  -0.104
  194   2HB   ASP  29          1HB       ASP  29  50.961   7.448   0.481
  195    H    CYS  30           H        CYS  30  48.585   7.734   3.341
  196    HA   CYS  30           HA       CYS  30  47.380   9.889   4.554
  197   1HB   CYS  30          2HB       CYS  30  45.006   9.556   3.794
  198   2HB   CYS  30          1HB       CYS  30  46.069  10.349   2.642
  199    H    GLY  31           H        GLY  31  46.075   6.745   3.504
  200   1HA   GLY  31          2HA       GLY  31  45.025   5.100   4.716
  201   2HA   GLY  31          1HA       GLY  31  46.242   5.402   5.950
  202    H    ASP  32           H        ASP  32  45.819   6.796   7.609
  203    HA   ASP  32           HA       ASP  32  43.134   8.008   7.746
  204   1HB   ASP  32          2HB       ASP  32  43.260   5.869   9.138
  205   2HB   ASP  32          1HB       ASP  32  44.447   6.696  10.142
  206    H    ARG  33           H        ARG  33  45.596   9.041   6.922
  207    HA   ARG  33           HA       ARG  33  47.030  10.785   7.174
  208   1HB   ARG  33          2HB       ARG  33  45.514  11.450   9.707
  209   2HB   ARG  33          1HB       ARG  33  46.537  12.529   8.756
  210   1HG   ARG  33          2HG       ARG  33  44.953  12.896   7.211
  211   2HG   ARG  33          1HG       ARG  33  44.366  11.229   7.291
  212   1HD   ARG  33          2HD       ARG  33  43.816  13.363   9.365
  213   2HD   ARG  33          1HD       ARG  33  42.697  12.895   8.085
  214    HE   ARG  33           HE       ARG  33  43.626  10.769   9.860
  215   1HH1  ARG  33          1HH1      ARG  33  41.092  13.056   9.080
  216   2HH1  ARG  33          2HH1      ARG  33  39.864  12.189   9.935
  217   1HH2  ARG  33          1HH2      ARG  33  42.019   9.608  10.997
  218   2HH2  ARG  33          2HH2      ARG  33  40.389  10.217  11.023
  219    H    SER  34           H        SER  34  47.176   8.170   8.301
  220    HA   SER  34           HA       SER  34  49.589   8.272   9.757
  221   1HB   SER  34          2HB       SER  34  47.077   7.448  11.246
  222   2HB   SER  34          1HB       SER  34  48.714   7.123  11.810
  223    HG   SER  34           HG       SER  34  48.389   9.737  11.175
  224    H    ASP  35           H        ASP  35  48.288   7.126   7.349
  225    HA   ASP  35           HA       ASP  35  47.581   4.468   7.436
  226   1HB   ASP  35          2HB       ASP  35  48.597   4.132   5.235
  227   2HB   ASP  35          1HB       ASP  35  47.685   5.633   5.320
  228    H    GLU  36           H        GLU  36  50.808   5.710   7.724
  229    HA   GLU  36           HA       GLU  36  51.755   2.967   8.171
  230   1HB   GLU  36          2HB       GLU  36  53.987   3.790   7.629
  231   2HB   GLU  36          1HB       GLU  36  52.854   4.099   6.323
  232   1HG   GLU  36          2HG       GLU  36  52.959   6.352   6.574
  233   2HG   GLU  36          1HG       GLU  36  53.257   6.257   8.309
  234    H    SER  37           H        SER  37  51.826   6.195   9.418
  235    HA   SER  37           HA       SER  37  53.809   5.820  11.369
  236   1HB   SER  37          2HB       SER  37  52.768   7.971  12.335
  237   2HB   SER  37          1HB       SER  37  53.415   8.037  10.695
  238    HG   SER  37           HG       SER  37  51.458   8.281   9.908
  239    H    ALA  38           H        ALA  38  50.321   5.370  11.494
  240    HA   ALA  38           HA       ALA  38  50.604   4.612  14.328
  241   1HB   ALA  38          1HB       ALA  38  49.035   6.463  13.879
  242   2HB   ALA  38          2HB       ALA  38  48.257   5.059  14.611
  243   3HB   ALA  38          3HB       ALA  38  48.070   5.373  12.885
  244    H    SER  39           H        SER  39  50.673   3.156  11.455
  245    HA   SER  39           HA       SER  39  49.014   0.900  12.362
  246   1HB   SER  39          2HB       SER  39  49.731   1.507   9.492
  247   2HB   SER  39          1HB       SER  39  48.558   0.329  10.084
  248    HG   SER  39           HG       SER  39  48.148   2.864   9.468
  249    H    CYS  40           H        CYS  40  52.032   1.705  10.546
  250    HA   CYS  40           HA       CYS  40  52.783  -1.087  10.762
  251   1HB   CYS  40          2HB       CYS  40  53.698   1.248   9.163
  252   2HB   CYS  40          1HB       CYS  40  54.862  -0.042   9.484
  253    H    ALA  41           H        ALA  41  53.448  -1.557  12.783
  254    HA   ALA  41           HA       ALA  41  55.470   0.028  14.096
  255   1HB   ALA  41          1HB       ALA  41  55.567  -1.802  15.713
  256   2HB   ALA  41          2HB       ALA  41  54.549  -2.796  14.673
  257   3HB   ALA  41          3HB       ALA  41  53.892  -1.333  15.403
  258    H    TYR  42           H        TYR  42  57.080   0.209  12.572
  259    HA   TYR  42           HA       TYR  42  57.905  -1.758  10.783
  260   1HB   TYR  42          2HB       TYR  42  59.423   0.646  11.813
  261   2HB   TYR  42          1HB       TYR  42  59.883  -0.303  10.407
  262    HD1  TYR  42           HD1      TYR  42  57.247   1.951  11.755
  263    HD2  TYR  42           HD2      TYR  42  58.885   0.089   8.290
  264    HE1  TYR  42           HE1      TYR  42  55.878   3.397  10.329
  265    HE2  TYR  42           HE2      TYR  42  57.483   1.522   6.862
  266    HH   TYR  42           HH       TYR  42  55.952   4.270   7.984
  267    HA   PRO  43           HA       PRO  43  60.639  -4.042  13.561
  268   1HB   PRO  43          2HB       PRO  43  60.406  -6.417  12.326
  269   2HB   PRO  43          1HB       PRO  43  59.155  -5.811  13.415
  270   1HG   PRO  43          2HG       PRO  43  59.188  -5.933  10.443
  271   2HG   PRO  43          1HG       PRO  43  57.824  -6.094  11.562
  272   1HD   PRO  43          2HD       PRO  43  58.527  -3.788  10.116
  273   2HD   PRO  43          1HD       PRO  43  57.385  -3.869  11.470
  274    H    THR  44           H        THR  44  60.514  -4.145  10.043
  275    HA   THR  44           HA       THR  44  63.318  -3.500   9.843
  276    HB   THR  44           HB       THR  44  63.305  -5.988   9.981
  277    HG1  THR  44           HG1      THR  44  64.037  -4.880   7.456
  278   1HG2  THR  44          1HG2      THR  44  61.715  -5.838   7.416
  279   2HG2  THR  44          2HG2      THR  44  61.125  -6.426   8.971
  280   3HG2  THR  44          3HG2      THR  44  62.399  -7.302   8.124
  281    H    CYS  45           H        CYS  45  60.509  -2.581   9.185
  282    HA   CYS  45           HA       CYS  45  59.300  -1.574   7.565
  283   1HB   CYS  45          2HB       CYS  45  61.994  -1.304   6.217
  284   2HB   CYS  45          1HB       CYS  45  60.541  -0.411   5.781
  285    H    PHE  46           H        PHE  46  58.258  -3.605   7.158
  286    HA   PHE  46           HA       PHE  46  58.138  -4.229   4.419
  287   1HB   PHE  46          2HB       PHE  46  60.131  -5.493   4.683
  288   2HB   PHE  46          1HB       PHE  46  59.590  -6.180   6.204
  289    HD1  PHE  46           HD1      PHE  46  59.439  -8.427   6.013
  290    HD2  PHE  46           HD2      PHE  46  57.995  -6.043   2.774
  291    HE1  PHE  46           HE1      PHE  46  58.686 -10.458   4.851
  292    HE2  PHE  46           HE2      PHE  46  57.254  -8.079   1.625
  293    HZ   PHE  46           HZ       PHE  46  57.600 -10.288   2.660
  294    HA   PRO  47           HA       PRO  47  54.355  -5.684   6.471
  295   1HB   PRO  47          2HB       PRO  47  52.692  -3.736   5.751
  296   2HB   PRO  47          1HB       PRO  47  53.796  -3.515   7.114
  297   1HG   PRO  47          2HG       PRO  47  53.943  -2.401   4.360
  298   2HG   PRO  47          1HG       PRO  47  54.510  -1.702   5.884
  299   1HD   PRO  47          2HD       PRO  47  56.048  -3.089   3.943
  300   2HD   PRO  47          1HD       PRO  47  56.581  -2.536   5.543
  301    H    LEU  48           H        LEU  48  55.562  -5.048   3.435
  302    HA   LEU  48           HA       LEU  48  53.635  -6.755   2.127
  303   1HB   LEU  48          2HB       LEU  48  52.545  -4.605   1.833
  304   2HB   LEU  48          1HB       LEU  48  54.037  -3.888   1.235
  305    HG   LEU  48           HG       LEU  48  53.930  -5.755  -0.551
  306   1HD1  LEU  48          1HD1      LEU  48  51.049  -5.630   0.317
  307   2HD1  LEU  48          2HD1      LEU  48  52.125  -7.025   0.416
  308   3HD1  LEU  48          3HD1      LEU  48  51.641  -6.395  -1.160
  309   1HD2  LEU  48          1HD2      LEU  48  52.517  -4.301  -2.000
  310   2HD2  LEU  48          2HD2      LEU  48  53.784  -3.439  -1.126
  311   3HD2  LEU  48          3HD2      LEU  48  52.116  -3.345  -0.566
  312    H    THR  49           H        THR  49  56.202  -4.417   1.421
  313    HA   THR  49           HA       THR  49  57.872  -6.147  -0.003
  314    HB   THR  49           HB       THR  49  55.537  -5.006  -1.449
  315    HG1  THR  49           HG1      THR  49  55.950  -7.291  -1.000
  316   1HG2  THR  49          1HG2      THR  49  56.687  -5.063  -3.602
  317   2HG2  THR  49          2HG2      THR  49  58.228  -5.250  -2.760
  318   3HG2  THR  49          3HG2      THR  49  57.271  -3.781  -2.547
  319    H    GLN  50           H        GLN  50  59.488  -5.008   0.905
  320    HA   GLN  50           HA       GLN  50  60.115  -2.383  -0.155
  321   1HB   GLN  50          2HB       GLN  50  60.113  -2.777   2.839
  322   2HB   GLN  50          1HB       GLN  50  60.423  -1.294   1.955
  323   1HG   GLN  50          2HG       GLN  50  58.034  -1.342   1.217
  324   2HG   GLN  50          1HG       GLN  50  57.788  -2.699   2.317
  325   1HE2  GLN  50          1HE2      GLN  50  58.158   0.700   2.013
  326   2HE2  GLN  50          2HE2      GLN  50  57.916   1.080   3.688
  327    H    PHE  51           H        PHE  51  62.302  -1.716   0.999
  328    HA   PHE  51           HA       PHE  51  63.931  -4.092   1.547
  329   1HB   PHE  51          2HB       PHE  51  64.271  -3.307  -0.818
  330   2HB   PHE  51          1HB       PHE  51  64.806  -1.759  -0.181
  331    HD1  PHE  51           HD1      PHE  51  67.045  -1.443   0.506
  332    HD2  PHE  51           HD2      PHE  51  65.598  -5.366  -0.276
  333    HE1  PHE  51           HE1      PHE  51  69.337  -2.310   0.649
  334    HE2  PHE  51           HE2      PHE  51  67.889  -6.234  -0.151
  335    HZ   PHE  51           HZ       PHE  51  69.763  -4.714   0.324
  336    H    THR  52           H        THR  52  65.661  -3.683   3.000
  337    HA   THR  52           HA       THR  52  65.259  -1.242   4.569
  338    HB   THR  52           HB       THR  52  66.800  -3.630   5.537
  339    HG1  THR  52           HG1      THR  52  63.989  -3.366   5.905
  340   1HG2  THR  52          1HG2      THR  52  65.064  -1.587   6.921
  341   2HG2  THR  52          2HG2      THR  52  66.825  -1.572   6.861
  342   3HG2  THR  52          3HG2      THR  52  65.982  -2.866   7.713
  343    H    CYS  53           H        CYS  53  66.624   0.225   3.642
  344    HA   CYS  53           HA       CYS  53  69.142  -0.397   2.564
  345   1HB   CYS  53          2HB       CYS  53  67.845   1.630   2.066
  346   2HB   CYS  53          1HB       CYS  53  68.207   2.226   3.683
  347    H    ASN  54           H        ASN  54  71.113  -0.545   3.361
  348    HA   ASN  54           HA       ASN  54  71.465  -1.004   6.142
  349   1HB   ASN  54          2HB       ASN  54  73.449  -0.777   3.873
  350   2HB   ASN  54          1HB       ASN  54  73.881  -1.270   5.509
  351   1HD2  ASN  54          1HD2      ASN  54  72.029  -2.114   2.656
  352   2HD2  ASN  54          2HD2      ASN  54  71.926  -3.808   2.996
  353    H    ASN  55           H        ASN  55  71.697   1.778   4.170
  354    HA   ASN  55           HA       ASN  55  73.329   3.419   5.731
  355   1HB   ASN  55          2HB       ASN  55  72.742   4.169   3.556
  356   2HB   ASN  55          1HB       ASN  55  71.024   3.961   3.866
  357   1HD2  ASN  55          1HD2      ASN  55  73.841   5.947   4.497
  358   2HD2  ASN  55          2HD2      ASN  55  72.953   7.356   4.990
  359    H    GLY  56           H        GLY  56  70.188   2.141   6.263
  360   1HA   GLY  56          2HA       GLY  56  69.470   2.093   8.609
  361   2HA   GLY  56          1HA       GLY  56  69.936   3.789   8.705
  362    H    ARG  57           H        ARG  57  68.793   3.645   5.780
  363    HA   ARG  57           HA       ARG  57  66.157   4.588   6.588
