*HEADER    NEUROPEPTIDE                            20-FEB-06   2DEZ              
*TITLE     STRUCTURE OF HUMAN PYY                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PEPTIDE YY;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PEPTIDE YY;                                                
*COMPND   5 SYNONYM: POLYPEPTIDE YY, PYY, PYY-I, PEPTIDE TYROSINE                
*COMPND   6 TYROSINE;                                                            
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMANS.;            
*SOURCE   4 THIS PROTEIN SYNTHESIZED BY SOLID STATE PEPTIDE SYNTHESIS.           
*KEYWDS    PP-FOLD, HELIX, PEPTIDE, NEUROPEPTIDE                                 
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    R.NYGAARD                                                             
*REVDAT   1   18-JUL-06 2DEZ    0                                                

ASSIGN (RESID   2 AND NAME HA   ) (RESID   3 AND NAME HN   )  2.4 0.6 0.8
ASSIGN (RESID   2 AND NAME HB#  ) (RESID  27 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID   2 AND NAME HB#  ) (RESID  27 AND NAME HE#  )  4.0 2.2 0.3
ASSIGN (RESID   2 AND NAME HG#  ) (RESID  27 AND NAME HD#  )  4.0 2.2 0.3
ASSIGN (RESID   2 AND NAME HG#  ) (RESID  27 AND NAME HE#  )  4.0 2.2 0.7
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HB   )  3.0 1.2 0.7
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HG1# )  4.0 2.2 0.6
ASSIGN (RESID   3 AND NAME HN   ) (RESID   4 AND NAME HN   )  3.0 1.2 0.6
ASSIGN (RESID   3 AND NAME HA   ) (RESID   4 AND NAME HN   )  3.0 1.2 0.5
ASSIGN (RESID   3 AND NAME HG2# ) (RESID   4 AND NAME HN   )  3.0 1.2 0.5
ASSIGN (RESID   3 AND NAME HG2# ) (RESID  27 AND NAME HE#  )  4.0 2.2 1.5
ASSIGN (RESID   3 AND NAME HG1# ) (RESID   4 AND NAME HB#  )  4.0 2.2 0.1
ASSIGN (RESID   4 AND NAME HN   ) (RESID  27 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID   4 AND NAME HA   ) (RESID  27 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID   4 AND NAME HA   ) (RESID  27 AND NAME HE#  )  4.0 2.2 0.6
ASSIGN (RESID   4 AND NAME HG#  ) (RESID  27 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID   5 AND NAME HA   ) (RESID   6 AND NAME HN   )  2.4 0.6 0.6
ASSIGN (RESID   5 AND NAME HB#  ) (RESID  20 AND NAME HD#  )  4.0 2.2 0.4
ASSIGN (RESID   5 AND NAME HB#  ) (RESID  20 AND NAME HE#  )  4.0 2.2 0.1
ASSIGN (RESID   5 AND NAME HG#  ) (RESID  20 AND NAME HE#  )  4.0 2.2 0.6
ASSIGN (RESID   5 AND NAME HG#  ) (RESID  24 AND NAME HA   )  4.0 2.2 0.7
ASSIGN (RESID   5 AND NAME HD#  ) (RESID  27 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID   6 AND NAME HN   ) (RESID   6 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID   7 AND NAME HN   ) (RESID  20 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID   7 AND NAME HA   ) (RESID  20 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID   7 AND NAME HB#  ) (RESID  20 AND NAME HE#  )  4.0 2.2 0.2
ASSIGN (RESID   8 AND NAME HA   ) (RESID   9 AND NAME HA#  )  4.0 2.2 0.4
ASSIGN (RESID   8 AND NAME HB#  ) (RESID  12 AND NAME HB#  )  3.0 1.2 0.7
ASSIGN (RESID   8 AND NAME HB#  ) (RESID  20 AND NAME HB#  )  4.0 2.2 0.4
ASSIGN (RESID   8 AND NAME HD#  ) (RESID  20 AND NAME HD#  )  4.0 2.2 0.9
ASSIGN (RESID   8 AND NAME HD#  ) (RESID  20 AND NAME HE#  )  4.0 2.2 0.7
ASSIGN (RESID   9 AND NAME HN   ) (RESID  10 AND NAME HA   )  4.0 2.2 0.5
ASSIGN (RESID   9 AND NAME HN   ) (RESID  12 AND NAME HB#  )  4.0 2.2 0.7
ASSIGN (RESID   9 AND NAME HA#  ) (RESID  11 AND NAME HN   )  4.0 2.2 0.9
ASSIGN (RESID  10 AND NAME HN   ) (RESID  10 AND NAME HG#  )  4.0 2.2 0.1
ASSIGN (RESID  11 AND NAME HN   ) (RESID  12 AND NAME HN   )  3.0 1.2 0.7
ASSIGN (RESID  11 AND NAME HN   ) (RESID  12 AND NAME HB#  )  4.0 2.2 0.8
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  16 AND NAME HB#  )  4.0 2.2 0.2
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  17 AND NAME HN   )  4.0 2.2 0.2
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  17 AND NAME HB#  )  2.4 0.6 0.8
ASSIGN (RESID  12 AND NAME HB#  ) (RESID  17 AND NAME HD*  )  3.0 1.2 0.6
ASSIGN (RESID  13 AND NAME HA   ) (RESID  17 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  14 AND NAME HA   ) (RESID  17 AND NAME HN   )  4.0 2.2 0.2
ASSIGN (RESID  14 AND NAME HA   ) (RESID  17 AND NAME HB#  )  4.0 2.2 0.5
ASSIGN (RESID  14 AND NAME HA   ) (RESID  17 AND NAME HD*  )  4.0 2.2 0.5
ASSIGN (RESID  14 AND NAME HA   ) (RESID  18 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  14 AND NAME HG#  ) (RESID  15 AND NAME HB#  )  4.0 2.2 1.1
ASSIGN (RESID  15 AND NAME HN   ) (RESID  16 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  15 AND NAME HN   ) (RESID  16 AND NAME HB#  )  4.0 2.2 0.7
ASSIGN (RESID  15 AND NAME HN   ) (RESID  17 AND NAME HN   )  4.0 2.2 0.2
ASSIGN (RESID  15 AND NAME HA   ) (RESID  19 AND NAME HG#  )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HN   ) (RESID  17 AND NAME HN   )  3.0 1.2 0.5
ASSIGN (RESID  16 AND NAME HN   ) (RESID  19 AND NAME HN   )  4.0 2.2 0.2
ASSIGN (RESID  16 AND NAME HA   ) (RESID  19 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  16 AND NAME HA   ) (RESID  19 AND NAME HB#  )  4.0 2.2 0.3
ASSIGN (RESID  16 AND NAME HA   ) (RESID  20 AND NAME HN   )  4.0 2.2 0.9
ASSIGN (RESID  17 AND NAME HN   ) (RESID  17 AND NAME HD*  )  4.0 2.2 0.3
ASSIGN (RESID  17 AND NAME HA   ) (RESID  20 AND NAME HN   )  4.0 2.2 0.1
ASSIGN (RESID  17 AND NAME HA   ) (RESID  20 AND NAME HB#  )  3.0 1.2 0.9
ASSIGN (RESID  17 AND NAME HA   ) (RESID  20 AND NAME HD#  )  4.0 2.2 0.4
ASSIGN (RESID  17 AND NAME HA   ) (RESID  21 AND NAME HN   )  4.0 2.2 0.9
ASSIGN (RESID  17 AND NAME HB#  ) (RESID  20 AND NAME HB#  )  4.0 2.2 2.0
ASSIGN (RESID  17 AND NAME HB#  ) (RESID  20 AND NAME HE#  )  4.0 2.2 1.0
ASSIGN (RESID  17 AND NAME HB#  ) (RESID  21 AND NAME HE#  )  4.0 2.2 1.4
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  20 AND NAME HB#  )  4.0 2.2 2.4
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  20 AND NAME HD#  )  4.0 2.2 0.6
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  20 AND NAME HE#  )  4.0 2.2 1.5
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  21 AND NAME HB#  )  4.0 2.2 1.3
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  21 AND NAME HD#  )  4.0 2.2 1.5
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  21 AND NAME HE#  )  4.0 2.2 0.2
ASSIGN (RESID  18 AND NAME HN   ) (RESID  18 AND NAME HD#  )  4.0 2.2 0.7
ASSIGN (RESID  18 AND NAME HN   ) (RESID  19 AND NAME HN   )  3.0 1.2 0.6
ASSIGN (RESID  18 AND NAME HN   ) (RESID  19 AND NAME HA   )  4.0 2.2 1.4
ASSIGN (RESID  18 AND NAME HN   ) (RESID  20 AND NAME HN   )  4.0 2.2 0.7
ASSIGN (RESID  18 AND NAME HN   ) (RESID  21 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  18 AND NAME HA   ) (RESID  21 AND NAME HN   )  4.0 2.2 0.5
ASSIGN (RESID  18 AND NAME HA   ) (RESID  21 AND NAME HB#  )  4.0 2.2 0.3
ASSIGN (RESID  18 AND NAME HA   ) (RESID  21 AND NAME HD#  )  4.0 2.2 0.3
ASSIGN (RESID  18 AND NAME HA   ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  18 AND NAME HB#  ) (RESID  19 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  18 AND NAME HD#  ) (RESID  19 AND NAME HA   )  4.0 2.2 0.4
ASSIGN (RESID  19 AND NAME HN   ) (RESID  19 AND NAME HG#  )  4.0 2.2 0.2
ASSIGN (RESID  19 AND NAME HN   ) (RESID  20 AND NAME HN   )  3.0 1.2 0.5
ASSIGN (RESID  19 AND NAME HN   ) (RESID  20 AND NAME HB#  )  4.0 2.2 1.0
ASSIGN (RESID  19 AND NAME HA   ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  19 AND NAME HA   ) (RESID  23 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  19 AND NAME HB#  ) (RESID  20 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HN   ) (RESID  21 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 HD#  ) (RESID  21 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HD#  ) (RESID  21 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HD#  ) (RESID  21 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HE#  ) (RESID  21 AND NAME HA   )  4.0 2.2 1.0
ASSIGN (RESID  20 AND NAME HE#  ) (RESID  21 AND NAME HD#  )  4.0 2.2 0.5
ASSIGN (RESID  20 AND NAME HE#  ) (RESID  21 AND NAME HE#  )  4.0 2.2 0.1
ASSIGN (RESID  20 AND NAME HE#  ) (RESID  24 AND NAME HD*  )  4.0 2.2 0.3
ASSIGN (RESID  21 AND NAME HN   ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  21 AND NAME HN   ) (RESID  22 AND NAME HB#  )  4.0 2.2 1.1
ASSIGN (RESID  21 AND NAME HA   ) (RESID  24 AND NAME HN   )  4.0 2.2 0.8
ASSIGN (RESID  21 AND NAME HA   ) (RESID  25 AND NAME HN   )  4.0 2.2 0.9