  364   1HB   ARG  57          2HB       ARG  57  66.550   6.156   5.049
  365   2HB   ARG  57          1HB       ARG  57  68.096   5.409   4.694
  366   1HG   ARG  57          2HG       ARG  57  66.017   3.985   3.359
  367   2HG   ARG  57          1HG       ARG  57  65.887   5.712   3.001
  368   1HD   ARG  57          2HD       ARG  57  68.159   3.821   2.475
  369   2HD   ARG  57          1HD       ARG  57  67.326   4.890   1.351
  370    HE   ARG  57           HE       ARG  57  68.861   6.163   3.474
  371   1HH1  ARG  57          1HH1      ARG  57  68.669   5.217   0.100
  372   2HH1  ARG  57          2HH1      ARG  57  70.026   6.181  -0.384
  373   1HH2  ARG  57          1HH2      ARG  57  70.668   7.425   2.839
  374   2HH2  ARG  57          2HH2      ARG  57  71.167   7.428   1.177
  375    H    CYS  58           H        CYS  58  64.254   3.834   5.381
  376    HA   CYS  58           HA       CYS  58  64.633   1.099   4.368
  377   1HB   CYS  58          2HB       CYS  58  62.086   2.427   5.327
  378   2HB   CYS  58          1HB       CYS  58  62.288   0.731   4.897
  379    H    ILE  59           H        ILE  59  64.428   0.802   2.233
  380    HA   ILE  59           HA       ILE  59  63.012   2.874   0.745
  381    HB   ILE  59           HB       ILE  59  64.324   2.268  -1.255
  382   1HG1  ILE  59          2HG1      ILE  59  65.961   0.593   0.664
  383   2HG1  ILE  59          1HG1      ILE  59  64.944  -0.026  -0.633
  384   1HG2  ILE  59          1HG2      ILE  59  64.968   4.164   0.101
  385   2HG2  ILE  59          2HG2      ILE  59  66.392   3.369  -0.569
  386   3HG2  ILE  59          3HG2      ILE  59  65.961   3.122   1.122
  387   1HD1  ILE  59          1HD1      ILE  59  67.397   1.686  -0.969
  388   2HD1  ILE  59          2HD1      ILE  59  66.370   1.100  -2.277
  389   3HD1  ILE  59          3HD1      ILE  59  67.274  -0.044  -1.283
  390    H    ASN  60           H        ASN  60  62.584   1.638  -1.676
  391    HA   ASN  60           HA       ASN  60  60.664  -0.412  -0.850
  392   1HB   ASN  60          2HB       ASN  60  61.013   0.836  -3.587
  393   2HB   ASN  60          1HB       ASN  60  59.682  -0.191  -3.067
  394   1HD2  ASN  60          1HD2      ASN  60  58.151   0.652  -1.600
  395   2HD2  ASN  60          2HD2      ASN  60  57.963   2.351  -1.372
  396    H    ILE  61           H        ILE  61  60.471  -2.383  -2.209
  397    HA   ILE  61           HA       ILE  61  63.049  -3.605  -2.472
  398    HB   ILE  61           HB       ILE  61  60.550  -4.543  -1.865
  399   1HG1  ILE  61          2HG1      ILE  61  62.686  -5.551  -1.209
  400   2HG1  ILE  61          1HG1      ILE  61  61.568  -6.765  -1.810
  401   1HG2  ILE  61          1HG2      ILE  61  59.884  -6.159  -3.550
  402   2HG2  ILE  61          2HG2      ILE  61  61.165  -5.586  -4.620
  403   3HG2  ILE  61          3HG2      ILE  61  59.830  -4.517  -4.192
  404   1HD1  ILE  61          1HD1      ILE  61  62.758  -6.776  -3.954
  405   2HD1  ILE  61          2HD1      ILE  61  63.806  -7.192  -2.598
  406   3HD1  ILE  61          3HD1      ILE  61  63.888  -5.584  -3.313
  407    H    ASN  62           H        ASN  62  61.277  -1.646  -4.436
  408    HA   ASN  62           HA       ASN  62  62.094  -2.897  -6.956
  409   1HB   ASN  62          2HB       ASN  62  60.203  -0.595  -6.410
  410   2HB   ASN  62          1HB       ASN  62  60.621  -1.175  -8.015
  411   1HD2  ASN  62          1HD2      ASN  62  58.593  -1.773  -8.576
  412   2HD2  ASN  62          2HD2      ASN  62  57.751  -3.097  -7.855
  413    H    TRP  63           H        TRP  63  64.044  -1.621  -5.207
  414    HA   TRP  63           HA       TRP  63  64.741   0.777  -6.777
  415   1HB   TRP  63          2HB       TRP  63  65.460  -0.064  -3.975
  416   2HB   TRP  63          1HB       TRP  63  66.395   1.158  -4.830
  417    HD1  TRP  63           HD1      TRP  63  62.538   0.737  -4.604
  418    HE1  TRP  63           HE1      TRP  63  61.545   2.957  -3.748
  419    HE3  TRP  63           HE3      TRP  63  66.860   3.323  -3.883
  420    HZ2  TRP  63           HZ2      TRP  63  62.477   5.467  -2.884
  421    HZ3  TRP  63           HZ3      TRP  63  66.738   5.636  -3.051
  422    HH2  TRP  63           HH2      TRP  63  64.589   6.690  -2.560
  423    H    ARG  64           H        ARG  64  65.170  -2.257  -7.094
  424    HA   ARG  64           HA       ARG  64  67.993  -2.571  -7.438
  425   1HB   ARG  64          2HB       ARG  64  65.842  -4.049  -8.963
  426   2HB   ARG  64          1HB       ARG  64  67.468  -4.598  -8.598
  427   1HG   ARG  64          2HG       ARG  64  65.583  -4.080  -6.358
  428   2HG   ARG  64          1HG       ARG  64  65.402  -5.545  -7.322
  429   1HD   ARG  64          2HD       ARG  64  67.905  -5.889  -6.895
  430   2HD   ARG  64          1HD       ARG  64  67.719  -4.677  -5.628
  431    HE   ARG  64           HE       ARG  64  65.749  -6.456  -5.088
  432   1HH1  ARG  64          1HH1      ARG  64  69.157  -6.835  -5.730
  433   2HH1  ARG  64          2HH1      ARG  64  69.392  -8.069  -4.531
  434   1HH2  ARG  64          1HH2      ARG  64  66.016  -8.144  -3.537
  435   2HH2  ARG  64          2HH2      ARG  64  67.583  -8.845  -3.306
  436    H    CYS  65           H        CYS  65  68.912  -0.981  -8.787
  437    HA   CYS  65           HA       CYS  65  67.548  -0.499 -11.324
  438   1HB   CYS  65          2HB       CYS  65  69.112   1.367 -11.634
  439   2HB   CYS  65          1HB       CYS  65  68.238   1.492 -10.113
  440    H    ASP  66           H        ASP  66  70.236  -2.135 -10.017
  441    HA   ASP  66           HA       ASP  66  70.821  -3.191 -12.662
  442   1HB   ASP  66          2HB       ASP  66  73.278  -3.017 -12.281
  443   2HB   ASP  66          1HB       ASP  66  72.477  -1.468 -12.484
  444    H    ASN  67           H        ASN  67  71.791  -3.491  -9.214
  445    HA   ASN  67           HA       ASN  67  71.467  -6.370  -9.585
  446   1HB   ASN  67          2HB       ASN  67  73.854  -5.863  -9.478
  447   2HB   ASN  67          1HB       ASN  67  73.618  -5.047  -7.937
  448   1HD2  ASN  67          1HD2      ASN  67  73.547  -6.204  -6.097
  449   2HD2  ASN  67          2HD2      ASN  67  73.712  -7.932  -6.028
  450    H    ASP  68           H        ASP  68  72.079  -4.258  -6.744
  451    HA   ASP  68           HA       ASP  68  69.688  -5.501  -5.548
  452   1HB   ASP  68          2HB       ASP  68  72.125  -5.619  -4.458
  453   2HB   ASP  68          1HB       ASP  68  71.642  -4.045  -3.828
  454    H    ASN  69           H        ASN  69  69.665  -3.385  -3.422
  455    HA   ASN  69           HA       ASN  69  67.950  -1.677  -5.096
  456   1HB   ASN  69          2HB       ASN  69  67.787  -2.340  -2.153
  457   2HB   ASN  69          1HB       ASN  69  66.698  -1.239  -2.990
  458   1HD2  ASN  69          1HD2      ASN  69  67.745  -4.536  -2.647
  459   2HD2  ASN  69          2HD2      ASN  69  66.334  -5.250  -3.356
  460    H    ASP  70           H        ASP  70  68.533   0.242  -5.460
  461    HA   ASP  70           HA       ASP  70  70.977   1.266  -4.715
  462   1HB   ASP  70          2HB       ASP  70  69.577   1.788  -6.753
  463   2HB   ASP  70          1HB       ASP  70  68.696   2.923  -5.729
  464    H    CYS  71           H        CYS  71  71.683   2.183  -3.013
  465    HA   CYS  71           HA       CYS  71  69.997   4.183  -1.658
  466   1HB   CYS  71          2HB       CYS  71  72.156   2.409  -0.527
  467   2HB   CYS  71          1HB       CYS  71  71.501   3.803   0.324
  468    H    GLY  72           H        GLY  72  72.955   3.408  -3.238
  469   1HA   GLY  72          2HA       GLY  72  74.640   4.771  -4.010
  470   2HA   GLY  72          1HA       GLY  72  73.782   6.151  -3.335
  471    H    ASP  73           H        ASP  73  74.091   3.806  -0.988
  472    HA   ASP  73           HA       ASP  73  76.669   4.746  -0.035
  473   1HB   ASP  73          2HB       ASP  73  75.242   6.436   0.882
  474   2HB   ASP  73          1HB       ASP  73  74.081   5.235   1.441
  475    H    ASN  74           H        ASN  74  77.119   2.518  -0.480
  476    HA   ASN  74           HA       ASN  74  77.954   0.589   0.376
  477   1HB   ASN  74          2HB       ASN  74  77.344   2.018   2.962
  478   2HB   ASN  74          1HB       ASN  74  78.264   0.519   2.864
  479   1HD2  ASN  74          1HD2      ASN  74  78.285   3.941   2.358
  480   2HD2  ASN  74          2HD2      ASN  74  79.969   4.066   1.972
  481    H    SER  75           H        SER  75  74.833   0.912   0.210
  482    HA   SER  75           HA       SER  75  74.057  -1.137   2.102
  483   1HB   SER  75          2HB       SER  75  72.634   0.859   1.808
  484   2HB   SER  75          1HB       SER  75  72.367   0.392   0.128
  485    HG   SER  75           HG       SER  75  70.998  -1.101   0.747
  486    H    ASP  76           H        ASP  76  72.778  -0.750  -1.067
  487    HA   ASP  76           HA       ASP  76  72.480  -3.416  -1.741
  488   1HB   ASP  76          2HB       ASP  76  72.475  -2.363  -4.133
  489   2HB   ASP  76          1HB       ASP  76  71.244  -1.855  -2.972
  490    H    GLU  77           H        GLU  77  74.871  -1.161  -2.966
  491    HA   GLU  77           HA       GLU  77  77.110  -2.818  -2.954
  492   1HB   GLU  77          2HB       GLU  77  77.324  -3.333  -5.374
  493   2HB   GLU  77          1HB       GLU  77  76.007  -4.201  -4.601
  494   1HG   GLU  77          2HG       GLU  77  75.215  -1.648  -5.817
  495   2HG   GLU  77          1HG       GLU  77  75.824  -2.847  -6.958
  496    H    ALA  78           H        ALA  78  75.359  -0.120  -4.139
  497    HA   ALA  78           HA       ALA  78  75.960   2.033  -4.527
  498   1HB   ALA  78          1HB       ALA  78  78.251   2.829  -4.196
  499   2HB   ALA  78          2HB       ALA  78  78.810   1.165  -4.019
  500   3HB   ALA  78          3HB       ALA  78  77.714   1.858  -2.825
  501    H    GLY  79           H        GLY  79  75.561   0.067  -6.469
  502   1HA   GLY  79          2HA       GLY  79  77.526   0.491  -8.564
  503   2HA   GLY  79          1HA       GLY  79  76.096  -0.524  -8.661
  504    H    CYS  80           H        CYS  80  74.678   0.146 -10.087
  505    HA   CYS  80           HA       CYS  80  73.496   1.474 -11.507
  506   1HB   CYS  80          2HB       CYS  80  73.049   2.370  -8.915
  507   2HB   CYS  80          1HB       CYS  80  73.382   3.848  -9.813
  508    H    SER  81           H        SER  81  76.431   1.677 -11.521
  509    HA   SER  81           HA       SER  81  77.134   4.426 -11.880
  510   1HB   SER  81          2HB       SER  81  78.735   1.965 -12.595
  511   2HB   SER  81          1HB       SER  81  79.355   3.592 -12.308
  512    HG   SER  81           HG       SER  81  77.951   2.950 -10.177
  513    H    HIS  82           HN       HIS  82  76.281   1.767 -13.982
  514    HA   HIS  82           HA       HIS  82  75.808   1.624 -16.184
  515   1HB   HIS  82          2HB       HIS  82  75.752   4.639 -15.976
  516   2HB   HIS  82          1HB       HIS  82  75.318   3.757 -17.436
  517    HD1  HIS  82           HD1      HIS  82  74.095   4.359 -13.897
  518    HD2  HIS  82           HD2      HIS  82  72.814   2.647 -17.464
  519    HE1  HIS  82           HE1      HIS  82  71.629   3.883 -13.615
  Start of MODEL   14
    1   1H    SER   1          1HT       SER   1  34.431  -4.176  -2.613
    2   2H    SER   1          2HT       SER   1  35.583  -5.043  -3.499
    3   3H    SER   1          3HT       SER   1  36.075  -3.844  -2.405
    4    HA   SER   1           HA       SER   1  34.707  -6.367  -1.709
    5   1HB   SER   1          2HB       SER   1  37.545  -5.533  -1.065
    6   2HB   SER   1          1HB       SER   1  36.799  -7.112  -0.809
    7    HG   SER   1           HG       SER   1  36.971  -7.564  -2.898
    8    H    ALA   2           H        ALA   2  36.922  -4.120  -0.044
    9    HA   ALA   2           HA       ALA   2  34.828  -3.736   1.990
   10   1HB   ALA   2          1HB       ALA   2  36.617  -5.211   2.807
   11   2HB   ALA   2          2HB       ALA   2  36.564  -3.690   3.697
   12   3HB   ALA   2          3HB       ALA   2  37.803  -3.951   2.468
   13    H    ARG   3           H        ARG   3  35.702  -1.779   3.483
   14    HA   ARG   3           HA       ARG   3  35.698   0.505   1.706
   15   1HB   ARG   3          2HB       ARG   3  34.360   0.251   3.895