ASSIGN (RESID  21 AND NAME HB#  ) (RESID  22 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  21 AND NAME HD#  ) (RESID  22 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  21 AND NAME HD#  ) (RESID  22 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  21 AND NAME HD#  ) (RESID  24 AND NAME HD*  )  4.0 2.2 0.4
ASSIGN (RESID  21 AND NAME HE#  ) (RESID  22 AND NAME HB#  )  4.0 2.2 1.5
ASSIGN (RESID  22 AND NAME HN   ) (RESID  23 AND NAME HN   )  3.0 1.2 0.6
ASSIGN (RESID  22 AND NAME HA   ) (RESID  25 AND NAME HN   )  4.0 2.2 0.4
ASSIGN (RESID  22 AND NAME HA   ) (RESID  26 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  22 AND NAME HB#  ) (RESID  23 AND NAME HA   )  4.0 2.2 0.8
ASSIGN (RESID  23 AND NAME HN   ) (RESID  24 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  23 AND NAME HN   ) (RESID  25 AND NAME HN   )  4.0 2.2 0.4
ASSIGN (RESID  23 AND NAME HA   ) (RESID  26 AND NAME HN   )  4.0 2.2 0.5
ASSIGN (RESID  23 AND NAME HA   ) (RESID  26 AND NAME HB#  )  4.0 2.2 0.2
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HG   )  4.0 2.2 1.5
ASSIGN (RESID  24 AND NAME HN   ) (RESID  25 AND NAME HN   )  4.0 2.2 0.1
ASSIGN (RESID  24 AND NAME HN   ) (RESID  28 AND NAME HN   )  4.0 2.2 1.2
ASSIGN (RESID  24 AND NAME HA   ) (RESID  27 AND NAME HN   )  4.0 2.2 0.4
ASSIGN (RESID  24 AND NAME HA   ) (RESID  27 AND NAME HB#  )  3.0 1.2 0.8
ASSIGN (RESID  24 AND NAME HA   ) (RESID  27 AND NAME HD#  )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HA   ) (RESID  28 AND NAME HN   )  4.0 2.2 0.6
ASSIGN (RESID  24 AND NAME HA   ) (RESID  28 AND NAME HD*  )  3.0 1.2 0.6
ASSIGN (RESID  24 AND NAME HB#  ) (RESID  25 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HB#  ) (RESID  25 AND NAME HD#  )  4.0 2.2 0.1
ASSIGN (RESID  24 AND NAME HB#  ) (RESID  28 AND NAME HD*  )  4.0 2.2 0.1
ASSIGN (RESID  24 AND NAME HG   ) (RESID  25 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  24 AND NAME HG   ) (RESID  28 AND NAME HD*  )  3.0 1.2 0.5
ASSIGN (RESID  24 AND NAME HD*  ) (RESID  25 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  24 AND NAME HD*  ) (RESID  28 AND NAME HG   )  3.0 1.2 0.4
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HG#  )  4.0 2.2 0.4
ASSIGN (RESID  25 AND NAME HN   ) (RESID  26 AND NAME HN   )  3.0 1.2 0.7
ASSIGN (RESID  25 AND NAME HA   ) (RESID  28 AND NAME HN   )  4.0 2.2 0.6
ASSIGN (RESID  25 AND NAME HA   ) (RESID  28 AND NAME HB#  )  4.0 2.2 0.2
ASSIGN (RESID  25 AND NAME HA   ) (RESID  29 AND NAME HN   )  4.0 2.2 1.0
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 HA   )  4.0 2.2 1.2
ASSIGN (RESID  26 AND NAME HN   ) (RESID  28 AND NAME HN   )  4.0 2.2 0.7
ASSIGN (RESID  26 AND NAME HN   ) (RESID  29 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HA   ) (RESID  29 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  26 AND NAME HA   ) (RESID  30 AND NAME HN   )  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  27 AND NAME HN   ) (RESID  28 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  27 AND NAME HA   ) (RESID  30 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  27 AND NAME HB#  ) (RESID  28 AND NAME HD*  )  4.0 2.2 0.3
ASSIGN (RESID  27 AND NAME HD#  ) (RESID  28 AND NAME HN   )  4.0 2.2 0.3
ASSIGN (RESID  27 AND NAME HD#  ) (RESID  28 AND NAME HA   )  4.0 2.2 0.6
ASSIGN (RESID  27 AND NAME HD#  ) (RESID  28 AND NAME HD*  )  3.0 1.2 0.7
ASSIGN (RESID  27 AND NAME HD#  ) (RESID  31 AND NAME HG1# )  4.0 2.2 1.5
ASSIGN (RESID  27 AND NAME HD#  ) (RESID  31 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  27 AND NAME HD#  ) (RESID  31 AND NAME HG*  )  4.0 2.2 0.6
ASSIGN (RESID  27 AND NAME HE#  ) (RESID  28 AND NAME HD*  )  3.0 1.2 0.9
ASSIGN (RESID  27 AND NAME HE#  ) (RESID  31 AND NAME HG1# )  4.0 2.2 1.5
ASSIGN (RESID  27 AND NAME HE#  ) (RESID  31 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  27 AND NAME HE#  ) (RESID  31 AND NAME HG*  )  4.0 2.2 0.3
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HG   )  4.0 2.2 0.3
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HD*  )  4.0 2.2 0.5
ASSIGN (RESID  28 AND NAME HN   ) (RESID  29 AND NAME HN   )  3.0 1.2 0.8
ASSIGN (RESID  28 AND NAME HA   ) (RESID  31 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  28 AND NAME HA   ) (RESID  31 AND NAME HG*  )  4.0 2.2 1.0
ASSIGN (RESID  28 AND NAME HB#  ) (RESID  29 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HD#  )  4.0 2.2 0.8
ASSIGN (RESID  29 AND NAME HN   ) (RESID  30 AND NAME HN   )  3.0 1.2 0.7
ASSIGN (RESID  29 AND NAME HN   ) (RESID  31 AND NAME HN   )  4.0 2.2 1.1
ASSIGN (RESID  29 AND NAME HA   ) (RESID  29 AND NAME HD#  )  4.0 2.2 0.5
ASSIGN (RESID  29 AND NAME HA   ) (RESID  32 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  29 AND NAME HA   ) (RESID  32 AND NAME HG2# )  4.0 2.2 1.5
ASSIGN (RESID  30 AND NAME HN   ) (RESID  30 AND NAME HG   )  4.0 2.2 0.0
ASSIGN (RESID  30 AND NAME HN   ) (RESID  30 AND NAME HD*  )  4.0 2.2 0.5
ASSIGN (RESID  30 AND NAME HN   ) (RESID  31 AND NAME HN   )  3.0 1.2 0.7
ASSIGN (RESID  30 AND NAME HA   ) (RESID  33 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  30 AND NAME HB#  ) (RESID  31 AND NAME HN   )  4.0 2.2 0.7
ASSIGN (RESID  31 AND NAME HN   ) (RESID  31 AND NAME HB   )  3.0 1.2 0.8
ASSIGN (RESID  31 AND NAME HN   ) (RESID  32 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  31 AND NAME HB   ) (RESID  32 AND NAME HN   )  4.0 2.2 1.0
ASSIGN (RESID  31 AND NAME HG1# ) (RESID  32 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  31 AND NAME HG2# ) (RESID  32 AND NAME HN   )  4.0 2.2 1.5
ASSIGN (RESID  31 AND NAME HG*  ) (RESID  32 AND NAME HN   )  4.0 2.2 0.6
ASSIGN (RESID  31 AND NAME HG*  ) (RESID  32 AND NAME HG2# )  4.0 2.2 0.6
ASSIGN (RESID  32 AND NAME HN   ) (RESID  32 AND NAME HB   )  4.0 2.2 0.0
ASSIGN (RESID  32 AND NAME HN   ) (RESID  33 AND NAME HN   )  3.0 1.2 0.9
ASSIGN (RESID  32 AND NAME HG2# ) (RESID  33 AND NAME HN   )  4.0 2.2 0.8
ASSIGN (RESID  33 AND NAME HN   ) (RESID  34 AND NAME HN   )  4.0 2.2 0.8
ASSIGN (RESID  33 AND NAME HB#  ) (RESID  35 AND NAME HB#  )  4.0 2.2 0.0
ASSIGN (RESID  33 AND NAME HD#  ) (RESID  35 AND NAME HB#  )  4.0 2.2 0.2
ASSIGN (RESID  34 AND NAME HB#  ) (RESID  35 AND NAME HA   )  4.0 2.2 0.7
ASSIGN (RESID  35 AND NAME HN   ) (RESID  35 AND NAME HG#  )  4.0 2.2 1.5
ASSIGN (RESID  35 AND NAME HA   ) (RESID  35 AND NAME HD#  )  4.0 2.2 1.4
ASSIGN (RESID  35 AND NAME HB#  ) (RESID  35 AND NAME HE   )  4.0 2.2 1.2
assign (resid  34 and name HN   ) (resid  31 and name HA   )  4.0 2.2 1.0
assign (resid  30 and name HD#  ) (resid  33 and name HB#  )  4.0 2.0 0.8
assign (resid  21 and name HE#  ) (resid  24 and name HD*  )  4.0 2.2 1.0
assign (resid  27 and name HE#  ) (resid   4 and name HB#  )  4.0 2.2 1.0
assign (resid  27 and name HD#  ) (resid   3 and name HG2# )  4.0 2.2 1.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    TYR   1          HT1       TYR   1  24.592  10.357   3.078
    2   2H    TYR   1          HT2       TYR   1  25.247   8.883   3.591
    3   3H    TYR   1          HT3       TYR   1  23.789   9.438   4.254
    4    HA   TYR   1           HA       TYR   1  23.128   7.821   2.750
    5   1HB   TYR   1          HB2       TYR   1  22.032  10.118   2.580
    6   2HB   TYR   1          HB1       TYR   1  23.009  10.376   1.141
    7    HD1  TYR   1           HD1      TYR   1  20.618   7.878   2.558
    8    HD2  TYR   1           HD2      TYR   1  22.099   9.851  -0.907
    9    HE1  TYR   1           HE1      TYR   1  18.881   6.786   1.202
   10    HE2  TYR   1           HE2      TYR   1  20.366   8.766  -2.271
   11    HH   TYR   1           HH       TYR   1  18.297   6.269  -0.995
   12    HA   PRO   2           HA       PRO   2  26.590   7.038  -0.094
   13   1HB   PRO   2          HB2       PRO   2  26.419   4.353  -0.016
   14   2HB   PRO   2          HB1       PRO   2  27.198   5.280   1.273
   15   1HG   PRO   2          HG2       PRO   2  24.478   4.053   1.198
   16   2HG   PRO   2          HG1       PRO   2  25.632   4.143   2.539
   17   1HD   PRO   2          HD2       PRO   2  23.460   5.817   2.227
   18   2HD   PRO   2          HD1       PRO   2  24.911   6.214   3.167
   19    H    ILE   3           HN       ILE   3  26.142   7.314  -2.199
   20    HA   ILE   3           HA       ILE   3  23.624   6.584  -3.294
   21    HB   ILE   3           HB       ILE   3  24.671   8.545  -4.159
   22   1HG1  ILE   3          HG12      ILE   3  25.061   7.587  -6.676