   16   2HB   ARG   3          1HB       ARG   3  35.875   0.592   4.718
   17   1HG   ARG   3          2HG       ARG   3  35.981   2.727   3.370
   18   2HG   ARG   3          1HG       ARG   3  34.315   2.395   2.892
   19   1HD   ARG   3          2HD       ARG   3  34.247   3.873   4.765
   20   2HD   ARG   3          1HD       ARG   3  33.729   2.283   5.318
   21    HE   ARG   3           HE       ARG   3  36.500   2.559   5.724
   22   1HH1  ARG   3          1HH1      ARG   3  33.453   3.753   7.002
   23   2HH1  ARG   3          2HH1      ARG   3  34.109   4.067   8.581
   24   1HH2  ARG   3          1HH2      ARG   3  37.339   2.990   7.807
   25   2HH2  ARG   3          2HH2      ARG   3  36.296   3.625   9.045
   26    H    THR   4           H        THR   4  38.091  -1.327   2.122
   27    HA   THR   4           HA       THR   4  40.058   0.804   2.462
   28    HB   THR   4           HB       THR   4  40.003  -0.302   4.627
   29    HG1  THR   4           HG1      THR   4  42.275  -1.051   3.080
   30   1HG2  THR   4          1HG2      THR   4  40.510  -2.675   4.893
   31   2HG2  THR   4          2HG2      THR   4  40.574  -2.867   3.140
   32   3HG2  THR   4          3HG2      THR   4  39.053  -2.447   3.928
   33    H    CYS   5           H        CYS   5  38.933  -0.497   0.154
   34    HA   CYS   5           HA       CYS   5  39.587  -1.289  -1.863
   35   1HB   CYS   5          2HB       CYS   5  42.284  -0.951  -0.578
   36   2HB   CYS   5          1HB       CYS   5  42.125  -1.682  -2.174
   37    HA   PRO   6           HA       PRO   6  39.805  -5.779  -1.743
   38   1HB   PRO   6          2HB       PRO   6  42.255  -5.736  -3.433
   39   2HB   PRO   6          1HB       PRO   6  40.742  -6.614  -3.670
   40   1HG   PRO   6          2HG       PRO   6  41.286  -4.467  -5.132
   41   2HG   PRO   6          1HG       PRO   6  39.640  -4.753  -4.530
   42   1HD   PRO   6          2HD       PRO   6  41.725  -2.854  -3.534
   43   2HD   PRO   6          1HD       PRO   6  39.969  -2.632  -3.672
   44    HA   PRO   7           HA       PRO   7  42.585  -7.000   1.460
   45   1HB   PRO   7          2HB       PRO   7  42.903  -9.625   0.117
   46   2HB   PRO   7          1HB       PRO   7  42.309  -9.254   1.739
   47   1HG   PRO   7          2HG       PRO   7  40.643 -10.023  -0.202
   48   2HG   PRO   7          1HG       PRO   7  40.164  -8.797   0.988
   49   1HD   PRO   7          2HD       PRO   7  41.046  -8.457  -1.851
   50   2HD   PRO   7          1HD       PRO   7  39.776  -7.597  -0.957
   51    H    ASN   8           H        ASN   8  43.618  -7.577  -1.845
   52    HA   ASN   8           HA       ASN   8  46.421  -7.811  -1.052
   53   1HB   ASN   8          2HB       ASN   8  45.217  -9.188  -2.925
   54   2HB   ASN   8          1HB       ASN   8  45.447  -7.741  -3.899
   55   1HD2  ASN   8          1HD2      ASN   8  47.527  -7.147  -4.515
   56   2HD2  ASN   8          2HD2      ASN   8  48.861  -8.236  -4.399
   57    H    GLN   9           H        GLN   9  44.640  -5.371  -0.898
   58    HA   GLN   9           HA       GLN   9  46.385  -3.494  -2.297
   59   1HB   GLN   9          2HB       GLN   9  43.660  -4.056  -3.000
   60   2HB   GLN   9          1HB       GLN   9  43.758  -2.430  -2.347
   61   1HG   GLN   9          2HG       GLN   9  44.010  -2.248  -4.682
   62   2HG   GLN   9          1HG       GLN   9  45.597  -1.975  -3.971
   63   1HE2  GLN   9          1HE2      GLN   9  44.180  -5.153  -4.275
   64   2HE2  GLN   9          2HE2      GLN   9  45.260  -5.733  -5.484
   65    H    PHE  10           H        PHE  10  45.719  -1.225  -1.588
   66    HA   PHE  10           HA       PHE  10  44.813  -1.140   1.187
   67   1HB   PHE  10          2HB       PHE  10  47.222  -1.205   1.356
   68   2HB   PHE  10          1HB       PHE  10  47.392   0.010   0.096
   69    HD1  PHE  10           HD1      PHE  10  45.852  -0.425   3.470
   70    HD2  PHE  10           HD2      PHE  10  47.770   2.196   0.711
   71    HE1  PHE  10           HE1      PHE  10  45.896   1.355   5.179
   72    HE2  PHE  10           HE2      PHE  10  47.797   3.953   2.394
   73    HZ   PHE  10           HZ       PHE  10  46.881   3.554   4.626
   74    H    SER  11           H        SER  11  43.938   0.936   1.736
   75    HA   SER  11           HA       SER  11  43.122   2.420  -0.613
   76   1HB   SER  11          2HB       SER  11  41.312   1.269   0.697
   77   2HB   SER  11          1HB       SER  11  41.699   2.337   2.049
   78    HG   SER  11           HG       SER  11  41.184   3.471  -0.463
   79    H    CYS  12           H        CYS  12  44.451   4.071  -0.818
   80    HA   CYS  12           HA       CYS  12  45.577   5.643   1.182
   81   1HB   CYS  12          2HB       CYS  12  46.258   5.820  -1.153
   82   2HB   CYS  12          1HB       CYS  12  44.671   6.428  -1.594
   83    H    ALA  13           H        ALA  13  44.921   7.558   2.149
   84    HA   ALA  13           HA       ALA  13  42.848   7.528   3.696
   85   1HB   ALA  13          1HB       ALA  13  43.593  10.097   2.334
   86   2HB   ALA  13          2HB       ALA  13  44.514   9.337   3.635
   87   3HB   ALA  13          3HB       ALA  13  42.873   9.914   3.934
   88    H    SER  14           H        SER  14  40.997   6.645   3.058
   89    HA   SER  14           HA       SER  14  38.887   6.468   2.283
   90   1HB   SER  14          2HB       SER  14  37.526   8.547   2.715
   91   2HB   SER  14          1HB       SER  14  38.483   7.961   4.074
   92    HG   SER  14           HG       SER  14  39.752   9.785   2.431
   93    H    GLY  15           H        GLY  15  39.692   6.071   0.030
   94   1HA   GLY  15          2HA       GLY  15  37.845   6.712  -1.731
   95   2HA   GLY  15          1HA       GLY  15  38.764   8.211  -1.747
   96    H    ARG  16           H        ARG  16  41.342   6.913  -1.432
   97    HA   ARG  16           HA       ARG  16  41.623   6.276  -4.262
   98   1HB   ARG  16          2HB       ARG  16  43.672   7.016  -2.168
   99   2HB   ARG  16          1HB       ARG  16  44.078   6.585  -3.821
  100   1HG   ARG  16          2HG       ARG  16  44.075   8.940  -3.740
  101   2HG   ARG  16          1HG       ARG  16  42.593   8.476  -4.573
  102   1HD   ARG  16          2HD       ARG  16  41.521   8.641  -2.202
  103   2HD   ARG  16          1HD       ARG  16  42.951   9.602  -1.818
  104    HE   ARG  16           HE       ARG  16  42.120  10.843  -4.006
  105   1HH1  ARG  16          1HH1      ARG  16  40.326   9.778  -1.198
  106   2HH1  ARG  16          2HH1      ARG  16  39.050  10.924  -1.419
  107   1HH2  ARG  16          1HH2      ARG  16  40.440  12.364  -4.311
  108   2HH2  ARG  16          2HH2      ARG  16  39.091  12.376  -3.211
  109    H    CYS  17           H        CYS  17  43.274   4.559  -4.830
  110    HA   CYS  17           HA       CYS  17  43.094   2.280  -3.008
  111   1HB   CYS  17          2HB       CYS  17  41.224   2.505  -4.924
  112   2HB   CYS  17          1HB       CYS  17  42.498   1.746  -5.873
  113    H    ILE  18           H        ILE  18  45.080   1.487  -2.827
  114    HA   ILE  18           HA       ILE  18  46.911   1.626  -5.130
  115    HB   ILE  18           HB       ILE  18  48.734   2.372  -3.721
  116   1HG1  ILE  18          2HG1      ILE  18  47.773   3.153  -1.306
  117   2HG1  ILE  18          1HG1      ILE  18  46.866   1.668  -1.555
  118   1HG2  ILE  18          1HG2      ILE  18  47.194   4.098  -4.596
  119   2HG2  ILE  18          2HG2      ILE  18  48.001   4.576  -3.102
  120   3HG2  ILE  18          3HG2      ILE  18  46.321   4.041  -3.061
  121   1HD1  ILE  18          1HD1      ILE  18  48.856   1.197  -0.310
  122   2HD1  ILE  18          2HD1      ILE  18  49.853   1.979  -1.532
  123   3HD1  ILE  18          3HD1      ILE  18  49.002   0.483  -1.917
  124    HA   PRO  19           HA       PRO  19  47.571  -2.642  -3.965
  125   1HB   PRO  19          2HB       PRO  19  50.276  -2.342  -5.147
  126   2HB   PRO  19          1HB       PRO  19  48.969  -3.455  -5.586
  127   1HG   PRO  19          2HG       PRO  19  49.507  -1.428  -7.194
  128   2HG   PRO  19          1HG       PRO  19  47.815  -1.808  -6.805
  129   1HD   PRO  19          2HD       PRO  19  49.600   0.257  -5.512
  130   2HD   PRO  19          1HD       PRO  19  47.990   0.497  -6.237
  131    H    ILE  20           H        ILE  20  48.548  -3.794  -2.328
  132    HA   ILE  20           HA       ILE  20  49.467  -2.457  -0.102
  133    HB   ILE  20           HB       ILE  20  49.671  -5.311  -0.967
  134   1HG1  ILE  20          2HG1      ILE  20  47.500  -4.383  -0.259
  135   2HG1  ILE  20          1HG1      ILE  20  48.058  -5.657   0.823
  136   1HG2  ILE  20          1HG2      ILE  20  50.698  -4.252   1.659
  137   2HG2  ILE  20          2HG2      ILE  20  51.674  -4.956   0.370
  138   3HG2  ILE  20          3HG2      ILE  20  50.504  -5.952   1.237
  139   1HD1  ILE  20          1HD1      ILE  20  48.274  -2.698   1.347
  140   2HD1  ILE  20          2HD1      ILE  20  48.776  -3.990   2.440
  141   3HD1  ILE  20          3HD1      ILE  20  47.072  -3.785   2.044
  142    H    SER  21           H        SER  21  51.289  -3.434  -2.860
  143    HA   SER  21           HA       SER  21  53.883  -3.524  -1.679
  144   1HB   SER  21          2HB       SER  21  54.535  -3.422  -4.166
  145   2HB   SER  21          1HB       SER  21  53.559  -4.794  -3.638
  146    HG   SER  21           HG       SER  21  52.633  -2.436  -4.921
  147    H    TRP  22           H        TRP  22  52.239  -0.968  -1.438
  148    HA   TRP  22           HA       TRP  22  54.142   0.910  -2.671
  149   1HB   TRP  22          2HB       TRP  22  51.149   1.163  -2.577
  150   2HB   TRP  22          1HB       TRP  22  52.220   2.479  -3.032
  151    HD1  TRP  22           HD1      TRP  22  52.369  -1.191  -4.203
  152    HE1  TRP  22           HE1      TRP  22  52.190  -1.222  -6.739
  153    HE3  TRP  22           HE3      TRP  22  51.603   3.793  -5.006
  154    HZ2  TRP  22           HZ2      TRP  22  51.779   0.623  -8.854
  155    HZ3  TRP  22           HZ3      TRP  22  51.327   4.581  -7.324
  156    HH2  TRP  22           HH2      TRP  22  51.410   3.025  -9.206
  157    H    THR  23           H        THR  23  52.007   0.328   0.015
  158    HA   THR  23           HA       THR  23  52.451   3.005   1.003
  159    HB   THR  23           HB       THR  23  50.164   2.254   1.042
  160    HG1  THR  23           HG1      THR  23  51.088   3.560   2.819
  161   1HG2  THR  23          1HG2      THR  23  49.419   0.422   2.482
  162   2HG2  THR  23          2HG2      THR  23  51.095   0.065   2.900
  163   3HG2  THR  23          3HG2      THR  23  50.534  -0.152   1.242
  164    H    CYS  24           H        CYS  24  53.119  -0.275   2.014
  165    HA   CYS  24           HA       CYS  24  54.259   0.671   4.489
  166   1HB   CYS  24          2HB       CYS  24  53.876  -2.161   3.530
  167   2HB   CYS  24          1HB       CYS  24  54.389  -1.672   5.142
  168    H    ASP  25           H        ASP  25  55.808   1.647   2.604
  169    HA   ASP  25           HA       ASP  25  58.275   0.182   3.057
  170   1HB   ASP  25          2HB       ASP  25  58.985   0.448   0.672
  171   2HB   ASP  25          1HB       ASP  25  57.705  -0.726   0.933
  172    H    LEU  26           H        LEU  26  56.842   2.736   3.734
  173    HA   LEU  26           HA       LEU  26  57.590   4.634   4.659
  174   1HB   LEU  26          2HB       LEU  26  60.221   3.911   3.401
  175   2HB   LEU  26          1HB       LEU  26  59.975   5.402   4.288
  176    HG   LEU  26           HG       LEU  26  59.642   2.625   5.422
  177   1HD1  LEU  26          1HD1      LEU  26  61.661   3.148   6.718
  178   2HD1  LEU  26          2HD1      LEU  26  61.821   4.671   5.842
  179   3HD1  LEU  26          3HD1      LEU  26  61.982   3.140   4.986
  180   1HD2  LEU  26          1HD2      LEU  26  58.151   4.207   6.485
  181   2HD2  LEU  26          2HD2      LEU  26  59.488   5.327   6.744
  182   3HD2  LEU  26          3HD2      LEU  26  59.469   3.776   7.578
  183    H    ASP  27           H        ASP  27  55.962   5.399   3.265
  184    HA   ASP  27           HA       ASP  27  55.213   7.308   2.274
  185   1HB   ASP  27          2HB       ASP  27  57.107   8.549   3.050