   23   2HG1  ILE   3          HG11      ILE   3  24.142   6.270  -5.951
   24   1HG2  ILE   3          HG21      ILE   3  26.839   8.757  -4.537
   25   2HG2  ILE   3          HG22      ILE   3  26.821   7.439  -5.707
   26   3HG2  ILE   3          HG23      ILE   3  27.043   7.093  -3.992
   27   1HD1  ILE   3          HD11      ILE   3  22.260   7.530  -5.722
   28   2HD1  ILE   3          HD12      ILE   3  22.957   8.277  -7.160
   29   3HD1  ILE   3          HD13      ILE   3  23.155   9.042  -5.582
   30    H    LYS   4           HN       LYS   4  26.900   5.243  -3.626
   31    HA   LYS   4           HA       LYS   4  25.673   2.743  -4.485
   32   1HB   LYS   4          HB2       LYS   4  27.762   4.246  -6.039
   33   2HB   LYS   4          HB1       LYS   4  27.573   2.509  -6.205
   34   1HG   LYS   4          HG2       LYS   4  25.433   4.558  -6.748
   35   2HG   LYS   4          HG1       LYS   4  26.414   3.743  -7.969
   36   1HD   LYS   4          HD2       LYS   4  25.389   1.687  -7.598
   37   2HD   LYS   4          HD1       LYS   4  24.807   2.158  -6.000
   38   1HE   LYS   4          HE2       LYS   4  23.820   3.731  -8.306
   39   2HE   LYS   4          HE1       LYS   4  23.232   2.075  -8.164
   40   1HZ   LYS   4          HZ1       LYS   4  22.033   2.558  -6.334
   41   2HZ   LYS   4          HZ2       LYS   4  22.089   4.140  -6.947
   42   3HZ   LYS   4          HZ3       LYS   4  23.167   3.667  -5.729
   43    HA   PRO   5           HA       PRO   5  28.948   1.859  -1.366
   44   1HB   PRO   5          HB2       PRO   5  27.440   0.090   0.024
   45   2HB   PRO   5          HB1       PRO   5  27.465   1.824   0.370
   46   1HG   PRO   5          HG2       PRO   5  25.453   0.222  -1.154
   47   2HG   PRO   5          HG1       PRO   5  25.195   1.558  -0.018
   48   1HD   PRO   5          HD2       PRO   5  25.089   1.858  -2.719
   49   2HD   PRO   5          HD1       PRO   5  25.587   3.155  -1.614
   50    H    GLU   6           HN       GLU   6  26.954  -0.869  -1.401
   51    HA   GLU   6           HA       GLU   6  28.385  -2.202  -3.559
   52   1HB   GLU   6          HB2       GLU   6  29.670  -2.790  -1.557
   53   2HB   GLU   6          HB1       GLU   6  28.203  -3.320  -0.748
   54   1HG   GLU   6          HG2       GLU   6  29.246  -5.285  -1.449
   55   2HG   GLU   6          HG1       GLU   6  27.968  -5.014  -2.632
   56    H    ALA   7           HN       ALA   7  26.139  -2.991  -0.926
   57    HA   ALA   7           HA       ALA   7  23.953  -3.555  -0.864
   58   1HB   ALA   7          HB1       ALA   7  22.513  -2.603  -2.322
   59   2HB   ALA   7          HB2       ALA   7  23.429  -3.109  -3.739
   60   3HB   ALA   7          HB3       ALA   7  23.961  -1.716  -2.799
   61    HA   PRO   8           HA       PRO   8  24.288  -7.736  -2.474
   62   1HB   PRO   8          HB2       PRO   8  22.957  -8.928  -0.479
   63   2HB   PRO   8          HB1       PRO   8  24.597  -8.313  -0.238
   64   1HG   PRO   8          HG2       PRO   8  21.987  -7.136   0.597
   65   2HG   PRO   8          HG1       PRO   8  23.536  -7.157   1.457
   66   1HD   PRO   8          HD2       PRO   8  22.531  -5.021  -0.027
   67   2HD   PRO   8          HD1       PRO   8  24.223  -5.234   0.455
   68    H    GLY   9           HN       GLY   9  22.020  -9.414  -1.777
   69   1HA   GLY   9          HA2       GLY   9  19.906  -8.120  -3.382
   70   2HA   GLY   9          HA1       GLY   9  20.276  -9.839  -3.463
   71    H    GLU  10           HN       GLU  10  19.198 -11.189  -2.163
   72    HA   GLU  10           HA       GLU  10  17.921 -10.043   0.218
   73   1HB   GLU  10          HB2       GLU  10  16.677 -11.894  -1.809
   74   2HB   GLU  10          HB1       GLU  10  16.005 -11.657  -0.202
   75   1HG   GLU  10          HG2       GLU  10  14.813 -10.026  -1.126
   76   2HG   GLU  10          HG1       GLU  10  16.304  -9.086  -1.099
   77    H    ASP  11           HN       ASP  11  19.939 -12.365  -1.084
   78    HA   ASP  11           HA       ASP  11  19.440 -14.461   0.798
   79   1HB   ASP  11          HB2       ASP  11  20.737 -15.625  -0.604
   80   2HB   ASP  11          HB1       ASP  11  20.954 -14.167  -1.559
   81    H    ALA  12           HN       ALA  12  21.712 -11.798   0.521
   82    HA   ALA  12           HA       ALA  12  23.051 -10.738   1.990
   83   1HB   ALA  12          HB1       ALA  12  20.867 -11.681   3.813
   84   2HB   ALA  12          HB2       ALA  12  21.111 -10.082   3.114
   85   3HB   ALA  12          HB3       ALA  12  22.192 -10.665   4.381
   86    H    SER  13           HN       SER  13  22.290 -12.932   4.576
   87    HA   SER  13           HA       SER  13  23.537 -14.353   5.813
   88   1HB   SER  13          HB2       SER  13  24.937 -14.671   3.169
   89   2HB   SER  13          HB1       SER  13  25.494 -15.519   4.613
   90    HG   SER  13           HG       SER  13  23.749 -16.451   3.049
   91    HA   PRO  14           HA       PRO  14  26.400 -11.834   7.838
   92   1HB   PRO  14          HB2       PRO  14  28.037 -13.669   9.062
   93   2HB   PRO  14          HB1       PRO  14  26.417 -13.239   9.620
   94   1HG   PRO  14          HG2       PRO  14  27.303 -15.574   7.979
   95   2HG   PRO  14          HG1       PRO  14  26.135 -15.520   9.313
   96   1HD   PRO  14          HD2       PRO  14  25.345 -15.617   6.746
   97   2HD   PRO  14          HD1       PRO  14  24.448 -14.683   7.964
   98    H    GLU  15           HN       GLU  15  27.563 -13.718   5.265
   99    HA   GLU  15           HA       GLU  15  30.248 -12.581   5.555
  100   1HB   GLU  15          HB2       GLU  15  29.478 -15.057   4.699
  101   2HB   GLU  15          HB1       GLU  15  29.714 -14.215   3.175
  102   1HG   GLU  15          HG2       GLU  15  31.690 -15.488   4.140
  103   2HG   GLU  15          HG1       GLU  15  31.978 -13.836   3.598
  104    H    GLU  16           HN       GLU  16  27.590 -12.691   3.199
  105    HA   GLU  16           HA       GLU  16  28.842 -10.841   1.422
  106   1HB   GLU  16          HB2       GLU  16  26.472 -12.478   1.433
  107   2HB   GLU  16          HB1       GLU  16  26.070 -10.846   0.923
  108   1HG   GLU  16          HG2       GLU  16  26.983 -12.828  -0.697
  109   2HG   GLU  16          HG1       GLU  16  27.050 -11.105  -1.057
  110    H    LEU  17           HN       LEU  17  26.322 -10.663   3.894
  111    HA   LEU  17           HA       LEU  17  25.728  -7.922   3.528
  112   1HB   LEU  17          HB2       LEU  17  24.572  -9.841   4.979
  113   2HB   LEU  17          HB1       LEU  17  25.547  -9.119   6.246
  114    HG   LEU  17           HG       LEU  17  24.487  -6.917   5.728
  115   1HD1  LEU  17          HD11      LEU  17  23.728  -8.024   3.395
  116   2HD1  LEU  17          HD12      LEU  17  22.943  -6.621   4.117
  117   3HD1  LEU  17          HD13      LEU  17  22.249  -8.228   4.332
  118   1HD2  LEU  17          HD21      LEU  17  23.147  -9.282   6.862
  119   2HD2  LEU  17          HD22      LEU  17  22.092  -7.920   6.482
  120   3HD2  LEU  17          HD23      LEU  17  23.458  -7.698   7.574
  121    H    ASN  18           HN       ASN  18  28.121  -9.652   5.444
  122    HA   ASN  18           HA       ASN  18  29.095  -7.323   6.787
  123   1HB   ASN  18          HB2       ASN  18  29.404  -9.580   7.734
  124   2HB   ASN  18          HB1       ASN  18  30.426 -10.011   6.366
  125   1HD2  ASN  18          HD21      ASN  18  32.510  -9.657   6.501
  126   2HD2  ASN  18          HD22      ASN  18  33.304  -8.737   7.738
  127    H    ARG  19           HN       ARG  19  29.827  -8.981   3.775
  128    HA   ARG  19           HA       ARG  19  32.241  -7.580   3.231
  129   1HB   ARG  19          HB2       ARG  19  30.614  -9.499   1.913
  130   2HB   ARG  19          HB1       ARG  19  30.880  -8.165   0.797
  131   1HG   ARG  19          HG2       ARG  19  33.372  -8.427   1.570
  132   2HG   ARG  19          HG1       ARG  19  32.841 -10.054   2.003
  133   1HD   ARG  19          HD2       ARG  19  32.315  -8.868  -0.707
  134   2HD   ARG  19          HD1       ARG  19  33.816  -9.715  -0.336
  135    HE   ARG  19           HE       ARG  19  31.115 -10.912  -0.311
  136   1HH1  ARG  19          HH11      ARG  19  34.596 -11.221  -0.530
  137   2HH1  ARG  19          HH12      ARG  19  34.557 -12.933  -0.826
  138   1HH2  ARG  19          HH21      ARG  19  31.033 -13.132  -0.687
  139   2HH2  ARG  19          HH22      ARG  19  32.515 -14.026  -0.935
  140    H    TYR  20           HN       TYR  20  28.929  -7.074   2.024
  141    HA   TYR  20           HA       TYR  20  29.420  -4.612   0.769
  142   1HB   TYR  20          HB2       TYR  20  27.308  -4.982   0.122
  143   2HB   TYR  20          HB1       TYR  20  27.173  -6.288   1.290
  144    HD1  TYR  20           HD1      TYR  20  26.348  -2.808   0.555
  145    HD2  TYR  20           HD2      TYR  20  26.124  -5.905   3.466
  146    HE1  TYR  20           HE1      TYR  20  24.646  -1.524   1.779
  147    HE2  TYR  20           HE2      TYR  20  24.423  -4.625   4.708
  148    HH   TYR  20           HH       TYR  20  22.601  -2.645   3.808
  149    H    TYR  21           HN       TYR  21  28.753  -5.471   4.055
  150    HA   TYR  21           HA       TYR  21  28.130  -3.051   5.235
  151   1HB   TYR  21          HB2       TYR  21  28.549  -5.575   6.099
  152   2HB   TYR  21          HB1       TYR  21  30.018  -4.806   6.683
  153    HD1  TYR  21           HD1      TYR  21  26.340  -4.745   6.858
  154    HD2  TYR  21           HD2      TYR  21  29.987  -3.381   8.545
  155    HE1  TYR  21           HE1      TYR  21  25.113  -3.925   8.807
  156    HE2  TYR  21           HE2      TYR  21  28.791  -2.554  10.509
  157    HH   TYR  21           HH       TYR  21  25.564  -3.416  11.183
  158    H    ALA  22           HN       ALA  22  31.340  -4.552   5.073
  159    HA   ALA  22           HA       ALA  22  32.622  -2.196   6.025
  160   1HB   ALA  22          HB1       ALA  22  33.548  -4.309   6.589
  161   2HB   ALA  22          HB2       ALA  22  34.712  -3.464   5.562
  162   3HB   ALA  22          HB3       ALA  22  33.714  -4.755   4.890
  163    H    SER  23           HN       SER  23  31.776  -3.392   2.888
  164    HA   SER  23           HA       SER  23  33.487  -1.679   1.390
  165   1HB   SER  23          HB2       SER  23  30.869  -3.024   0.700
  166   2HB   SER  23          HB1       SER  23  31.822  -2.095  -0.458
  167    HG   SER  23           HG       SER  23  33.038  -3.775  -0.710
  168    H    LEU  24           HN       LEU  24  30.445  -1.270   3.008
  169    HA   LEU  24           HA       LEU  24  29.785   1.253   1.838
  170   1HB   LEU  24          HB2       LEU  24  28.022  -0.135   2.760
  171   2HB   LEU  24          HB1       LEU  24  28.821  -0.175   4.319
  172    HG   LEU  24           HG       LEU  24  28.275   2.550   3.553
  173   1HD1  LEU  24          HD11      LEU  24  26.466   1.456   2.250
  174   2HD1  LEU  24          HD12      LEU  24  25.881   2.508   3.539
  175   3HD1  LEU  24          HD13      LEU  24  25.865   0.759   3.755
  176   1HD2  LEU  24          HD21      LEU  24  28.574   1.163   5.842
  177   2HD2  LEU  24          HD22      LEU  24  26.816   1.264   5.767
  178   3HD2  LEU  24          HD23      LEU  24  27.783   2.738   5.748
  179    H    ARG  25           HN       ARG  25  31.373   0.069   4.758
  180    HA   ARG  25           HA       ARG  25  31.888   2.629   5.859
  181   1HB   ARG  25          HB2       ARG  25  32.364  -0.040   6.609
  182   2HB   ARG  25          HB1       ARG  25  33.945   0.725   6.539
  183   1HG   ARG  25          HG2       ARG  25  32.449   0.759   8.728
  184   2HG   ARG  25          HG1       ARG  25  33.522   2.093   8.298
  185   1HD   ARG  25          HD2       ARG  25  31.377   2.929   6.997
  186   2HD   ARG  25          HD1       ARG  25  30.549   1.923   8.182
  187    HE   ARG  25           HE       ARG  25  31.066   3.440   9.819
  188   1HH1  ARG  25          HH11      ARG  25  32.955   4.190   6.948
  189   2HH1  ARG  25          HH12      ARG  25  33.523   5.710   7.569
  190   1HH2  ARG  25          HH21      ARG  25  31.795   5.428  10.609
  191   2HH2  ARG  25          HH22      ARG  25  32.849   6.417   9.647
  192    H    HIS  26           HN       HIS  26  33.599   0.563   3.600
  193    HA   HIS  26           HA       HIS  26  35.947   2.114   3.318
  194   1HB   HIS  26          HB2       HIS  26  35.065  -0.289   2.335
  195   2HB   HIS  26          HB1       HIS  26  34.956   0.727   0.906
  196    HD1  HIS  26           HD1      HIS  26  36.975  -1.671   1.359
  197    HD2  HIS  26           HD2      HIS  26  37.848   2.381   1.717
  198    HE1  HIS  26           HE1      HIS  26  39.457  -1.474   0.999
  199    HE2  HIS  26           HE2      HIS  26  39.938   0.998   1.060
  200    H    TYR  27           HN       TYR  27  32.938   1.958   1.447
  201    HA   TYR  27           HA       TYR  27  33.517   4.002  -0.371
  202   1HB   TYR  27          HB2       TYR  27  31.650   2.323  -0.554
  203   2HB   TYR  27          HB1       TYR  27  30.773   3.250   0.660
  204    HD1  TYR  27           HD1      TYR  27  28.915   4.084  -0.532
  205    HD2  TYR  27           HD2      TYR  27  32.816   4.500  -2.185
  206    HE1  TYR  27           HE1      TYR  27  28.012   5.534  -2.278
  207    HE2  TYR  27           HE2      TYR  27  31.914   5.952  -3.953
  208    HH   TYR  27           HH       TYR  27  29.880   7.483  -4.228
  209    H    LEU  28           HN       LEU  28  31.766   4.081   2.721
  210    HA   LEU  28           HA       LEU  28  31.124   6.835   2.590
  211   1HB   LEU  28          HB2       LEU  28  31.375   4.956   4.927
  212   2HB   LEU  28          HB1       LEU  28  30.881   6.627   5.112
  213    HG   LEU  28           HG       LEU  28  29.352   4.301   4.179
  214   1HD1  LEU  28          HD11      LEU  28  28.863   5.566   6.227
  215   2HD1  LEU  28          HD12      LEU  28  27.505   5.560   5.102
  216   3HD1  LEU  28          HD13      LEU  28  28.522   6.995   5.250
  217   1HD2  LEU  28          HD21      LEU  28  29.599   6.666   2.465
  218   2HD2  LEU  28          HD22      LEU  28  27.941   6.236   2.883
  219   3HD2  LEU  28          HD23      LEU  28  28.988   5.051   2.099
  220    H    ASN  29           HN       ASN  29  33.944   5.159   3.871
  221    HA   ASN  29           HA       ASN  29  35.081   7.403   5.177
  222   1HB   ASN  29          HB2       ASN  29  35.719   5.003   5.565
  223   2HB   ASN  29          HB1       ASN  29  36.558   5.034   4.017
  224   1HD2  ASN  29          HD21      ASN  29  36.386   7.597   6.431
  225   2HD2  ASN  29          HD22      ASN  29  38.082   7.621   6.783
  226    H    LEU  30           HN       LEU  30  35.696   5.927   2.002
  227    HA   LEU  30           HA       LEU  30  37.608   7.853   1.198
  228   1HB   LEU  30          HB2       LEU  30  36.016   5.748  -0.206
  229   2HB   LEU  30          HB1       LEU  30  36.909   6.924  -1.150
  230    HG   LEU  30           HG       LEU  30  38.174   5.169   0.954
  231   1HD1  LEU  30          HD11      LEU  30  38.100   3.484  -0.485
  232   2HD1  LEU  30          HD12      LEU  30  39.033   4.451  -1.627
  233   3HD1  LEU  30          HD13      LEU  30  37.271   4.493  -1.672
  234   1HD2  LEU  30          HD21      LEU  30  39.403   7.210   0.514
  235   2HD2  LEU  30          HD22      LEU  30  39.329   6.910  -1.222
  236   3HD2  LEU  30          HD23      LEU  30  40.257   5.832  -0.179
  237    H    VAL  31           HN       VAL  31  34.119   7.727   0.999
  238    HA   VAL  31           HA       VAL  31  33.819   9.815  -0.898
  239    HB   VAL  31           HB       VAL  31  32.088   8.046   0.310
  240   1HG1  VAL  31          HG11      VAL  31  30.681  10.506   1.001
  241   2HG1  VAL  31          HG12      VAL  31  32.040  10.147   2.067
  242   3HG1  VAL  31          HG13      VAL  31  30.753   8.960   1.848
  243   1HG2  VAL  31          HG21      VAL  31  32.074   9.272  -1.948
  244   2HG2  VAL  31          HG22      VAL  31  31.086  10.478  -1.122
  245   3HG2  VAL  31          HG23      VAL  31  30.528   8.809  -1.237
  246    H    THR  32           HN       THR  32  34.554   9.777   2.471
  247    HA   THR  32           HA       THR  32  34.123  12.674   2.636
  248    HB   THR  32           HB       THR  32  35.050  11.062   4.983
  249    HG1  THR  32           HG1      THR  32  33.243   9.895   4.110
  250   1HG2  THR  32          HG21      THR  32  34.398  12.855   6.178
  251   2HG2  THR  32          HG22      THR  32  32.910  13.050   5.252
  252   3HG2  THR  32          HG23      THR  32  34.428  13.697   4.628
  253    H    ARG  33           HN       ARG  33  36.388  10.789   1.467
  254    HA   ARG  33           HA       ARG  33  38.539  12.615   2.177
  255   1HB   ARG  33          HB2       ARG  33  38.447  10.364   3.616