  186   2HB   ASP  27          1HB       ASP  27  58.150   7.835   1.829
  187    H    ASP  28           H        ASP  28  54.175   7.441   0.424
  188    HA   ASP  28           HA       ASP  28  55.404   7.782  -2.030
  189   1HB   ASP  28          2HB       ASP  28  55.843   5.337  -1.995
  190   2HB   ASP  28          1HB       ASP  28  54.106   5.052  -1.892
  191    H    ASP  29           H        ASP  29  52.447   6.155  -0.849
  192    HA   ASP  29           HA       ASP  29  50.905   7.823  -2.661
  193   1HB   ASP  29          2HB       ASP  29  48.968   6.378  -1.961
  194   2HB   ASP  29          1HB       ASP  29  50.276   5.540  -2.780
  195    H    CYS  30           H        CYS  30  50.001   6.795   0.574
  196    HA   CYS  30           HA       CYS  30  50.254   9.322   1.775
  197   1HB   CYS  30          2HB       CYS  30  48.016  10.045   2.057
  198   2HB   CYS  30          1HB       CYS  30  48.214   9.772   0.319
  199    H    GLY  31           H        GLY  31  48.874   6.127   1.630
  200   1HA   GLY  31          2HA       GLY  31  48.223   4.633   3.217
  201   2HA   GLY  31          1HA       GLY  31  49.403   5.409   4.262
  202    H    ASP  32           H        ASP  32  48.802   6.902   5.647
  203    HA   ASP  32           HA       ASP  32  45.927   7.343   6.093
  204   1HB   ASP  32          2HB       ASP  32  46.702   6.316   8.057
  205   2HB   ASP  32          1HB       ASP  32  48.279   7.087   7.954
  206    H    ARG  33           H        ARG  33  49.008   8.903   6.845
  207    HA   ARG  33           HA       ARG  33  48.251  11.228   5.222
  208   1HB   ARG  33          2HB       ARG  33  49.452  11.394   7.990
  209   2HB   ARG  33          1HB       ARG  33  49.092  12.753   6.933
  210   1HG   ARG  33          2HG       ARG  33  46.785  12.480   7.187
  211   2HG   ARG  33          1HG       ARG  33  46.968  10.847   7.833
  212   1HD   ARG  33          2HD       ARG  33  47.942  11.706   9.863
  213   2HD   ARG  33          1HD       ARG  33  47.943  13.345   9.213
  214    HE   ARG  33           HE       ARG  33  45.628  13.457   9.555
  215   1HH1  ARG  33          1HH1      ARG  33  46.816  10.263  10.355
  216   2HH1  ARG  33          2HH1      ARG  33  45.490   9.912  11.419
  217   1HH2  ARG  33          1HH2      ARG  33  43.883  12.968  10.987
  218   2HH2  ARG  33          2HH2      ARG  33  43.853  11.432  11.790
  219    H    SER  34           H        SER  34  50.639   9.188   6.673
  220    HA   SER  34           HA       SER  34  52.602   9.990   4.666
  221   1HB   SER  34          2HB       SER  34  53.259   9.629   7.605
  222   2HB   SER  34          1HB       SER  34  54.395  10.046   6.322
  223    HG   SER  34           HG       SER  34  52.650  11.862   6.071
  224    H    ASP  35           H        ASP  35  50.696   7.831   5.219
  225    HA   ASP  35           HA       ASP  35  50.465   5.661   4.714
  226   1HB   ASP  35          2HB       ASP  35  53.393   5.312   4.182
  227   2HB   ASP  35          1HB       ASP  35  52.017   4.460   3.473
  228    H    GLU  36           H        GLU  36  53.045   6.409   6.878
  229    HA   GLU  36           HA       GLU  36  52.986   3.670   7.930
  230   1HB   GLU  36          2HB       GLU  36  55.027   5.822   8.505
  231   2HB   GLU  36          1HB       GLU  36  55.167   4.101   8.837
  232   1HG   GLU  36          2HG       GLU  36  55.011   5.321   6.091
  233   2HG   GLU  36          1HG       GLU  36  56.499   4.845   6.905
  234    H    SER  37           H        SER  37  50.864   4.430   8.935
  235    HA   SER  37           HA       SER  37  51.468   5.093  11.681
  236   1HB   SER  37          2HB       SER  37  49.463   6.752  10.130
  237   2HB   SER  37          1HB       SER  37  49.830   6.906  11.849
  238    HG   SER  37           HG       SER  37  52.134   7.069  10.597
  239    H    ALA  38           H        ALA  38  50.732   3.261  12.498
  240    HA   ALA  38           HA       ALA  38  49.313   1.696  13.284
  241   1HB   ALA  38          1HB       ALA  38  47.143   3.640  12.506
  242   2HB   ALA  38          2HB       ALA  38  48.027   3.646  14.032
  243   3HB   ALA  38          3HB       ALA  38  46.980   2.285  13.625
  244    H    SER  39           H        SER  39  49.776   2.157  10.237
  245    HA   SER  39           HA       SER  39  47.833   0.167   9.325
  246   1HB   SER  39          2HB       SER  39  48.825   0.919   7.034
  247   2HB   SER  39          1HB       SER  39  47.731   2.021   7.874
  248    HG   SER  39           HG       SER  39  49.942   2.782   7.034
  249    H    CYS  40           H        CYS  40  51.173   1.056   8.526
  250    HA   CYS  40           HA       CYS  40  51.888  -1.751   8.327
  251   1HB   CYS  40          2HB       CYS  40  53.653   0.635   7.803
  252   2HB   CYS  40          1HB       CYS  40  53.759  -0.984   7.110
  253    H    ALA  41           H        ALA  41  53.476   1.130   9.709
  254    HA   ALA  41           HA       ALA  41  54.428   1.560  11.727
  255   1HB   ALA  41          1HB       ALA  41  53.264   0.718  13.691
  256   2HB   ALA  41          2HB       ALA  41  52.433  -0.480  12.700
  257   3HB   ALA  41          3HB       ALA  41  52.116   1.240  12.456
  258    H    TYR  42           H        TYR  42  55.668  -0.536  10.133
  259    HA   TYR  42           HA       TYR  42  56.485  -2.659  11.845
  260   1HB   TYR  42          2HB       TYR  42  58.281  -2.930   9.993
  261   2HB   TYR  42          1HB       TYR  42  56.592  -3.201   9.580
  262    HD1  TYR  42           HD1      TYR  42  55.424  -1.720   8.083
  263    HD2  TYR  42           HD2      TYR  42  59.447  -0.920   9.205
  264    HE1  TYR  42           HE1      TYR  42  55.597  -0.068   6.275
  265    HE2  TYR  42           HE2      TYR  42  59.627   0.738   7.407
  266    HH   TYR  42           HH       TYR  42  56.902   1.847   5.630
  267    HA   PRO  43           HA       PRO  43  59.572  -0.157  13.907
  268   1HB   PRO  43          2HB       PRO  43  59.941  -1.761  16.011
  269   2HB   PRO  43          1HB       PRO  43  58.445  -0.841  15.812
  270   1HG   PRO  43          2HG       PRO  43  58.975  -3.735  15.291
  271   2HG   PRO  43          1HG       PRO  43  57.537  -2.962  15.984
  272   1HD   PRO  43          2HD       PRO  43  57.816  -3.774  13.334
  273   2HD   PRO  43          1HD       PRO  43  56.617  -2.612  13.931
  274    H    THR  44           H        THR  44  60.027  -2.750  12.027
  275    HA   THR  44           HA       THR  44  62.901  -2.862  12.559
  276    HB   THR  44           HB       THR  44  61.954  -4.757  13.782
  277    HG1  THR  44           HG1      THR  44  63.425  -5.339  11.428
  278   1HG2  THR  44          1HG2      THR  44  59.898  -5.075  12.492
  279   2HG2  THR  44          2HG2      THR  44  60.807  -6.583  12.597
  280   3HG2  THR  44          3HG2      THR  44  60.841  -5.635  11.111
  281    H    CYS  45           H        CYS  45  60.860  -1.905  10.457
  282    HA   CYS  45           HA       CYS  45  60.594  -1.789   8.208
  283   1HB   CYS  45          2HB       CYS  45  63.175  -1.790   8.303
  284   2HB   CYS  45          1HB       CYS  45  63.062  -3.477   7.818
  285    H    PHE  46           H        PHE  46  59.600  -3.035   6.539
  286    HA   PHE  46           HA       PHE  46  58.949  -5.731   7.523
  287   1HB   PHE  46          2HB       PHE  46  57.131  -3.970   7.637
  288   2HB   PHE  46          1HB       PHE  46  57.139  -3.971   5.872
  289    HD1  PHE  46           HD1      PHE  46  56.237  -5.797   4.634
  290    HD2  PHE  46           HD2      PHE  46  56.376  -5.930   8.876
  291    HE1  PHE  46           HE1      PHE  46  54.746  -7.741   4.596
  292    HE2  PHE  46           HE2      PHE  46  54.884  -7.884   8.871
  293    HZ   PHE  46           HZ       PHE  46  54.058  -8.800   6.726
  294    HA   PRO  47           HA       PRO  47  60.455  -7.214   3.611
  295   1HB   PRO  47          2HB       PRO  47  59.015  -9.691   4.202
  296   2HB   PRO  47          1HB       PRO  47  60.753  -9.405   4.093
  297   1HG   PRO  47          2HG       PRO  47  59.514  -9.924   6.433
  298   2HG   PRO  47          1HG       PRO  47  60.936  -8.869   6.325
  299   1HD   PRO  47          2HD       PRO  47  58.038  -8.132   6.537
  300   2HD   PRO  47          1HD       PRO  47  59.444  -7.419   7.360
  301    H    LEU  48           H        LEU  48  57.921  -5.702   3.526
  302    HA   LEU  48           HA       LEU  48  56.265  -7.241   1.707
  303   1HB   LEU  48          2HB       LEU  48  56.113  -4.483   2.833
  304   2HB   LEU  48          1HB       LEU  48  55.370  -4.735   1.262
  305    HG   LEU  48           HG       LEU  48  54.673  -6.172   3.823
  306   1HD1  LEU  48          1HD1      LEU  48  53.866  -3.887   3.754
  307   2HD1  LEU  48          2HD1      LEU  48  52.528  -5.022   3.575
  308   3HD1  LEU  48          3HD1      LEU  48  53.156  -4.169   2.165
  309   1HD2  LEU  48          1HD2      LEU  48  54.473  -7.688   1.948
  310   2HD2  LEU  48          2HD2      LEU  48  53.559  -6.484   1.042
  311   3HD2  LEU  48          3HD2      LEU  48  52.868  -7.199   2.498
  312    H    THR  49           H        THR  49  57.604  -4.015   1.247
  313    HA   THR  49           HA       THR  49  58.633  -4.801  -1.355
  314    HB   THR  49           HB       THR  49  57.251  -3.024  -2.456
  315    HG1  THR  49           HG1      THR  49  56.351  -1.727  -0.976
  316   1HG2  THR  49          1HG2      THR  49  55.186  -4.382  -2.489
  317   2HG2  THR  49          2HG2      THR  49  55.766  -5.275  -1.077
  318   3HG2  THR  49          3HG2      THR  49  56.633  -5.381  -2.612
  319    H    GLN  50           H        GLN  50  60.034  -3.943   0.894
  320    HA   GLN  50           HA       GLN  50  60.972  -1.329  -0.041
  321   1HB   GLN  50          2HB       GLN  50  61.493  -0.805   2.409
  322   2HB   GLN  50          1HB       GLN  50  59.813  -0.709   1.901
  323   1HG   GLN  50          2HG       GLN  50  59.558  -3.040   2.814
  324   2HG   GLN  50          1HG       GLN  50  61.147  -2.813   3.549
  325   1HE2  GLN  50          1HE2      GLN  50  60.562   0.106   3.831
  326   2HE2  GLN  50          2HE2      GLN  50  59.508   0.230   5.195
  327    H    PHE  51           H        PHE  51  63.123  -0.912   0.150
  328    HA   PHE  51           HA       PHE  51  64.858  -3.242   0.640
  329   1HB   PHE  51          2HB       PHE  51  65.038  -2.419  -1.641
  330   2HB   PHE  51          1HB       PHE  51  65.211  -0.763  -1.079
  331    HD1  PHE  51           HD1      PHE  51  66.909  -4.083  -0.901
  332    HD2  PHE  51           HD2      PHE  51  67.327   0.158  -0.893
  333    HE1  PHE  51           HE1      PHE  51  69.354  -4.317  -0.997
  334    HE2  PHE  51           HE2      PHE  51  69.765  -0.078  -0.974
  335    HZ   PHE  51           HZ       PHE  51  70.784  -2.310  -1.038
  336    H    THR  52           H        THR  52  66.763  -2.852   1.946
  337    HA   THR  52           HA       THR  52  66.255  -0.626   3.787
  338    HB   THR  52           HB       THR  52  67.906  -3.099   4.301
  339    HG1  THR  52           HG1      THR  52  65.245  -2.623   5.187
  340   1HG2  THR  52          1HG2      THR  52  66.683  -1.075   6.175
  341   2HG2  THR  52          2HG2      THR  52  68.389  -1.194   5.760
  342   3HG2  THR  52          3HG2      THR  52  67.611  -2.499   6.653
  343    H    CYS  53           H        CYS  53  67.403   1.076   3.024
  344    HA   CYS  53           HA       CYS  53  69.986   1.019   1.985
  345   1HB   CYS  53          2HB       CYS  53  68.469   3.007   2.092
  346   2HB   CYS  53          1HB       CYS  53  68.919   3.174   3.785
  347    H    ASN  54           H        ASN  54  72.038   0.880   2.810
  348    HA   ASN  54           HA       ASN  54  72.345  -0.410   5.292
  349   1HB   ASN  54          2HB       ASN  54  74.650  -0.502   4.871
  350   2HB   ASN  54          1HB       ASN  54  73.910  -0.541   3.281
  351   1HD2  ASN  54          1HD2      ASN  54  73.380   2.273   3.062
  352   2HD2  ASN  54          2HD2      ASN  54  74.902   3.069   2.905
  353    H    ASN  55           H        ASN  55  71.885   2.833   4.629
  354    HA   ASN  55           HA       ASN  55  73.266   4.083   6.724
  355   1HB   ASN  55          2HB       ASN  55  72.115   5.226   4.805
  356   2HB   ASN  55          1HB       ASN  55  70.575   4.835   5.559
  357   1HD2  ASN  55          1HD2      ASN  55  73.329   6.872   5.549
  358   2HD2  ASN  55          2HD2      ASN  55  72.795   7.960   6.793
  359    H    GLY  56           H        GLY  56  70.351   2.211   6.527
  360   1HA   GLY  56          2HA       GLY  56  69.753   1.063   8.655
  361   2HA   GLY  56          1HA       GLY  56  69.845   2.656   9.401
  362    H    ARG  57           H        ARG  57  68.733   3.431   6.553
  363    HA   ARG  57           HA       ARG  57  65.977   3.458   7.506
  364   1HB   ARG  57          2HB       ARG  57  66.018   5.585   6.821
  365   2HB   ARG  57          1HB       ARG  57  67.684   5.381   6.306
  366   1HG   ARG  57          2HG       ARG  57  65.879   4.309   4.342
  367   2HG   ARG  57          1HG       ARG  57  65.484   5.989   4.720
  368   1HD   ARG  57          2HD       ARG  57  68.109   4.870   3.758
  369   2HD   ARG  57          1HD       ARG  57  67.045   6.001   2.924
  370    HE   ARG  57           HE       ARG  57  67.744   7.239   5.281
  371   1HH1  ARG  57          1HH1      ARG  57  69.381   6.041   2.441
  372   2HH1  ARG  57          2HH1      ARG  57  70.772   7.066   2.644
  373   1HH2  ARG  57          1HH2      ARG  57  69.581   8.637   5.515
  374   2HH2  ARG  57          2HH2      ARG  57  70.871   8.531   4.359
  375    H    CYS  58           H        CYS  58  64.269   2.834   6.021
  376    HA   CYS  58           HA       CYS  58  65.256   1.050   3.910
  377   1HB   CYS  58          2HB       CYS  58  62.591   1.160   5.335
  378   2HB   CYS  58          1HB       CYS  58  62.903   0.129   3.942
  379    H    ILE  59           H        ILE  59  64.341   1.106   1.862
  380    HA   ILE  59           HA       ILE  59  62.892   3.558   1.233
  381    HB   ILE  59           HB       ILE  59  64.047   3.654  -0.934
  382   1HG1  ILE  59          2HG1      ILE  59  65.938   1.589   0.179
  383   2HG1  ILE  59          1HG1      ILE  59  64.598   1.169  -0.883
  384   1HG2  ILE  59          1HG2      ILE  59  66.200   4.467  -0.108
  385   2HG2  ILE  59          2HG2      ILE  59  65.906   3.679   1.443
  386   3HG2  ILE  59          3HG2      ILE  59  64.871   5.008   0.916
  387   1HD1  ILE  59          1HD1      ILE  59  65.522   2.575  -2.625
  388   2HD1  ILE  59          2HD1      ILE  59  66.694   1.366  -2.097
  389   3HD1  ILE  59          3HD1      ILE  59  66.853   3.039  -1.562
  390    H    ASN  60           H        ASN  60  61.903   3.265  -1.135
  391    HA   ASN  60           HA       ASN  60  60.228   0.986  -1.129
  392   1HB   ASN  60          2HB       ASN  60  59.584   3.100  -2.205
  393   2HB   ASN  60          1HB       ASN  60  60.872   2.901  -3.386
  394   1HD2  ASN  60          1HD2      ASN  60  57.746   1.809  -2.320
  395   2HD2  ASN  60          2HD2      ASN  60  57.354   0.928  -3.767
  396    H    ILE  61           H        ILE  61  60.379  -0.958  -2.176
  397    HA   ILE  61           HA       ILE  61  62.991  -1.936  -2.665
  398    HB   ILE  61           HB       ILE  61  60.580  -3.049  -2.023
  399   1HG1  ILE  61          2HG1      ILE  61  62.764  -3.909  -1.368
  400   2HG1  ILE  61          1HG1      ILE  61  61.747  -5.195  -2.003
  401   1HG2  ILE  61          1HG2      ILE  61  61.215  -3.969  -4.822
  402   2HG2  ILE  61          2HG2      ILE  61  59.774  -3.100  -4.297
  403   3HG2  ILE  61          3HG2      ILE  61  60.067  -4.746  -3.730
  404   1HD1  ILE  61          1HD1      ILE  61  62.963  -5.082  -4.126
  405   2HD1  ILE  61          2HD1      ILE  61  64.017  -5.448  -2.760
  406   3HD1  ILE  61          3HD1      ILE  61  64.002  -3.825  -3.450
  407    H    ASN  62           H        ASN  62  61.030  -0.176  -4.738
  408    HA   ASN  62           HA       ASN  62  61.961  -1.655  -7.104
  409   1HB   ASN  62          2HB       ASN  62  59.425  -0.990  -6.523
  410   2HB   ASN  62          1HB       ASN  62  59.906   0.460  -7.402
  411   1HD2  ASN  62          1HD2      ASN  62  60.628   0.247  -9.558
  412   2HD2  ASN  62          2HD2      ASN  62  60.151  -1.112 -10.510
  413    H    TRP  63           H        TRP  63  63.607   0.240  -5.612
  414    HA   TRP  63           HA       TRP  63  63.994   2.326  -7.659
  415   1HB   TRP  63          2HB       TRP  63  64.910   2.188  -4.779
  416   2HB   TRP  63          1HB       TRP  63  65.399   3.451  -5.905
  417    HD1  TRP  63           HD1      TRP  63  61.952   2.858  -6.797
  418    HE1  TRP  63           HE1      TRP  63  60.348   4.487  -5.614
  419    HE3  TRP  63           HE3      TRP  63  65.109   4.621  -3.216
  420    HZ2  TRP  63           HZ2      TRP  63  60.422   6.294  -3.443
  421    HZ3  TRP  63           HZ3      TRP  63  64.278   6.300  -1.615
  422    HH2  TRP  63           HH2      TRP  63  61.981   7.119  -1.729
  423    H    ARG  64           H        ARG  64  64.641  -0.357  -7.987
  424    HA   ARG  64           HA       ARG  64  67.461  -0.775  -7.612
  425   1HB   ARG  64          2HB       ARG  64  65.582  -2.512  -7.544
  426   2HB   ARG  64          1HB       ARG  64  65.575  -2.409  -9.296
  427   1HG   ARG  64          2HG       ARG  64  67.032  -4.091  -9.172
  428   2HG   ARG  64          1HG       ARG  64  68.210  -2.831  -8.790
  429   1HD   ARG  64          2HD       ARG  64  68.324  -4.665  -7.181
  430   2HD   ARG  64          1HD       ARG  64  67.806  -3.164  -6.412
  431    HE   ARG  64           HE       ARG  64  65.453  -4.208  -6.860
  432   1HH1  ARG  64          1HH1      ARG  64  68.363  -5.817  -5.758
  433   2HH1  ARG  64          2HH1      ARG  64  67.504  -7.084  -4.935
  434   1HH2  ARG  64          1HH2      ARG  64  64.307  -5.859  -5.772
  435   2HH2  ARG  64          2HH2      ARG  64  65.180  -7.106  -4.943
  436    H    CYS  65           H        CYS  65  68.799   0.426  -8.940
  437    HA   CYS  65           HA       CYS  65  68.203   0.700 -11.743
  438   1HB   CYS  65          2HB       CYS  65  69.564   2.432 -10.674
  439   2HB   CYS  65          1HB       CYS  65  70.765   1.231 -10.216
  440    H    ASP  66           H        ASP  66  69.816  -1.496  -9.677
  441    HA   ASP  66           HA       ASP  66  70.535  -3.230 -11.891
  442   1HB   ASP  66          2HB       ASP  66  72.893  -3.412 -11.061
  443   2HB   ASP  66          1HB       ASP  66  72.492  -1.848 -11.758
  444    H    ASN  67           H        ASN  67  71.928  -3.292  -8.667
  445    HA   ASN  67           HA       ASN  67  70.565  -5.823  -8.174
  446   1HB   ASN  67          2HB       ASN  67  72.989  -6.090  -8.489
  447   2HB   ASN  67          1HB       ASN  67  73.287  -4.909  -7.220
  448   1HD2  ASN  67          1HD2      ASN  67  73.029  -5.489  -5.069
  449   2HD2  ASN  67          2HD2      ASN  67  72.849  -7.146  -4.588
  450    H    ASP  68           H        ASP  68  71.557  -2.745  -6.902
  451    HA   ASP  68           HA       ASP  68  69.954  -3.251  -4.487
  452   1HB   ASP  68          2HB       ASP  68  72.419  -1.552  -4.866
  453   2HB   ASP  68          1HB       ASP  68  71.364  -1.391  -3.464
  454    H    ASN  69           H        ASN  69  69.452  -0.782  -3.559
  455    HA   ASN  69           HA       ASN  69  67.875   0.324  -5.784
  456   1HB   ASN  69          2HB       ASN  69  66.904  -0.264  -2.979
  457   2HB   ASN  69          1HB       ASN  69  65.971   0.566  -4.221
  458   1HD2  ASN  69          1HD2      ASN  69  67.365  -2.483  -3.244
  459   2HD2  ASN  69          2HD2      ASN  69  66.416  -3.465  -4.301
  460    H    ASP  70           H        ASP  70  67.821   2.437  -5.971
  461    HA   ASP  70           HA       ASP  70  69.638   4.169  -4.942
  462   1HB   ASP  70          2HB       ASP  70  66.841   4.760  -5.925
  463   2HB   ASP  70          1HB       ASP  70  68.045   6.003  -5.631
  464    H    CYS  71           H        CYS  71  69.922   4.116  -2.718
  465    HA   CYS  71           HA       CYS  71  67.751   5.378  -1.173
  466   1HB   CYS  71          2HB       CYS  71  68.466   4.261   0.766
  467   2HB   CYS  71          1HB       CYS  71  68.559   3.042  -0.498
  468    H    GLY  72           H        GLY  72  70.999   5.649  -2.300
  469   1HA   GLY  72          2HA       GLY  72  71.925   7.835  -2.556
  470   2HA   GLY  72          1HA       GLY  72  71.050   8.339  -1.118
  471    H    ASP  73           H        ASP  73  72.306   5.461  -0.230
  472    HA   ASP  73           HA       ASP  73  74.667   6.798   0.899
  473   1HB   ASP  73          2HB       ASP  73  72.798   4.751   1.995
  474   2HB   ASP  73          1HB       ASP  73  74.469   4.745   2.548
  475    H    ASN  74           H        ASN  74  74.615   5.548  -1.699
  476    HA   ASN  74           HA       ASN  74  76.252   4.657  -2.976
  477   1HB   ASN  74          2HB       ASN  74  77.722   4.486  -0.349
  478   2HB   ASN  74          1HB       ASN  74  78.444   4.092  -1.906
  479   1HD2  ASN  74          1HD2      ASN  74  79.102   6.187   0.043
  480   2HD2  ASN  74          2HD2      ASN  74  79.025   7.673  -0.832
  481    H    SER  75           H        SER  75  74.298   2.858  -1.307
  482    HA   SER  75           HA       SER  75  75.688   0.322  -1.499
  483   1HB   SER  75          2HB       SER  75  72.728   0.737  -1.105
  484   2HB   SER  75          1HB       SER  75  73.697  -0.657  -0.629
  485    HG   SER  75           HG       SER  75  74.818   1.321   0.587
  486    H    ASP  76           H        ASP  76  72.884   1.792  -2.907
  487    HA   ASP  76           HA       ASP  76  72.305   0.040  -4.967
  488   1HB   ASP  76          2HB       ASP  76  71.427   2.362  -5.963
  489   2HB   ASP  76          1HB       ASP  76  70.623   1.526  -4.629
  490    H    GLU  77           H        GLU  77  73.964   3.170  -5.233
  491    HA   GLU  77           HA       GLU  77  74.568   2.777  -7.994
  492   1HB   GLU  77          2HB       GLU  77  75.408   4.939  -6.063
  493   2HB   GLU  77          1HB       GLU  77  75.698   4.981  -7.799
  494   1HG   GLU  77          2HG       GLU  77  73.023   4.952  -6.419
  495   2HG   GLU  77          1HG       GLU  77  73.771   6.313  -7.256
  496    H    ALA  78           H        ALA  78  75.812   1.073  -5.790
  497    HA   ALA  78           HA       ALA  78  78.618   1.302  -6.083
  498   1HB   ALA  78          1HB       ALA  78  77.595  -0.143  -4.392
  499   2HB   ALA  78          2HB       ALA  78  78.704  -1.051  -5.419
  500   3HB   ALA  78          3HB       ALA  78  76.963  -1.191  -5.664
  501    H    GLY  79           H        GLY  79  76.104   0.264  -8.205
  502   1HA   GLY  79          2HA       GLY  79  78.129  -0.195 -10.287
  503   2HA   GLY  79          1HA       GLY  79  76.846  -1.376 -10.064
  504    H    CYS  80           H        CYS  80  74.617  -0.548 -10.209
  505    HA   CYS  80           HA       CYS  80  72.973   0.264 -11.527
  506   1HB   CYS  80          2HB       CYS  80  73.309   2.228 -10.122
  507   2HB   CYS  80          1HB       CYS  80  74.543   2.827 -11.220
  508    H    SER  81           H        SER  81  74.989   2.673 -13.049
  509    HA   SER  81           HA       SER  81  75.762   1.200 -15.318
  510   1HB   SER  81          2HB       SER  81  74.099   2.182 -16.936
  511   2HB   SER  81          1HB       SER  81  73.417   0.989 -15.828
  512    HG   SER  81           HG       SER  81  72.672   2.761 -14.537
  513    H    HIS  82           HN       HIS  82  75.842   3.012 -17.290
  514    HA   HIS  82           HA       HIS  82  76.808   5.512 -16.122
  515   1HB   HIS  82          2HB       HIS  82  78.754   5.455 -17.737
  516   2HB   HIS  82          1HB       HIS  82  78.846   4.309 -16.408
  517    HD1  HIS  82           HD1      HIS  82  78.294   4.446 -20.144
  518    HD2  HIS  82           HD2      HIS  82  78.927   1.655 -17.130
  519    HE1  HIS  82           HE1      HIS  82  78.788   2.258 -21.300
  Start of MODEL   15
    1   1H    SER   1          1HT       SER   1  38.936  -5.708  -1.970
    2   2H    SER   1          2HT       SER   1  37.777  -5.394  -0.780
    3   3H    SER   1          3HT       SER   1  38.180  -4.197  -1.907
    4    HA   SER   1           HA       SER   1  37.277  -5.503  -3.691
    5   1HB   SER   1          2HB       SER   1  35.902  -7.544  -2.979
    6   2HB   SER   1          1HB       SER   1  37.655  -7.728  -2.969
    7    HG   SER   1           HG       SER   1  36.053  -8.219  -0.986