  256   2HB   ARG  33          HB1       ARG  33  39.264   9.726   2.196
  257   1HG   ARG  33          HG2       ARG  33  41.141  10.411   3.170
  258   2HG   ARG  33          HG1       ARG  33  40.651  12.041   2.701
  259   1HD   ARG  33          HD2       ARG  33  40.181  10.667   5.340
  260   2HD   ARG  33          HD1       ARG  33  41.194  12.075   5.027
  261    HE   ARG  33           HE       ARG  33  38.368  12.376   4.402
  262   1HH1  ARG  33          HH11      ARG  33  40.918  12.857   6.756
  263   2HH1  ARG  33          HH12      ARG  33  40.057  14.090   7.628
  264   1HH2  ARG  33          HH21      ARG  33  37.233  13.984   5.540
  265   2HH2  ARG  33          HH22      ARG  33  37.965  14.751   6.919
  266    H    GLN  34           HN       GLN  34  37.610  13.012  -0.093
  267    HA   GLN  34           HA       GLN  34  38.383  11.227  -2.193
  268   1HB   GLN  34          HB2       GLN  34  36.847  13.632  -1.921
  269   2HB   GLN  34          HB1       GLN  34  38.029  13.852  -3.207
  270   1HG   GLN  34          HG2       GLN  34  37.086  11.403  -3.820
  271   2HG   GLN  34          HG1       GLN  34  35.655  12.127  -3.089
  272   1HE2  GLN  34          HE21      GLN  34  38.258  13.219  -5.261
  273   2HE2  GLN  34          HE22      GLN  34  37.204  13.925  -6.433
  274    H    ARG  35           HN       ARG  35  40.631  11.424  -0.831
  275    HA   ARG  35           HA       ARG  35  42.298  13.535  -1.985
  276   1HB   ARG  35          HB2       ARG  35  42.541  13.294   0.395
  277   2HB   ARG  35          HB1       ARG  35  42.766  11.558   0.251
  278   1HG   ARG  35          HG2       ARG  35  44.947  11.983   0.360
  279   2HG   ARG  35          HG1       ARG  35  44.803  12.572  -1.297
  280   1HD   ARG  35          HD2       ARG  35  44.480  14.828  -0.510
  281   2HD   ARG  35          HD1       ARG  35  44.458  14.277   1.166
  282    HE   ARG  35           HE       ARG  35  46.865  13.658  -0.339
  283   1HH1  ARG  35          HH11      ARG  35  45.260  15.876   1.846
  284   2HH1  ARG  35          HH12      ARG  35  46.745  16.550   2.456
  285   1HH2  ARG  35          HH21      ARG  35  48.820  14.527   0.468
  286   2HH2  ARG  35          HH22      ARG  35  48.773  15.799   1.657
  287    H    TYR  36           HN       TYR  36  42.529  12.831  -4.068
  288    HA   TYR  36           HA       TYR  36  43.396  11.716  -5.837
  289   1HB   TYR  36          HB2       TYR  36  45.416  12.051  -3.961
  290   2HB   TYR  36          HB1       TYR  36  45.548  10.356  -4.418
  291    HD1  TYR  36           HD1      TYR  36  44.371  13.024  -6.677
  292    HD2  TYR  36           HD2      TYR  36  47.623  10.509  -5.581
  293    HE1  TYR  36           HE1      TYR  36  45.548  13.659  -8.740
  294    HE2  TYR  36           HE2      TYR  36  48.816  11.141  -7.637
  295    HH   TYR  36           HH       TYR  36  48.326  11.994  -9.862
  296   1HN   NH2  37          H1        NH2  37  41.629   8.609  -5.226
  297   2HN   NH2  37          H2        NH2  37  41.326  10.305  -5.350
  Start of MODEL    2
    1   1H    TYR   1          HT1       TYR   1  35.691   1.602 -12.879
    2   2H    TYR   1          HT2       TYR   1  34.244   1.826 -13.732
    3   3H    TYR   1          HT3       TYR   1  34.678   0.277 -13.193
    4    HA   TYR   1           HA       TYR   1  33.932   2.598 -11.520
    5   1HB   TYR   1          HB2       TYR   1  32.582   0.028 -12.294
    6   2HB   TYR   1          HB1       TYR   1  32.214   0.777 -10.746
    7    HD1  TYR   1           HD1      TYR   1  32.621   3.671 -11.980
    8    HD2  TYR   1           HD2      TYR   1  30.281   0.276 -13.034
    9    HE1  TYR   1           HE1      TYR   1  30.990   5.146 -13.087
   10    HE2  TYR   1           HE2      TYR   1  28.651   1.733 -14.151
   11    HH   TYR   1           HH       TYR   1  28.820   4.153 -15.270
   12    HA   PRO   2           HA       PRO   2  36.269   0.502  -8.331
   13   1HB   PRO   2          HB2       PRO   2  35.305   1.816  -6.183
   14   2HB   PRO   2          HB1       PRO   2  36.412   2.581  -7.329
   15   1HG   PRO   2          HG2       PRO   2  33.447   2.843  -7.091
   16   2HG   PRO   2          HG1       PRO   2  34.657   4.090  -7.435
   17   1HD   PRO   2          HD2       PRO   2  33.106   2.878  -9.352
   18   2HD   PRO   2          HD1       PRO   2  34.692   3.605  -9.670
   19    H    ILE   3           HN       ILE   3  35.293   0.043  -5.764
   20    HA   ILE   3           HA       ILE   3  33.853  -2.322  -6.030
   21    HB   ILE   3           HB       ILE   3  34.786  -2.413  -3.984
   22   1HG1  ILE   3          HG12      ILE   3  33.146  -1.205  -2.198
   23   2HG1  ILE   3          HG11      ILE   3  32.085  -1.253  -3.606
   24   1HG2  ILE   3          HG21      ILE   3  36.045  -0.608  -3.608
   25   2HG2  ILE   3          HG22      ILE   3  34.710  -0.064  -2.590
   26   3HG2  ILE   3          HG23      ILE   3  34.833   0.494  -4.260
   27   1HD1  ILE   3          HD11      ILE   3  32.572  -3.294  -1.763
   28   2HD1  ILE   3          HD12      ILE   3  33.387  -3.792  -3.247
   29   3HD1  ILE   3          HD13      ILE   3  31.666  -3.403  -3.272
   30    H    LYS   4           HN       LYS   4  32.733   0.894  -5.087
   31    HA   LYS   4           HA       LYS   4  30.658   1.636  -4.443
   32   1HB   LYS   4          HB2       LYS   4  29.063   1.464  -6.498
   33   2HB   LYS   4          HB1       LYS   4  30.515   2.446  -6.574
   34   1HG   LYS   4          HG2       LYS   4  31.122   1.360  -8.393
   35   2HG   LYS   4          HG1       LYS   4  31.228  -0.130  -7.452
   36   1HD   LYS   4          HD2       LYS   4  28.525   0.137  -7.871
   37   2HD   LYS   4          HD1       LYS   4  29.214   0.737  -9.381
   38   1HE   LYS   4          HE2       LYS   4  28.956  -1.546  -9.761
   39   2HE   LYS   4          HE1       LYS   4  30.657  -1.378  -9.333
   40   1HZ   LYS   4          HZ1       LYS   4  30.178  -2.135  -7.117
   41   2HZ   LYS   4          HZ2       LYS   4  29.557  -3.262  -8.225
   42   3HZ   LYS   4          HZ3       LYS   4  28.510  -2.186  -7.438
   43    HA   PRO   5           HA       PRO   5  28.854  -2.360  -3.181
   44   1HB   PRO   5          HB2       PRO   5  28.267  -1.647  -0.643
   45   2HB   PRO   5          HB1       PRO   5  29.888  -2.148  -1.138
   46   1HG   PRO   5          HG2       PRO   5  28.798   0.603  -0.716
   47   2HG   PRO   5          HG1       PRO   5  30.375  -0.059  -0.250
   48   1HD   PRO   5          HD2       PRO   5  30.002   1.497  -2.455
   49   2HD   PRO   5          HD1       PRO   5  31.270   0.266  -2.335
   50    H    GLU   6           HN       GLU   6  26.962  -2.452  -4.268
   51    HA   GLU   6           HA       GLU   6  24.751  -0.711  -3.590
   52   1HB   GLU   6          HB2       GLU   6  24.691  -3.237  -5.253
   53   2HB   GLU   6          HB1       GLU   6  23.504  -1.941  -5.242
   54   1HG   GLU   6          HG2       GLU   6  24.600  -0.823  -6.805
   55   2HG   GLU   6          HG1       GLU   6  26.109  -0.914  -5.895
   56    H    ALA   7           HN       ALA   7  22.574  -2.166  -3.301
   57    HA   ALA   7           HA       ALA   7  22.785  -3.283  -0.715
   58   1HB   ALA   7          HB1       ALA   7  20.421  -4.234  -1.954
   59   2HB   ALA   7          HB2       ALA   7  20.700  -2.581  -2.503
   60   3HB   ALA   7          HB3       ALA   7  20.606  -2.933  -0.778
   61    HA   PRO   8           HA       PRO   8  24.232  -7.294  -1.562
   62   1HB   PRO   8          HB2       PRO   8  23.303  -8.674   0.567
   63   2HB   PRO   8          HB1       PRO   8  24.558  -7.438   0.704
   64   1HG   PRO   8          HG2       PRO   8  21.626  -7.230   1.268
   65   2HG   PRO   8          HG1       PRO   8  22.991  -6.605   2.210
   66   1HD   PRO   8          HD2       PRO   8  21.518  -5.056   0.537
   67   2HD   PRO   8          HD1       PRO   8  23.236  -4.758   0.863
   68    H    GLY   9           HN       GLY   9  21.216  -6.610  -2.331
   69   1HA   GLY   9          HA2       GLY   9  19.774  -7.736  -3.751
   70   2HA   GLY   9          HA1       GLY   9  20.777  -9.171  -3.570
   71    H    GLU  10           HN       GLU  10  20.096  -7.905  -0.617
   72    HA   GLU  10           HA       GLU  10  18.862  -8.509   1.149
   73   1HB   GLU  10          HB2       GLU  10  16.854  -8.795  -1.055
   74   2HB   GLU  10          HB1       GLU  10  16.428  -9.219   0.599
   75   1HG   GLU  10          HG2       GLU  10  15.840  -7.077   0.794