    8    H    ALA   2           H        ALA   2  35.325  -6.116  -0.773
    9    HA   ALA   2           HA       ALA   2  33.194  -4.468  -1.806
   10   1HB   ALA   2          1HB       ALA   2  32.686  -6.520  -0.575
   11   2HB   ALA   2          2HB       ALA   2  31.995  -5.111   0.225
   12   3HB   ALA   2          3HB       ALA   2  33.458  -5.855   0.865
   13    H    ARG   3           H        ARG   3  33.730  -2.367  -1.848
   14    HA   ARG   3           HA       ARG   3  34.089  -0.242  -1.156
   15   1HB   ARG   3          2HB       ARG   3  32.629  -0.668   0.749
   16   2HB   ARG   3          1HB       ARG   3  33.968  -1.369   1.645
   17   1HG   ARG   3          2HG       ARG   3  35.125   0.800   1.587
   18   2HG   ARG   3          1HG       ARG   3  33.743   1.491   0.738
   19   1HD   ARG   3          2HD       ARG   3  32.310   1.002   2.643
   20   2HD   ARG   3          1HD       ARG   3  33.668   0.252   3.483
   21    HE   ARG   3           HE       ARG   3  34.547   2.767   2.917
   22   1HH1  ARG   3          1HH1      ARG   3  31.762   1.474   4.577
   23   2HH1  ARG   3          2HH1      ARG   3  31.613   2.818   5.660
   24   1HH2  ARG   3          1HH2      ARG   3  34.377   4.559   4.352
   25   2HH2  ARG   3          2HH2      ARG   3  33.103   4.576   5.534
   26    H    THR   4           H        THR   4  35.992  -2.672   0.529
   27    HA   THR   4           HA       THR   4  38.292  -1.050   0.887
   28    HB   THR   4           HB       THR   4  39.437  -3.329   1.145
   29    HG1  THR   4           HG1      THR   4  37.184  -4.691   1.620
   30   1HG2  THR   4          1HG2      THR   4  37.055  -2.724   2.908
   31   2HG2  THR   4          2HG2      THR   4  38.645  -1.979   3.048
   32   3HG2  THR   4          3HG2      THR   4  38.452  -3.707   3.348
   33    H    CYS   5           H        CYS   5  40.307  -1.261  -0.205
   34    HA   CYS   5           HA       CYS   5  40.083  -1.174  -3.021
   35   1HB   CYS   5          2HB       CYS   5  42.362  -1.030  -1.079
   36   2HB   CYS   5          1HB       CYS   5  42.640  -1.059  -2.813
   37    HA   PRO   6           HA       PRO   6  41.016  -5.243  -4.562
   38   1HB   PRO   6          2HB       PRO   6  43.514  -4.178  -5.798
   39   2HB   PRO   6          1HB       PRO   6  42.177  -5.059  -6.547
   40   1HG   PRO   6          2HG       PRO   6  42.423  -2.455  -6.939
   41   2HG   PRO   6          1HG       PRO   6  40.820  -3.161  -6.645
   42   1HD   PRO   6          2HD       PRO   6  42.615  -1.665  -4.771
   43   2HD   PRO   6          1HD       PRO   6  40.854  -1.539  -4.980
   44    HA   PRO   7           HA       PRO   7  43.859  -7.349  -1.967
   45   1HB   PRO   7          2HB       PRO   7  44.704  -9.452  -3.451
   46   2HB   PRO   7          1HB       PRO   7  43.054  -9.314  -2.830
   47   1HG   PRO   7          2HG       PRO   7  44.115  -8.681  -5.559
   48   2HG   PRO   7          1HG       PRO   7  42.633  -9.545  -5.112
   49   1HD   PRO   7          2HD       PRO   7  42.632  -6.946  -5.859
   50   2HD   PRO   7          1HD       PRO   7  41.482  -7.597  -4.675
   51    H    ASN   8           H        ASN   8  45.097  -5.441  -4.202
   52    HA   ASN   8           HA       ASN   8  47.848  -5.994  -3.343
   53   1HB   ASN   8          2HB       ASN   8  47.519  -6.746  -5.733
   54   2HB   ASN   8          1HB       ASN   8  47.121  -5.080  -6.142
   55   1HD2  ASN   8          1HD2      ASN   8  48.831  -4.740  -7.492
   56   2HD2  ASN   8          2HD2      ASN   8  50.473  -4.700  -6.965
   57    H    GLN   9           H        GLN   9  45.477  -4.164  -2.750
   58    HA   GLN   9           HA       GLN   9  46.810  -1.586  -3.073
   59   1HB   GLN   9          2HB       GLN   9  44.705  -2.453  -4.713
   60   2HB   GLN   9          1HB       GLN   9  43.968  -1.381  -3.550
   61   1HG   GLN   9          2HG       GLN   9  44.480   0.099  -5.195
   62   2HG   GLN   9          1HG       GLN   9  45.937   0.204  -4.210
   63   1HE2  GLN   9          1HE2      GLN   9  46.919  -2.397  -5.083
   64   2HE2  GLN   9          2HE2      GLN   9  47.477  -2.177  -6.696
   65    H    PHE  10           H        PHE  10  46.327  -0.168  -1.449
   66    HA   PHE  10           HA       PHE  10  44.815  -1.268   0.813
   67   1HB   PHE  10          2HB       PHE  10  47.104  -0.947   1.415
   68   2HB   PHE  10          1HB       PHE  10  47.155   0.642   0.665
   69    HD1  PHE  10           HD1      PHE  10  45.128  -1.099   3.295
   70    HD2  PHE  10           HD2      PHE  10  47.238   2.424   2.146
   71    HE1  PHE  10           HE1      PHE  10  44.601  -0.059   5.468
   72    HE2  PHE  10           HE2      PHE  10  46.694   3.456   4.288
   73    HZ   PHE  10           HZ       PHE  10  45.387   2.237   5.964
   74    H    SER  11           H        SER  11  43.237  -0.095   1.708
   75    HA   SER  11           HA       SER  11  42.374   2.255   0.253
   76   1HB   SER  11          2HB       SER  11  40.121   1.671   1.344
   77   2HB   SER  11          1HB       SER  11  40.697   0.601   0.065
   78    HG   SER  11           HG       SER  11  40.938   0.176   2.866
   79    H    CYS  12           H        CYS  12  43.365   3.792   1.239
   80    HA   CYS  12           HA       CYS  12  43.642   4.139   4.032
   81   1HB   CYS  12          2HB       CYS  12  45.153   5.184   2.422
   82   2HB   CYS  12          1HB       CYS  12  43.817   6.066   1.701
   83    H    ALA  13           H        ALA  13  42.763   6.545   4.755
   84    HA   ALA  13           HA       ALA  13  40.177   6.712   5.369
   85   1HB   ALA  13          1HB       ALA  13  41.740   8.502   5.871
   86   2HB   ALA  13          2HB       ALA  13  40.292   9.167   5.113
   87   3HB   ALA  13          3HB       ALA  13  41.773   8.978   4.169
   88    H    SER  14           H        SER  14  38.219   6.867   4.439
   89    HA   SER  14           HA       SER  14  37.838   5.636   2.055
   90   1HB   SER  14          2HB       SER  14  35.962   7.547   3.457
   91   2HB   SER  14          1HB       SER  14  35.484   6.467   2.146
   92    HG   SER  14           HG       SER  14  36.832   5.093   4.024
   93    H    GLY  15           H        GLY  15  38.985   6.338   0.401
   94   1HA   GLY  15          2HA       GLY  15  38.009   7.952  -1.526
   95   2HA   GLY  15          1HA       GLY  15  38.898   9.071  -0.499
   96    H    ARG  16           H        ARG  16  40.950   7.144   0.255
   97    HA   ARG  16           HA       ARG  16  42.509   7.325  -2.199
   98   1HB   ARG  16          2HB       ARG  16  43.306   6.768   0.651
   99   2HB   ARG  16          1HB       ARG  16  44.429   6.657  -0.694
  100   1HG   ARG  16          2HG       ARG  16  43.835   9.061  -1.210
  101   2HG   ARG  16          1HG       ARG  16  43.032   9.093   0.362
  102   1HD   ARG  16          2HD       ARG  16  45.333   9.948   0.492
  103   2HD   ARG  16          1HD       ARG  16  45.110   8.491   1.461
  104    HE   ARG  16           HE       ARG  16  46.015   7.518  -0.891
  105   1HH1  ARG  16          1HH1      ARG  16  47.281  10.006   1.253
  106   2HH1  ARG  16          2HH1      ARG  16  48.937   9.728   0.783
  107   1HH2  ARG  16          1HH2      ARG  16  48.198   7.171  -1.473
  108   2HH2  ARG  16          2HH2      ARG  16  49.460   8.111  -0.729
  109    H    CYS  17           H        CYS  17  43.665   5.610  -3.059
  110    HA   CYS  17           HA       CYS  17  43.167   2.903  -2.131
  111   1HB   CYS  17          2HB       CYS  17  41.299   3.718  -3.769
  112   2HB   CYS  17          1HB       CYS  17  42.541   3.510  -5.003
  113    H    ILE  18           H        ILE  18  45.309   2.453  -1.923
  114    HA   ILE  18           HA       ILE  18  47.133   3.408  -4.054
  115    HB   ILE  18           HB       ILE  18  48.717   4.004  -2.410
  116   1HG1  ILE  18          2HG1      ILE  18  47.037   2.494  -0.398
  117   2HG1  ILE  18          1HG1      ILE  18  48.542   1.902  -1.099
  118   1HG2  ILE  18          1HG2      ILE  18  47.526   5.475  -0.883
  119   2HG2  ILE  18          2HG2      ILE  18  46.029   4.577  -1.147
  120   3HG2  ILE  18          3HG2      ILE  18  46.748   5.505  -2.468
  121   1HD1  ILE  18          1HD1      ILE  18  49.709   3.818  -0.090
  122   2HD1  ILE  18          2HD1      ILE  18  48.954   2.755   1.098
  123   3HD1  ILE  18          3HD1      ILE  18  48.196   4.294   0.682
  124    HA   PRO  19           HA       PRO  19  48.721  -0.835  -4.329
  125   1HB   PRO  19          2HB       PRO  19  51.371   0.499  -4.512
  126   2HB   PRO  19          1HB       PRO  19  50.634  -0.690  -5.592
  127   1HG   PRO  19          2HG       PRO  19  50.820   1.885  -6.294
  128   2HG   PRO  19          1HG       PRO  19  49.404   0.910  -6.731
  129   1HD   PRO  19          2HD       PRO  19  49.700   2.983  -4.603
  130   2HD   PRO  19          1HD       PRO  19  48.302   2.608  -5.631
  131    H    ILE  20           H        ILE  20  49.214  -2.152  -2.587
  132    HA   ILE  20           HA       ILE  20  49.914  -0.898  -0.112
  133    HB   ILE  20           HB       ILE  20  49.977  -3.851  -0.529
  134   1HG1  ILE  20          2HG1      ILE  20  47.579  -2.082  -0.054
  135   2HG1  ILE  20          1HG1      ILE  20  47.849  -3.150  -1.426
  136   1HG2  ILE  20          1HG2      ILE  20  49.341  -3.882   1.835
  137   2HG2  ILE  20          2HG2      ILE  20  49.334  -2.119   1.848
  138   3HG2  ILE  20          3HG2      ILE  20  50.841  -2.994   1.578
  139   1HD1  ILE  20          1HD1      ILE  20  47.694  -5.085   0.036
  140   2HD1  ILE  20          2HD1      ILE  20  46.242  -4.087   0.134
  141   3HD1  ILE  20          3HD1      ILE  20  47.447  -4.019   1.418
  142    H    SER  21           H        SER  21  51.915   0.005  -0.827
  143    HA   SER  21           HA       SER  21  54.053  -1.741   0.138
  144   1HB   SER  21          2HB       SER  21  54.375  -1.774  -2.276
  145   2HB   SER  21          1HB       SER  21  54.195  -0.021  -2.361
  146    HG   SER  21           HG       SER  21  56.108  -0.032  -0.870
  147    H    TRP  22           H        TRP  22  52.196   0.763   0.564
  148    HA   TRP  22           HA       TRP  22  54.277   2.785   1.035
  149   1HB   TRP  22          2HB       TRP  22  51.334   3.189   0.542
  150   2HB   TRP  22          1HB       TRP  22  52.510   4.475   0.781
  151    HD1  TRP  22           HD1      TRP  22  54.329   2.142  -1.236
  152    HE1  TRP  22           HE1      TRP  22  54.153   2.650  -3.738
  153    HE3  TRP  22           HE3      TRP  22  50.375   5.372  -1.136
  154    HZ2  TRP  22           HZ2      TRP  22  52.574   4.225  -5.459
  155    HZ3  TRP  22           HZ3      TRP  22  49.599   6.342  -3.257
  156    HH2  TRP  22           HH2      TRP  22  50.677   5.780  -5.379
  157    H    THR  23           H        THR  23  51.098   2.046   2.364
  158    HA   THR  23           HA       THR  23  51.161   3.480   4.645
  159    HB   THR  23           HB       THR  23  49.150   2.376   4.210
  160    HG1  THR  23           HG1      THR  23  49.897   2.374   6.514
  161   1HG2  THR  23          1HG2      THR  23  50.648  -0.244   4.334
  162   2HG2  THR  23          2HG2      THR  23  50.008   0.523   2.880
  163   3HG2  THR  23          3HG2      THR  23  48.906  -0.075   4.119
  164    H    CYS  24           H        CYS  24  52.727   0.417   4.198
  165    HA   CYS  24           HA       CYS  24  53.681   0.411   6.914
  166   1HB   CYS  24          2HB       CYS  24  52.529  -1.583   5.915
  167   2HB   CYS  24          1HB       CYS  24  53.917  -1.772   4.853
  168    H    ASP  25           H        ASP  25  54.849   2.333   4.945
  169    HA   ASP  25           HA       ASP  25  57.566   1.239   5.121
  170   1HB   ASP  25          2HB       ASP  25  58.319   2.732   3.283
  171   2HB   ASP  25          1HB       ASP  25  57.226   1.459   2.793
  172    H    LEU  26           H        LEU  26  56.257   4.592   4.827
  173    HA   LEU  26           HA       LEU  26  57.317   5.280   7.402
  174   1HB   LEU  26          2HB       LEU  26  58.886   5.947   4.954
  175   2HB   LEU  26          1HB       LEU  26  58.853   7.096   6.277
  176    HG   LEU  26           HG       LEU  26  59.779   4.229   6.492
  177   1HD1  LEU  26          1HD1      LEU  26  62.015   5.174   6.701
  178   2HD1  LEU  26          2HD1      LEU  26  61.370   6.793   6.437
  179   3HD1  LEU  26          3HD1      LEU  26  61.296   5.589   5.149
  180   1HD2  LEU  26          1HD2      LEU  26  59.869   6.492   8.492
  181   2HD2  LEU  26          2HD2      LEU  26  60.587   4.896   8.708
  182   3HD2  LEU  26          3HD2      LEU  26  58.838   5.062   8.577
  183    H    ASP  27           H        ASP  27  55.530   6.184   4.551
  184    HA   ASP  27           HA       ASP  27  54.479   8.527   5.869
  185   1HB   ASP  27          2HB       ASP  27  56.706   9.317   5.107
  186   2HB   ASP  27          1HB       ASP  27  56.267   8.921   3.455
  187    H    ASP  28           H        ASP  28  53.103   9.846   4.348
  188    HA   ASP  28           HA       ASP  28  52.094  10.315   2.333
  189   1HB   ASP  28          2HB       ASP  28  53.269   8.659   1.018
  190   2HB   ASP  28          1HB       ASP  28  52.238   7.380   1.655
  191    H    ASP  29           H        ASP  29  50.699   7.111   3.318
  192    HA   ASP  29           HA       ASP  29  48.173   8.336   2.659
  193   1HB   ASP  29          2HB       ASP  29  47.186   6.078   2.960
  194   2HB   ASP  29          1HB       ASP  29  48.458   6.178   1.754
  195    H    CYS  30           H        CYS  30  48.048   5.982   5.215
  196    HA   CYS  30           HA       CYS  30  47.603   7.808   7.312
  197   1HB   CYS  30          2HB       CYS  30  45.164   7.690   7.485
  198   2HB   CYS  30          1HB       CYS  30  45.651   8.454   5.973
  199    H    GLY  31           H        GLY  31  47.060   4.687   5.842
  200   1HA   GLY  31          2HA       GLY  31  46.730   2.594   6.690
  201   2HA   GLY  31          1HA       GLY  31  47.736   3.139   8.026
  202    H    ASP  32           H        ASP  32  46.827   3.824   9.859
  203    HA   ASP  32           HA       ASP  32  43.928   3.388  10.233
  204   1HB   ASP  32          2HB       ASP  32  46.173   2.566  12.101
  205   2HB   ASP  32          1HB       ASP  32  44.463   2.493  12.502
  206    H    ARG  33           H        ARG  33  44.644   5.824   9.671
  207    HA   ARG  33           HA       ARG  33  44.857   8.005  10.314
  208   1HB   ARG  33          2HB       ARG  33  43.420   7.847  12.193
  209   2HB   ARG  33          1HB       ARG  33  44.554   6.832  13.078
  210   1HG   ARG  33          2HG       ARG  33  46.135   8.831  13.008
  211   2HG   ARG  33          1HG       ARG  33  44.720   9.776  12.538
  212   1HD   ARG  33          2HD       ARG  33  43.565   9.039  14.580
  213   2HD   ARG  33          1HD       ARG  33  44.999   8.127  15.049
  214    HE   ARG  33           HE       ARG  33  44.785  11.065  14.930
  215   1HH1  ARG  33          1HH1      ARG  33  46.532   8.195  15.946
  216   2HH1  ARG  33          2HH1      ARG  33  47.568   9.068  17.033
  217   1HH2  ARG  33          1HH2      ARG  33  46.145  12.189  16.366
  218   2HH2  ARG  33          2HH2      ARG  33  47.340  11.315  17.278
  219    H    SER  34           H        SER  34  46.766   5.598  11.944
  220    HA   SER  34           HA       SER  34  49.153   7.202  11.458
  221   1HB   SER  34          2HB       SER  34  48.638   5.520  13.926
  222   2HB   SER  34          1HB       SER  34  50.114   6.418  13.574
  223    HG   SER  34           HG       SER  34  48.375   8.234  13.364
  224    H    ASP  35           H        ASP  35  49.374   6.105   9.605
  225    HA   ASP  35           HA       ASP  35  49.351   3.326   9.172
  226   1HB   ASP  35          2HB       ASP  35  50.894   4.037   7.188
  227   2HB   ASP  35          1HB       ASP  35  49.220   4.577   7.238
  228    H    GLU  36           H        GLU  36  51.406   5.032  11.107
  229    HA   GLU  36           HA       GLU  36  53.802   3.441  10.553
  230   1HB   GLU  36          2HB       GLU  36  53.297   5.881  12.266
  231   2HB   GLU  36          1HB       GLU  36  54.831   5.031  12.236
  232   1HG   GLU  36          2HG       GLU  36  53.620   6.099   9.723
  233   2HG   GLU  36          1HG       GLU  36  54.544   7.140  10.806
  234    H    SER  37           H        SER  37  51.138   2.860  12.087
  235    HA   SER  37           HA       SER  37  52.372   1.139  14.031
  236   1HB   SER  37          2HB       SER  37  50.456   3.314  14.932
  237   2HB   SER  37          1HB       SER  37  51.017   1.979  15.937
  238    HG   SER  37           HG       SER  37  53.123   3.238  14.821
  239    H    ALA  38           H        ALA  38  50.308   0.177  15.358
  240    HA   ALA  38           HA       ALA  38  48.328  -0.881  15.409
  241   1HB   ALA  38          1HB       ALA  38  47.573   0.701  12.975
  242   2HB   ALA  38          2HB       ALA  38  47.350   1.226  14.642
  243   3HB   ALA  38          3HB       ALA  38  46.478  -0.182  14.039
  244    H    SER  39           H        SER  39  48.941  -0.587  11.906
  245    HA   SER  39           HA       SER  39  48.450  -3.478  11.755
  246   1HB   SER  39          2HB       SER  39  48.247  -1.349   9.609
  247   2HB   SER  39          1HB       SER  39  47.924  -3.066   9.368
  248    HG   SER  39           HG       SER  39  46.355  -1.114  10.531
  249    H    CYS  40           H        CYS  40  50.767  -0.961  10.838
  250    HA   CYS  40           HA       CYS  40  52.481  -3.025   9.696
  251   1HB   CYS  40          2HB       CYS  40  52.280  -0.894   8.462
  252   2HB   CYS  40          1HB       CYS  40  52.933  -0.040   9.857
  253    H    ALA  41           H        ALA  41  53.724  -4.098  11.047
  254    HA   ALA  41           HA       ALA  41  54.300  -3.073  13.678
  255   1HB   ALA  41          1HB       ALA  41  53.727  -5.432  13.371
  256   2HB   ALA  41          2HB       ALA  41  55.331  -5.250  14.082
  257   3HB   ALA  41          3HB       ALA  41  55.166  -5.651  12.373
  258    H    TYR  42           H        TYR  42  55.749  -2.890  10.669
  259    HA   TYR  42           HA       TYR  42  57.810  -2.392   9.861
  260   1HB   TYR  42          2HB       TYR  42  57.639  -0.710  12.353
  261   2HB   TYR  42          1HB       TYR  42  58.992  -0.576  11.231
  262    HD1  TYR  42           HD1      TYR  42  55.679   0.549  11.976
  263    HD2  TYR  42           HD2      TYR  42  58.398  -0.137   8.762
  264    HE1  TYR  42           HE1      TYR  42  54.383   2.074  10.545
  265    HE2  TYR  42           HE2      TYR  42  57.077   1.364   7.329
  266    HH   TYR  42           HH       TYR  42  55.039   3.563   8.351
  267    HA   PRO  43           HA       PRO  43  60.078  -5.357  12.641
  268   1HB   PRO  43          2HB       PRO  43  60.199  -7.154  10.364
  269   2HB   PRO  43          1HB       PRO  43  59.468  -7.421  11.947
  270   1HG   PRO  43          2HG       PRO  43  58.013  -7.171   9.664
  271   2HG   PRO  43          1HG       PRO  43  57.404  -6.698  11.260
  272   1HD   PRO  43          2HD       PRO  43  58.536  -4.975   9.079
  273   2HD   PRO  43          1HD       PRO  43  57.130  -4.688  10.131
  274    H    THR  44           H        THR  44  60.581  -4.760   9.187
  275    HA   THR  44           HA       THR  44  63.302  -3.941   9.566
  276    HB   THR  44           HB       THR  44  63.554  -6.421   9.669
  277    HG1  THR  44           HG1      THR  44  64.603  -5.151   7.346
  278   1HG2  THR  44          1HG2      THR  44  62.499  -6.387   6.833
  279   2HG2  THR  44          2HG2      THR  44  61.658  -7.048   8.237
  280   3HG2  THR  44          3HG2      THR  44  63.159  -7.784   7.678
  281    H    CYS  45           H        CYS  45  60.811  -2.965   8.432
  282    HA   CYS  45           HA       CYS  45  59.787  -2.152   6.580
  283   1HB   CYS  45          2HB       CYS  45  62.444  -2.518   5.168
  284   2HB   CYS  45          1HB       CYS  45  61.107  -1.500   4.645
  285    H    PHE  46           H        PHE  46  59.542  -2.769   4.078
  286    HA   PHE  46           HA       PHE  46  58.690  -4.284   2.647
  287   1HB   PHE  46          2HB       PHE  46  60.962  -4.606   2.041
  288   2HB   PHE  46          1HB       PHE  46  61.259  -5.645   3.435
  289    HD1  PHE  46           HD1      PHE  46  58.375  -5.728   1.134
  290    HD2  PHE  46           HD2      PHE  46  61.934  -7.650   2.430
  291    HE1  PHE  46           HE1      PHE  46  57.738  -7.709  -0.138
  292    HE2  PHE  46           HE2      PHE  46  61.332  -9.651   1.140
  293    HZ   PHE  46           HZ       PHE  46  59.228  -9.695  -0.160
  294    HA   PRO  47           HA       PRO  47  56.688  -7.681   4.704
  295   1HB   PRO  47          2HB       PRO  47  54.316  -6.632   5.292
  296   2HB   PRO  47          1HB       PRO  47  55.706  -6.341   6.348
  297   1HG   PRO  47          2HG       PRO  47  54.349  -4.500   4.470
  298   2HG   PRO  47          1HG       PRO  47  55.287  -4.130   5.924
  299   1HD   PRO  47          2HD       PRO  47  56.163  -4.099   3.168
  300   2HD   PRO  47          1HD       PRO  47  57.090  -3.662   4.621
  301    H    LEU  48           H        LEU  48  56.608  -5.939   1.928
  302    HA   LEU  48           HA       LEU  48  54.259  -7.280   0.782
  303   1HB   LEU  48          2HB       LEU  48  54.712  -4.309   0.469
  304   2HB   LEU  48          1HB       LEU  48  53.289  -5.238   0.024
  305    HG   LEU  48           HG       LEU  48  54.156  -5.144   2.869
  306   1HD1  LEU  48          1HD1      LEU  48  52.730  -3.155   3.211
  307   2HD1  LEU  48          2HD1      LEU  48  52.539  -3.011   1.464
  308   3HD1  LEU  48          3HD1      LEU  48  54.131  -2.806   2.196
  309   1HD2  LEU  48          1HD2      LEU  48  52.381  -6.683   2.253
  310   2HD2  LEU  48          2HD2      LEU  48  51.470  -5.370   1.509
  311   3HD2  LEU  48          3HD2      LEU  48  51.732  -5.381   3.254
  312    H    THR  49           H        THR  49  56.390  -4.640  -0.222
  313    HA   THR  49           HA       THR  49  57.828  -6.169  -2.125
  314    HB   THR  49           HB       THR  49  55.855  -6.092  -3.470
  315    HG1  THR  49           HG1      THR  49  56.801  -5.331  -5.207
  316   1HG2  THR  49          1HG2      THR  49  54.659  -4.030  -4.030
  317   2HG2  THR  49          2HG2      THR  49  55.715  -3.125  -2.945
  318   3HG2  THR  49          3HG2      THR  49  54.627  -4.352  -2.294
  319    H    GLN  50           H        GLN  50  59.610  -5.238  -1.154
  320    HA   GLN  50           HA       GLN  50  60.024  -2.399  -1.424
  321   1HB   GLN  50          2HB       GLN  50  59.258  -3.662   1.155
  322   2HB   GLN  50          1HB       GLN  50  60.526  -2.452   1.190
  323   1HG   GLN  50          2HG       GLN  50  58.972  -0.852   0.115
  324   2HG   GLN  50          1HG       GLN  50  57.703  -2.074   0.225
  325   1HE2  GLN  50          1HE2      GLN  50  56.509  -0.618   1.554
  326   2HE2  GLN  50          2HE2      GLN  50  56.919  -0.413   3.221
  327    H    PHE  51           H        PHE  51  62.017  -1.686  -0.586
  328    HA   PHE  51           HA       PHE  51  64.056  -3.727   0.038
  329   1HB   PHE  51          2HB       PHE  51  64.555  -2.742  -2.125
  330   2HB   PHE  51          1HB       PHE  51  64.273  -1.128  -1.518
  331    HD1  PHE  51           HD1      PHE  51  66.711  -3.585  -2.255
  332    HD2  PHE  51           HD2      PHE  51  65.960  -0.252   0.273
  333    HE1  PHE  51           HE1      PHE  51  69.112  -3.309  -1.920
  334    HE2  PHE  51           HE2      PHE  51  68.377   0.010   0.627
  335    HZ   PHE  51           HZ       PHE  51  69.958  -1.515  -0.466
  336    H    THR  52           H        THR  52  65.574  -2.978   1.704
  337    HA   THR  52           HA       THR  52  64.317  -1.000   3.457
  338    HB   THR  52           HB       THR  52  66.425  -3.052   4.155
  339    HG1  THR  52           HG1      THR  52  64.076  -3.643   5.250
  340   1HG2  THR  52          1HG2      THR  52  65.728  -2.605   6.476
  341   2HG2  THR  52          2HG2      THR  52  64.610  -1.369   5.896
  342   3HG2  THR  52          3HG2      THR  52  66.347  -1.152   5.694
  343    H    CYS  53           H        CYS  53  65.115   0.850   2.584
  344    HA   CYS  53           HA       CYS  53  67.648   1.296   1.567
  345   1HB   CYS  53          2HB       CYS  53  65.630   2.767   1.400
  346   2HB   CYS  53          1HB       CYS  53  65.990   3.335   3.024
  347    H    ASN  54           H        ASN  54  69.579   1.806   2.351
  348    HA   ASN  54           HA       ASN  54  70.195   1.006   4.989