   76   2HG   GLU  10          HG1       GLU  10  17.569  -6.772   0.937
   77    H    ASP  11           HN       ASP  11  20.180 -10.635  -0.781
   78    HA   ASP  11           HA       ASP  11  19.026 -12.991   0.563
   79   1HB   ASP  11          HB2       ASP  11  18.966 -12.812  -2.019
   80   2HB   ASP  11          HB1       ASP  11  20.702 -13.109  -1.942
   81    H    ALA  12           HN       ALA  12  21.495 -10.911   0.724
   82    HA   ALA  12           HA       ALA  12  23.494 -12.915   1.507
   83   1HB   ALA  12          HB1       ALA  12  24.740 -10.429   1.404
   84   2HB   ALA  12          HB2       ALA  12  23.637 -10.435   0.026
   85   3HB   ALA  12          HB3       ALA  12  24.840 -11.714   0.198
   86    H    SER  13           HN       SER  13  23.263 -13.296   3.617
   87    HA   SER  13           HA       SER  13  22.704 -11.027   5.387
   88   1HB   SER  13          HB2       SER  13  22.425 -13.792   6.420
   89   2HB   SER  13          HB1       SER  13  21.419 -12.372   6.698
   90    HG   SER  13           HG       SER  13  21.499 -13.956   4.333
   91    HA   PRO  14           HA       PRO  14  26.190 -13.174   7.742
   92   1HB   PRO  14          HB2       PRO  14  27.493 -15.266   6.316
   93   2HB   PRO  14          HB1       PRO  14  26.413 -15.416   7.704
   94   1HG   PRO  14          HG2       PRO  14  25.847 -16.302   5.140
   95   2HG   PRO  14          HG1       PRO  14  24.641 -15.986   6.399
   96   1HD   PRO  14          HD2       PRO  14  25.489 -14.266   4.106
   97   2HD   PRO  14          HD1       PRO  14  23.869 -14.515   4.791
   98    H    GLU  15           HN       GLU  15  28.406 -14.552   5.691
   99    HA   GLU  15           HA       GLU  15  30.250 -12.464   6.125
  100   1HB   GLU  15          HB2       GLU  15  30.256 -15.112   4.908
  101   2HB   GLU  15          HB1       GLU  15  31.338 -13.991   4.090
  102   1HG   GLU  15          HG2       GLU  15  31.425 -14.125   7.056
  103   2HG   GLU  15          HG1       GLU  15  32.135 -15.447   6.129
  104    H    GLU  16           HN       GLU  16  28.123 -13.183   3.511
  105    HA   GLU  16           HA       GLU  16  29.258 -11.554   1.520
  106   1HB   GLU  16          HB2       GLU  16  26.434 -12.502   2.017
  107   2HB   GLU  16          HB1       GLU  16  26.901 -11.585   0.590
  108   1HG   GLU  16          HG2       GLU  16  26.997 -13.735  -0.187
  109   2HG   GLU  16          HG1       GLU  16  28.671 -13.457   0.285
  110    H    LEU  17           HN       LEU  17  26.838 -10.980   4.053
  111    HA   LEU  17           HA       LEU  17  26.431  -8.242   3.299
  112   1HB   LEU  17          HB2       LEU  17  24.729  -9.539   4.543
  113   2HB   LEU  17          HB1       LEU  17  25.818  -9.631   5.913
  114    HG   LEU  17           HG       LEU  17  25.591  -6.897   5.340
  115   1HD1  LEU  17          HD11      LEU  17  23.107  -6.613   5.551
  116   2HD1  LEU  17          HD12      LEU  17  22.947  -8.322   5.140
  117   3HD1  LEU  17          HD13      LEU  17  23.664  -7.199   3.983
  118   1HD2  LEU  17          HD21      LEU  17  24.733  -8.777   7.462
  119   2HD2  LEU  17          HD22      LEU  17  24.034  -7.159   7.475
  120   3HD2  LEU  17          HD23      LEU  17  25.783  -7.365   7.556
  121    H    ASN  18           HN       ASN  18  28.382 -10.007   5.616
  122    HA   ASN  18           HA       ASN  18  29.580  -7.893   6.982
  123   1HB   ASN  18          HB2       ASN  18  29.853 -10.219   7.665
  124   2HB   ASN  18          HB1       ASN  18  30.747 -10.572   6.190
  125   1HD2  ASN  18          HD21      ASN  18  32.767 -10.941   6.729
  126   2HD2  ASN  18          HD22      ASN  18  33.720  -9.968   7.801
  127    H    ARG  19           HN       ARG  19  30.495  -9.467   3.932
  128    HA   ARG  19           HA       ARG  19  32.874  -8.002   3.512
  129   1HB   ARG  19          HB2       ARG  19  31.007  -9.473   1.671
  130   2HB   ARG  19          HB1       ARG  19  32.374  -8.574   1.032
  131   1HG   ARG  19          HG2       ARG  19  32.332 -11.068   2.650
  132   2HG   ARG  19          HG1       ARG  19  33.277 -10.666   1.219
  133   1HD   ARG  19          HD2       ARG  19  34.910  -9.624   2.419
  134   2HD   ARG  19          HD1       ARG  19  33.801  -9.107   3.687
  135    HE   ARG  19           HE       ARG  19  33.837 -11.469   4.469
  136   1HH1  ARG  19          HH11      ARG  19  36.479 -10.213   2.536
  137   2HH1  ARG  19          HH12      ARG  19  37.637 -11.368   3.124
  138   1HH2  ARG  19          HH21      ARG  19  35.342 -12.978   5.263
  139   2HH2  ARG  19          HH22      ARG  19  36.986 -12.939   4.688
  140    H    TYR  20           HN       TYR  20  29.625  -7.501   2.107
  141    HA   TYR  20           HA       TYR  20  30.296  -5.088   0.807
  142   1HB   TYR  20          HB2       TYR  20  28.294  -5.481  -0.109
  143   2HB   TYR  20          HB1       TYR  20  28.022  -6.774   1.043
  144    HD1  TYR  20           HD1      TYR  20  26.842  -6.223   3.224
  145    HD2  TYR  20           HD2      TYR  20  27.022  -3.490  -0.039
  146    HE1  TYR  20           HE1      TYR  20  24.930  -4.987   4.153
  147    HE2  TYR  20           HE2      TYR  20  25.108  -2.252   0.886
  148    HH   TYR  20           HH       TYR  20  23.289  -3.458   3.617
  149    H    TYR  21           HN       TYR  21  29.346  -5.836   4.036
  150    HA   TYR  21           HA       TYR  21  28.473  -3.365   4.985
  151   1HB   TYR  21          HB2       TYR  21  28.775  -5.835   6.045
  152   2HB   TYR  21          HB1       TYR  21  30.141  -5.014   6.789
  153    HD1  TYR  21           HD1      TYR  21  29.816  -3.319   8.438
  154    HD2  TYR  21           HD2      TYR  21  26.497  -5.151   6.529
  155    HE1  TYR  21           HE1      TYR  21  28.339  -2.377  10.145
  156    HE2  TYR  21           HE2      TYR  21  24.992  -4.219   8.230
  157    HH   TYR  21           HH       TYR  21  24.826  -2.612   9.871
  158    H    ALA  22           HN       ALA  22  31.691  -4.811   5.444
  159    HA   ALA  22           HA       ALA  22  32.756  -2.402   6.506
  160   1HB   ALA  22          HB1       ALA  22  34.048  -4.961   5.614
  161   2HB   ALA  22          HB2       ALA  22  33.663  -4.445   7.260
  162   3HB   ALA  22          HB3       ALA  22  34.935  -3.625   6.349
  163    H    SER  23           HN       SER  23  32.679  -3.810   3.295
  164    HA   SER  23           HA       SER  23  34.540  -2.055   2.091
  165   1HB   SER  23          HB2       SER  23  32.126  -3.345   0.798
  166   2HB   SER  23          HB1       SER  23  33.557  -2.723  -0.026
  167    HG   SER  23           HG       SER  23  33.268  -5.019   1.576
  168    H    LEU  24           HN       LEU  24  31.094  -1.805   2.758
  169    HA   LEU  24           HA       LEU  24  30.599   0.611   1.405
  170   1HB   LEU  24          HB2       LEU  24  28.735  -0.739   2.041
  171   2HB   LEU  24          HB1       LEU  24  29.249  -0.774   3.719
  172    HG   LEU  24           HG       LEU  24  28.873   1.835   3.534
  173   1HD1  LEU  24          HD11      LEU  24  26.536   1.341   1.928
  174   2HD1  LEU  24          HD12      LEU  24  28.004   0.997   1.014
  175   3HD1  LEU  24          HD13      LEU  24  27.779   2.587   1.754
  176   1HD2  LEU  24          HD21      LEU  24  26.612   1.495   4.388
  177   2HD2  LEU  24          HD22      LEU  24  27.745   0.342   5.092
  178   3HD2  LEU  24          HD23      LEU  24  26.640  -0.172   3.817
  179    H    ARG  25           HN       ARG  25  31.545  -0.176   4.719
  180    HA   ARG  25           HA       ARG  25  31.471   2.446   5.728
  181   1HB   ARG  25          HB2       ARG  25  32.970  -0.027   6.550
  182   2HB   ARG  25          HB1       ARG  25  33.178   1.496   7.406
  183   1HG   ARG  25          HG2       ARG  25  31.160   1.374   8.395
  184   2HG   ARG  25          HG1       ARG  25  30.395   0.643   6.982
  185   1HD   ARG  25          HD2       ARG  25  30.343  -1.134   8.418
  186   2HD   ARG  25          HD1       ARG  25  31.903  -1.407   7.645
  187    HE   ARG  25           HE       ARG  25  32.261   0.217   9.922
  188   1HH1  ARG  25          HH11      ARG  25  31.484  -3.108   9.099
  189   2HH1  ARG  25          HH12      ARG  25  32.166  -3.754  10.560
  190   1HH2  ARG  25          HH21      ARG  25  33.137  -0.627  11.821
  191   2HH2  ARG  25          HH22      ARG  25  33.082  -2.338  12.112
  192    H    HIS  26           HN       HIS  26  34.078   0.592   4.215