  349   1HB   ASN  54          2HB       ASN  54  71.862   2.414   2.896
  350   2HB   ASN  54          1HB       ASN  54  72.504   1.781   4.409
  351   1HD2  ASN  54          1HD2      ASN  54  71.051   0.952   1.335
  352   2HD2  ASN  54          2HD2      ASN  54  71.567  -0.703   1.343
  353    H    ASN  55           H        ASN  55  69.683   4.136   3.507
  354    HA   ASN  55           HA       ASN  55  70.658   5.543   5.808
  355   1HB   ASN  55          2HB       ASN  55  70.919   6.353   3.442
  356   2HB   ASN  55          1HB       ASN  55  69.190   6.677   3.432
  357   1HD2  ASN  55          1HD2      ASN  55  69.788   8.852   2.971
  358   2HD2  ASN  55          2HD2      ASN  55  70.265   9.915   4.243
  359    H    GLY  56           H        GLY  56  68.267   3.708   6.007
  360   1HA   GLY  56          2HA       GLY  56  66.973   3.869   7.985
  361   2HA   GLY  56          1HA       GLY  56  66.924   5.608   7.781
  362    H    ARG  57           H        ARG  57  66.241   4.584   4.787
  363    HA   ARG  57           HA       ARG  57  63.402   4.980   5.283
  364   1HB   ARG  57          2HB       ARG  57  64.645   4.591   2.583
  365   2HB   ARG  57          1HB       ARG  57  63.182   5.469   3.001
  366   1HG   ARG  57          2HG       ARG  57  64.343   7.324   3.715
  367   2HG   ARG  57          1HG       ARG  57  65.833   6.409   3.994
  368   1HD   ARG  57          2HD       ARG  57  65.892   5.979   1.527
  369   2HD   ARG  57          1HD       ARG  57  64.595   7.158   1.353
  370    HE   ARG  57           HE       ARG  57  66.622   8.418   2.747
  371   1HH1  ARG  57          1HH1      ARG  57  66.153   6.956  -0.392
  372   2HH1  ARG  57          2HH1      ARG  57  67.376   7.909  -1.177
  373   1HH2  ARG  57          1HH2      ARG  57  68.244   9.701   1.705
  374   2HH2  ARG  57          2HH2      ARG  57  68.572   9.444   0.024
  375    H    CYS  58           H        CYS  58  61.790   3.609   4.316
  376    HA   CYS  58           HA       CYS  58  62.738   0.950   3.428
  377   1HB   CYS  58          2HB       CYS  58  59.887   1.708   4.143
  378   2HB   CYS  58          1HB       CYS  58  60.569   0.094   3.977
  379    H    ILE  59           H        ILE  59  62.692   0.733   1.222
  380    HA   ILE  59           HA       ILE  59  61.056   2.709  -0.219
  381    HB   ILE  59           HB       ILE  59  62.635   2.747  -2.030
  382   1HG1  ILE  59          2HG1      ILE  59  64.390   0.889  -0.422
  383   2HG1  ILE  59          1HG1      ILE  59  63.326   0.337  -1.714
  384   1HG2  ILE  59          1HG2      ILE  59  64.578   3.747  -0.881
  385   2HG2  ILE  59          2HG2      ILE  59  63.970   3.104   0.646
  386   3HG2  ILE  59          3HG2      ILE  59  63.035   4.307  -0.240
  387   1HD1  ILE  59          1HD1      ILE  59  65.591   2.297  -2.018
  388   2HD1  ILE  59          2HD1      ILE  59  64.535   1.721  -3.311
  389   3HD1  ILE  59          3HD1      ILE  59  65.616   0.595  -2.486
  390    H    ASN  60           H        ASN  60  60.556   1.952  -2.573
  391    HA   ASN  60           HA       ASN  60  59.435  -0.720  -2.386
  392   1HB   ASN  60          2HB       ASN  60  58.114   1.162  -3.361
  393   2HB   ASN  60          1HB       ASN  60  59.259   1.228  -4.696
  394   1HD2  ASN  60          1HD2      ASN  60  56.704  -0.602  -3.193
  395   2HD2  ASN  60          2HD2      ASN  60  56.413  -1.656  -4.536
  396    H    ILE  61           H        ILE  61  59.671  -2.223  -4.320
  397    HA   ILE  61           HA       ILE  61  62.536  -2.629  -4.485
  398    HB   ILE  61           HB       ILE  61  60.930  -4.361  -3.642
  399   1HG1  ILE  61          2HG1      ILE  61  62.762  -5.094  -5.936
  400   2HG1  ILE  61          1HG1      ILE  61  63.240  -4.879  -4.256
  401   1HG2  ILE  61          1HG2      ILE  61  59.792  -5.749  -5.310
  402   2HG2  ILE  61          2HG2      ILE  61  60.305  -4.636  -6.579
  403   3HG2  ILE  61          3HG2      ILE  61  59.194  -4.086  -5.324
  404   1HD1  ILE  61          1HD1      ILE  61  61.366  -6.976  -5.289
  405   2HD1  ILE  61          2HD1      ILE  61  61.890  -6.777  -3.616
  406   3HD1  ILE  61          3HD1      ILE  61  63.058  -7.216  -4.865
  407    H    ASN  62           H        ASN  62  60.995  -0.791  -6.432
  408    HA   ASN  62           HA       ASN  62  61.636  -2.208  -8.931
  409   1HB   ASN  62          2HB       ASN  62  60.095  -0.811 -10.093
  410   2HB   ASN  62          1HB       ASN  62  59.287  -1.352  -8.631
  411   1HD2  ASN  62          1HD2      ASN  62  58.889   0.127  -6.978
  412   2HD2  ASN  62          2HD2      ASN  62  58.934   1.832  -7.262
  413    H    TRP  63           H        TRP  63  63.481  -0.592  -7.080
  414    HA   TRP  63           HA       TRP  63  64.297   1.481  -9.010
  415   1HB   TRP  63          2HB       TRP  63  64.690   1.289  -6.036
  416   2HB   TRP  63          1HB       TRP  63  65.523   2.472  -7.042
  417    HD1  TRP  63           HD1      TRP  63  62.476   2.457  -8.764
  418    HE1  TRP  63           HE1      TRP  63  60.775   4.175  -7.893
  419    HE3  TRP  63           HE3      TRP  63  64.581   3.386  -4.241
  420    HZ2  TRP  63           HZ2      TRP  63  60.381   5.730  -5.556
  421    HZ3  TRP  63           HZ3      TRP  63  63.496   5.003  -2.729
  422    HH2  TRP  63           HH2      TRP  63  61.439   6.152  -3.378
  423    H    ARG  64           H        ARG  64  64.992  -1.529  -8.530
  424    HA   ARG  64           HA       ARG  64  67.774  -1.714  -8.204
  425   1HB   ARG  64          2HB       ARG  64  66.225  -3.634  -8.082
  426   2HB   ARG  64          1HB       ARG  64  65.921  -3.489  -9.807
  427   1HG   ARG  64          2HG       ARG  64  67.474  -5.117  -9.894
  428   2HG   ARG  64          1HG       ARG  64  68.577  -3.742  -9.876
  429   1HD   ARG  64          2HD       ARG  64  69.341  -5.376  -8.289
  430   2HD   ARG  64          1HD       ARG  64  68.737  -3.970  -7.405
  431    HE   ARG  64           HE       ARG  64  66.585  -5.599  -7.505
  432   1HH1  ARG  64          1HH1      ARG  64  69.920  -6.152  -6.574
  433   2HH1  ARG  64          2HH1      ARG  64  69.506  -7.229  -5.275
  434   1HH2  ARG  64          1HH2      ARG  64  66.047  -7.062  -5.804
  435   2HH2  ARG  64          2HH2      ARG  64  67.315  -7.749  -4.847
  436    H    CYS  65           H        CYS  65  69.139  -0.422  -9.440
  437    HA   CYS  65           HA       CYS  65  68.773  -0.685 -12.342
  438   1HB   CYS  65          2HB       CYS  65  70.104   1.318 -12.655
  439   2HB   CYS  65          1HB       CYS  65  68.761   1.641 -11.567
  440    H    ASP  66           H        ASP  66  71.123  -1.124  -9.780
  441    HA   ASP  66           HA       ASP  66  72.678  -2.731 -11.680
  442   1HB   ASP  66          2HB       ASP  66  74.807  -1.807 -10.936
  443   2HB   ASP  66          1HB       ASP  66  73.780  -0.548 -11.605
  444    H    ASN  67           H        ASN  67  72.706  -1.837  -8.202
  445    HA   ASN  67           HA       ASN  67  73.660  -4.523  -7.643
  446   1HB   ASN  67          2HB       ASN  67  74.989  -2.754  -6.668
  447   2HB   ASN  67          1HB       ASN  67  73.562  -2.050  -5.915
  448   1HD2  ASN  67          1HD2      ASN  67  72.841  -2.849  -4.002
  449   2HD2  ASN  67          2HD2      ASN  67  73.638  -4.105  -3.125
  450    H    ASP  68           H        ASP  68  71.385  -2.263  -6.083
  451    HA   ASP  68           HA       ASP  68  69.422  -4.388  -5.958
  452   1HB   ASP  68          2HB       ASP  68  70.968  -4.239  -3.789
  453   2HB   ASP  68          1HB       ASP  68  69.795  -2.991  -3.367
  454    H    ASN  69           H        ASN  69  68.428  -2.128  -3.709
  455    HA   ASN  69           HA       ASN  69  67.073  -0.737  -5.910
  456   1HB   ASN  69          2HB       ASN  69  66.087  -1.507  -3.201
  457   2HB   ASN  69          1HB       ASN  69  65.294  -0.242  -4.141
  458   1HD2  ASN  69          1HD2      ASN  69  66.068  -3.646  -3.973
  459   2HD2  ASN  69          2HD2      ASN  69  64.943  -4.138  -5.191
  460    H    ASP  70           H        ASP  70  66.691   1.387  -5.911
  461    HA   ASP  70           HA       ASP  70  69.071   2.751  -5.223
  462   1HB   ASP  70          2HB       ASP  70  67.456   2.900  -7.303
  463   2HB   ASP  70          1HB       ASP  70  66.716   4.181  -6.348
  464    H    CYS  71           H        CYS  71  69.367   4.666  -4.139
  465    HA   CYS  71           HA       CYS  71  67.223   5.746  -2.498
  466   1HB   CYS  71          2HB       CYS  71  69.668   4.390  -1.413
  467   2HB   CYS  71          1HB       CYS  71  68.888   5.684  -0.510
  468    H    GLY  72           H        GLY  72  70.634   5.885  -3.406
  469   1HA   GLY  72          2HA       GLY  72  71.640   7.914  -4.218
  470   2HA   GLY  72          1HA       GLY  72  70.503   8.824  -3.228
  471    H    ASP  73           H        ASP  73  71.867   6.019  -1.835
  472    HA   ASP  73           HA       ASP  73  73.887   7.554  -0.377
  473   1HB   ASP  73          2HB       ASP  73  73.015   6.371   1.754
  474   2HB   ASP  73          1HB       ASP  73  72.148   7.788   1.169
  475    H    ASN  74           H        ASN  74  73.741   5.341  -2.395
  476    HA   ASN  74           HA       ASN  74  75.311   3.787  -2.983
  477   1HB   ASN  74          2HB       ASN  74  76.199   3.862  -0.088
  478   2HB   ASN  74          1HB       ASN  74  76.983   2.927  -1.355
  479   1HD2  ASN  74          1HD2      ASN  74  76.458   6.061  -0.016
  480   2HD2  ASN  74          2HD2      ASN  74  77.647   6.894  -0.955
  481    H    SER  75           H        SER  75  72.588   3.346  -1.866
  482    HA   SER  75           HA       SER  75  72.642   0.747  -0.668
  483   1HB   SER  75          2HB       SER  75  70.484   2.421  -1.906
  484   2HB   SER  75          1HB       SER  75  70.175   0.799  -1.294
  485    HG   SER  75           HG       SER  75  70.912   3.138   0.128
  486    H    ASP  76           H        ASP  76  71.121   1.697  -3.670
  487    HA   ASP  76           HA       ASP  76  71.855  -0.811  -4.958
  488   1HB   ASP  76          2HB       ASP  76  69.606   0.047  -5.323
  489   2HB   ASP  76          1HB       ASP  76  70.252   1.582  -5.901
  490    H    GLU  77           H        GLU  77  72.389   2.586  -5.011
  491    HA   GLU  77           HA       GLU  77  73.580   2.924  -7.527
  492   1HB   GLU  77          2HB       GLU  77  74.101   4.820  -5.268
  493   2HB   GLU  77          1HB       GLU  77  73.784   5.168  -6.958
  494   1HG   GLU  77          2HG       GLU  77  71.895   5.904  -5.775
  495   2HG   GLU  77          1HG       GLU  77  71.421   4.397  -6.557
  496    H    ALA  78           H        ALA  78  74.836   1.173  -5.249
  497    HA   ALA  78           HA       ALA  78  77.372   1.885  -4.580
  498   1HB   ALA  78          1HB       ALA  78  77.971  -0.454  -4.640
  499   2HB   ALA  78          2HB       ALA  78  76.602  -0.805  -5.698
  500   3HB   ALA  78          3HB       ALA  78  76.321  -0.273  -4.038
  501    H    GLY  79           H        GLY  79  76.337   0.796  -7.828
  502   1HA   GLY  79          2HA       GLY  79  78.599   2.275  -8.923
  503   2HA   GLY  79          1HA       GLY  79  78.606   0.549  -9.241
  504    H    CYS  80           H        CYS  80  75.822   2.734  -9.123
  505    HA   CYS  80           HA       CYS  80  74.757   1.539 -11.478
  506   1HB   CYS  80          2HB       CYS  80  73.407   2.430  -9.537
  507   2HB   CYS  80          1HB       CYS  80  73.748   4.048 -10.139
  508    H    SER  81           H        SER  81  75.687   4.961 -10.839
  509    HA   SER  81           HA       SER  81  76.649   5.210 -13.549
  510   1HB   SER  81          2HB       SER  81  74.231   6.790 -12.644
  511   2HB   SER  81          1HB       SER  81  75.136   7.093 -14.129
  512    HG   SER  81           HG       SER  81  74.455   4.484 -13.940
  513    H    HIS  82           HN       HIS  82  77.381   7.514 -13.986
  514    HA   HIS  82           HA       HIS  82  78.032   9.078 -11.624
  515   1HB   HIS  82          2HB       HIS  82  79.905   7.493 -11.771
  516   2HB   HIS  82          1HB       HIS  82  80.155   7.923 -13.457
  517    HD1  HIS  82           HD1      HIS  82  80.928  10.516 -13.842
  518    HD2  HIS  82           HD2      HIS  82  81.308   8.988  -9.996
  519    HE1  HIS  82           HE1      HIS  82  82.540  12.041 -12.629