  193    HA   HIS  26           HA       HIS  26  36.069   2.602   4.516
  194   1HB   HIS  26          HB2       HIS  26  36.118  -0.022   3.818
  195   2HB   HIS  26          HB1       HIS  26  36.302   0.727   2.238
  196    HD1  HIS  26           HD1      HIS  26  38.423  -0.836   4.335
  197    HD2  HIS  26           HD2      HIS  26  38.386   3.108   2.986
  198    HE1  HIS  26           HE1      HIS  26  40.785  -0.008   4.568
  199    HE2  HIS  26           HE2      HIS  26  40.768   2.339   3.659
  200    H    TYR  27           HN       TYR  27  34.050   1.594   1.770
  201    HA   TYR  27           HA       TYR  27  35.041   3.502  -0.038
  202   1HB   TYR  27          HB2       TYR  27  33.741   1.467  -0.676
  203   2HB   TYR  27          HB1       TYR  27  32.289   2.251  -0.062
  204    HD1  TYR  27           HD1      TYR  27  30.968   3.445  -1.542
  205    HD2  TYR  27           HD2      TYR  27  35.079   2.858  -2.478
  206    HE1  TYR  27           HE1      TYR  27  30.618   4.519  -3.726
  207    HE2  TYR  27           HE2      TYR  27  34.739   3.927  -4.664
  208    HH   TYR  27           HH       TYR  27  32.096   5.768  -5.421
  209    H    LEU  28           HN       LEU  28  32.125   3.529   2.011
  210    HA   LEU  28           HA       LEU  28  31.246   6.089   1.171
  211   1HB   LEU  28          HB2       LEU  28  30.537   4.193   3.279
  212   2HB   LEU  28          HB1       LEU  28  30.310   5.864   3.754
  213    HG   LEU  28           HG       LEU  28  28.810   6.238   1.895
  214   1HD1  LEU  28          HD11      LEU  28  29.891   4.796   0.254
  215   2HD1  LEU  28          HD12      LEU  28  28.157   4.477   0.365
  216   3HD1  LEU  28          HD13      LEU  28  29.313   3.377   1.124
  217   1HD2  LEU  28          HD21      LEU  28  27.010   5.264   2.855
  218   2HD2  LEU  28          HD22      LEU  28  28.197   4.902   4.111
  219   3HD2  LEU  28          HD23      LEU  28  27.767   3.674   2.919
  220    H    ASN  29           HN       ASN  29  33.531   5.084   3.650
  221    HA   ASN  29           HA       ASN  29  33.870   7.569   4.927
  222   1HB   ASN  29          HB2       ASN  29  34.829   5.656   5.970
  223   2HB   ASN  29          HB1       ASN  29  35.727   5.222   4.523
  224   1HD2  ASN  29          HD21      ASN  29  35.618   7.215   7.339
  225   2HD2  ASN  29          HD22      ASN  29  37.221   7.859   7.205
  226    H    LEU  30           HN       LEU  30  35.289   6.215   1.993
  227    HA   LEU  30           HA       LEU  30  36.976   8.479   1.500
  228   1HB   LEU  30          HB2       LEU  30  36.462   5.936   0.293
  229   2HB   LEU  30          HB1       LEU  30  36.343   7.179  -0.937
  230    HG   LEU  30           HG       LEU  30  38.693   7.500   0.760
  231   1HD1  LEU  30          HD11      LEU  30  38.397   4.980  -0.868
  232   2HD1  LEU  30          HD12      LEU  30  38.624   5.089   0.877
  233   3HD1  LEU  30          HD13      LEU  30  39.916   5.590  -0.213
  234   1HD2  LEU  30          HD21      LEU  30  39.531   8.364  -1.130
  235   2HD2  LEU  30          HD22      LEU  30  37.874   8.282  -1.731
  236   3HD2  LEU  30          HD23      LEU  30  39.011   6.986  -2.101
  237    H    VAL  31           HN       VAL  31  33.688   7.611   0.713
  238    HA   VAL  31           HA       VAL  31  33.293   9.596  -1.296
  239    HB   VAL  31           HB       VAL  31  31.292   8.013   0.324
  240   1HG1  VAL  31          HG11      VAL  31  30.661  10.307  -0.944
  241   2HG1  VAL  31          HG12      VAL  31  29.557   8.941  -0.775
  242   3HG1  VAL  31          HG13      VAL  31  30.475   9.151  -2.267
  243   1HG2  VAL  31          HG21      VAL  31  32.719   6.653  -1.105
  244   2HG2  VAL  31          HG22      VAL  31  32.304   7.656  -2.493
  245   3HG2  VAL  31          HG23      VAL  31  31.065   6.676  -1.711
  246    H    THR  32           HN       THR  32  33.346   9.732   2.144
  247    HA   THR  32           HA       THR  32  31.486  11.887   2.450
  248    HB   THR  32           HB       THR  32  33.340  11.825   4.633
  249    HG1  THR  32           HG1      THR  32  32.363   9.283   3.760
  250   1HG2  THR  32          HG21      THR  32  30.691  12.164   4.317
  251   2HG2  THR  32          HG22      THR  32  31.430  11.732   5.857
  252   3HG2  THR  32          HG23      THR  32  30.713  10.482   4.844
  253    H    ARG  33           HN       ARG  33  33.777  12.253   0.559
  254    HA   ARG  33           HA       ARG  33  35.107  14.589   1.677
  255   1HB   ARG  33          HB2       ARG  33  36.406  14.631  -0.328
  256   2HB   ARG  33          HB1       ARG  33  36.277  12.945   0.149
  257   1HG   ARG  33          HG2       ARG  33  34.124  13.243  -1.515
  258   2HG   ARG  33          HG1       ARG  33  35.329  14.294  -2.258
  259   1HD   ARG  33          HD2       ARG  33  36.810  12.544  -2.631
  260   2HD   ARG  33          HD1       ARG  33  36.061  11.521  -1.408
  261    HE   ARG  33           HE       ARG  33  34.103  11.844  -3.268
  262   1HH1  ARG  33          HH11      ARG  33  37.446  10.805  -3.466
  263   2HH1  ARG  33          HH12      ARG  33  37.150   9.693  -4.775
  264   1HH2  ARG  33          HH21      ARG  33  33.729  10.389  -5.010
  265   2HH2  ARG  33          HH22      ARG  33  35.060   9.479  -5.648
  266    H    GLN  34           HN       GLN  34  32.140  14.011   0.661
  267    HA   GLN  34           HA       GLN  34  30.370  15.325   0.177
  268   1HB   GLN  34          HB2       GLN  34  32.363  17.249   0.859
  269   2HB   GLN  34          HB1       GLN  34  31.446  17.852  -0.515
  270   1HG   GLN  34          HG2       GLN  34  30.685  18.302   1.964
  271   2HG   GLN  34          HG1       GLN  34  29.519  18.047   0.668
  272   1HE2  GLN  34          HE21      GLN  34  30.951  16.732   3.542
  273   2HE2  GLN  34          HE22      GLN  34  29.840  15.421   3.741
  274    H    ARG  35           HN       ARG  35  33.022  14.964  -1.876
  275    HA   ARG  35           HA       ARG  35  31.411  15.639  -4.226
  276   1HB   ARG  35          HB2       ARG  35  34.266  15.615  -3.650
  277   2HB   ARG  35          HB1       ARG  35  33.889  14.702  -5.104
  278   1HG   ARG  35          HG2       ARG  35  34.417  17.018  -5.625
  279   2HG   ARG  35          HG1       ARG  35  32.744  16.632  -6.041
  280   1HD   ARG  35          HD2       ARG  35  32.164  18.444  -4.872
  281   2HD   ARG  35          HD1       ARG  35  32.580  17.516  -3.429
  282    HE   ARG  35           HE       ARG  35  34.580  18.689  -3.257
  283   1HH1  ARG  35          HH11      ARG  35  32.804  19.654  -6.130
  284   2HH1  ARG  35          HH12      ARG  35  33.833  21.026  -6.446
  285   1HH2  ARG  35          HH21      ARG  35  35.877  20.495  -3.633
  286   2HH2  ARG  35          HH22      ARG  35  35.585  21.512  -5.018
  287    H    TYR  36           HN       TYR  36  30.411  14.059  -5.322
  288    HA   TYR  36           HA       TYR  36  30.746  11.332  -4.410
  289   1HB   TYR  36          HB2       TYR  36  28.649  12.844  -5.601
  290   2HB   TYR  36          HB1       TYR  36  29.003  11.489  -6.670
  291    HD1  TYR  36           HD1      TYR  36  28.111   9.390  -6.208
  292    HD2  TYR  36           HD2      TYR  36  28.298  12.282  -3.096
  293    HE1  TYR  36           HE1      TYR  36  26.827   7.888  -4.746
  294    HE2  TYR  36           HE2      TYR  36  27.006  10.792  -1.624
  295    HH   TYR  36           HH       TYR  36  25.246   8.243  -2.669
  296   1HN   NH2  37          H1        NH2  37  31.966  11.762  -8.305
  297   2HN   NH2  37          H2        NH2  37  30.794  12.848  -7.651
  Start of MODEL    3
    1   1H    TYR   1          HT1       TYR   1  36.067   0.561  -9.208
    2   2H    TYR   1          HT2       TYR   1  37.056   1.778  -8.557
    3   3H    TYR   1          HT3       TYR   1  36.954   1.576 -10.234
    4    HA   TYR   1           HA       TYR   1  35.634   3.444  -9.039
    5   1HB   TYR   1          HB2       TYR   1  35.346   1.974 -11.465
    6   2HB   TYR   1          HB1       TYR   1  33.737   2.336 -10.857
    7    HD1  TYR   1           HD1      TYR   1  35.350   4.931  -9.495
    8    HD2  TYR   1           HD2      TYR   1  34.446   3.458 -13.384
    9    HE1  TYR   1           HE1      TYR   1  35.525   7.214 -10.394
   10    HE2  TYR   1           HE2      TYR   1  34.623   5.736 -14.295
   11    HH   TYR   1           HH       TYR   1  36.014   8.290 -12.623
   12    HA   PRO   2           HA       PRO   2  32.756   1.200  -6.300
   13   1HB   PRO   2          HB2       PRO   2  33.003   3.520  -4.592
   14   2HB   PRO   2          HB1       PRO   2  33.447   1.847  -4.252
   15   1HG   PRO   2          HG2       PRO   2  35.275   3.840  -4.553
   16   2HG   PRO   2          HG1       PRO   2  35.611   2.145  -4.948
   17   1HD   PRO   2          HD2       PRO   2  34.900   4.410  -6.779
   18   2HD   PRO   2          HD1       PRO   2  36.106   3.123  -6.995
   19    H    ILE   3           HN       ILE   3  32.522   4.583  -5.697
   20    HA   ILE   3           HA       ILE   3  31.002   6.173  -5.951
   21    HB   ILE   3           HB       ILE   3  30.300   6.720  -8.002
   22   1HG1  ILE   3          HG12      ILE   3  29.955   4.039  -9.218
   23   2HG1  ILE   3          HG11      ILE   3  28.782   4.498  -7.990
   24   1HG2  ILE   3          HG21      ILE   3  32.418   6.505  -8.670
   25   2HG2  ILE   3          HG22      ILE   3  31.752   5.242  -9.706
   26   3HG2  ILE   3          HG23      ILE   3  32.513   4.813  -8.173
   27   1HD1  ILE   3          HD11      ILE   3  28.925   5.283 -10.728
   28   2HD1  ILE   3          HD12      ILE   3  29.045   6.712  -9.702
   29   3HD1  ILE   3          HD13      ILE   3  27.670   5.615  -9.534
   30    H    LYS   4           HN       LYS   4  29.527   3.010  -6.531
   31    HA   LYS   4           HA       LYS   4  27.646   3.472  -4.429
   32   1HB   LYS   4          HB2       LYS   4  26.846   4.409  -6.933
   33   2HB   LYS   4          HB1       LYS   4  26.064   2.841  -6.788
   34   1HG   LYS   4          HG2       LYS   4  25.861   5.070  -4.770
   35   2HG   LYS   4          HG1       LYS   4  24.654   4.692  -6.000
   36   1HD   LYS   4          HD2       LYS   4  25.562   2.810  -3.821
   37   2HD   LYS   4          HD1       LYS   4  24.082   3.768  -3.780
   38   1HE   LYS   4          HE2       LYS   4  24.554   2.014  -6.135
   39   2HE   LYS   4          HE1       LYS   4  24.105   1.248  -4.613
   40   1HZ   LYS   4          HZ1       LYS   4  22.131   1.668  -5.824
   41   2HZ   LYS   4          HZ2       LYS   4  22.565   3.279  -6.131
   42   3HZ   LYS   4          HZ3       LYS   4  22.168   2.796  -4.553
   43    HA   PRO   5           HA       PRO   5  28.280  -0.979  -4.906
   44   1HB   PRO   5          HB2       PRO   5  27.484  -1.175  -2.135
   45   2HB   PRO   5          HB1       PRO   5  29.073  -1.474  -2.845
   46   1HG   PRO   5          HG2       PRO   5  28.498   0.616  -1.167
   47   2HG   PRO   5          HG1       PRO   5  29.823   0.614  -2.345
   48   1HD   PRO   5          HD2       PRO   5  27.131   1.901  -2.514
   49   2HD   PRO   5          HD1       PRO   5  28.701   2.484  -3.105
   50    H    GLU   6           HN       GLU   6  26.623  -1.999  -5.866
   51    HA   GLU   6           HA       GLU   6  23.895  -1.420  -5.349
   52   1HB   GLU   6          HB2       GLU   6  25.342  -3.544  -6.890
   53   2HB   GLU   6          HB1       GLU   6  23.611  -3.687  -6.626
   54   1HG   GLU   6          HG2       GLU   6  23.624  -1.210  -7.537
   55   2HG   GLU   6          HG1       GLU   6  25.131  -1.746  -8.276
   56    H    ALA   7           HN       ALA   7  23.286  -1.708  -3.281
   57    HA   ALA   7           HA       ALA   7  24.245  -3.698  -1.557
   58   1HB   ALA   7          HB1       ALA   7  22.761  -1.412  -1.272
   59   2HB   ALA   7          HB2       ALA   7  23.110  -2.570   0.011
   60   3HB   ALA   7          HB3       ALA   7  21.594  -2.676  -0.882
   61    HA   PRO   8           HA       PRO   8  21.881  -7.208  -3.064
   62   1HB   PRO   8          HB2       PRO   8  23.010  -8.369  -0.572
   63   2HB   PRO   8          HB1       PRO   8  23.102  -8.973  -2.230
   64   1HG   PRO   8          HG2       PRO   8  25.232  -7.893  -1.058
   65   2HG   PRO   8          HG1       PRO   8  24.886  -7.578  -2.770
   66   1HD   PRO   8          HD2       PRO   8  24.392  -5.834  -0.381
   67   2HD   PRO   8          HD1       PRO   8  25.022  -5.396  -1.986
   68    H    GLY   9           HN       GLY   9  21.990  -6.060   0.281
   69   1HA   GLY   9          HA2       GLY   9  19.611  -5.313   0.904
   70   2HA   GLY   9          HA1       GLY   9  19.263  -7.029   0.696
   71    H    GLU  10           HN       GLU  10  18.699  -6.182   3.104
   72    HA   GLU  10           HA       GLU  10  20.951  -6.351   4.859
   73   1HB   GLU  10          HB2       GLU  10  17.988  -6.154   5.202
   74   2HB   GLU  10          HB1       GLU  10  18.924  -6.786   6.550
   75   1HG   GLU  10          HG2       GLU  10  18.566  -4.406   6.797
   76   2HG   GLU  10          HG1       GLU  10  20.278  -4.757   6.565
   77    H    ASP  11           HN       ASP  11  18.516  -8.484   3.576
   78    HA   ASP  11           HA       ASP  11  19.561 -10.768   5.028
   79   1HB   ASP  11          HB2       ASP  11  17.122 -10.552   4.452
   80   2HB   ASP  11          HB1       ASP  11  17.565 -10.758   2.759
   81    H    ALA  12           HN       ALA  12  21.731 -10.275   4.133
   82    HA   ALA  12           HA       ALA  12  22.077 -11.686   1.565
   83   1HB   ALA  12          HB1       ALA  12  22.700  -9.206   1.648
   84   2HB   ALA  12          HB2       ALA  12  23.909 -10.325   1.020
   85   3HB   ALA  12          HB3       ALA  12  24.052  -9.708   2.664
   86    H    SER  13           HN       SER  13  22.072 -12.320   4.607
   87    HA   SER  13           HA       SER  13  23.079 -13.757   6.031
   88   1HB   SER  13          HB2       SER  13  24.923 -14.546   3.767
   89   2HB   SER  13          HB1       SER  13  24.487 -15.498   5.189
   90    HG   SER  13           HG       SER  13  22.281 -14.722   3.821
   91    HA   PRO  14           HA       PRO  14  26.160 -11.417   8.029
   92   1HB   PRO  14          HB2       PRO  14  27.725 -13.494   9.080
   93   2HB   PRO  14          HB1       PRO  14  26.324 -12.743   9.844
   94   1HG   PRO  14          HG2       PRO  14  26.501 -15.266   8.269
   95   2HG   PRO  14          HG1       PRO  14  25.508 -14.893   9.691
   96   1HD   PRO  14          HD2       PRO  14  24.429 -14.974   7.253
   97   2HD   PRO  14          HD1       PRO  14  23.924 -13.740   8.429
   98    H    GLU  15           HN       GLU  15  27.361 -14.059   5.996
   99    HA   GLU  15           HA       GLU  15  30.047 -13.195   5.873
  100   1HB   GLU  15          HB2       GLU  15  28.383 -15.197   4.624
  101   2HB   GLU  15          HB1       GLU  15  29.470 -14.469   3.448
  102   1HG   GLU  15          HG2       GLU  15  30.612 -15.298   6.054
  103   2HG   GLU  15          HG1       GLU  15  30.157 -16.560   4.908
  104    H    GLU  16           HN       GLU  16  27.351 -12.679   3.609
  105    HA   GLU  16           HA       GLU  16  28.999 -11.050   1.896
  106   1HB   GLU  16          HB2       GLU  16  26.863 -12.703   1.435
  107   2HB   GLU  16          HB1       GLU  16  26.118 -11.114   1.352
  108   1HG   GLU  16          HG2       GLU  16  26.944 -12.087  -0.816
  109   2HG   GLU  16          HG1       GLU  16  27.477 -10.451  -0.439
  110    H    LEU  17           HN       LEU  17  26.470 -10.646   4.279
  111    HA   LEU  17           HA       LEU  17  25.949  -7.916   3.874
  112   1HB   LEU  17          HB2       LEU  17  24.581  -9.238   5.394
  113   2HB   LEU  17          HB1       LEU  17  25.962  -9.528   6.434
  114    HG   LEU  17           HG       LEU  17  25.801  -6.764   6.321
  115   1HD1  LEU  17          HD11      LEU  17  23.160  -7.097   7.240
  116   2HD1  LEU  17          HD12      LEU  17  23.249  -7.840   5.644
  117   3HD1  LEU  17          HD13      LEU  17  23.725  -6.157   5.857
  118   1HD2  LEU  17          HD21      LEU  17  24.487  -7.453   8.628
  119   2HD2  LEU  17          HD22      LEU  17  26.237  -7.379   8.420
  120   3HD2  LEU  17          HD23      LEU  17  25.390  -8.914   8.241
  121    H    ASN  18           HN       ASN  18  28.335  -9.574   5.929
  122    HA   ASN  18           HA       ASN  18  29.655  -7.279   6.865
  123   1HB   ASN  18          HB2       ASN  18  30.022  -9.430   7.914
  124   2HB   ASN  18          HB1       ASN  18  30.681 -10.091   6.422
  125   1HD2  ASN  18          HD21      ASN  18  32.758 -10.453   6.718
  126   2HD2  ASN  18          HD22      ASN  18  33.882  -9.356   7.448
  127    H    ARG  19           HN       ARG  19  30.105  -9.247   3.955
  128    HA   ARG  19           HA       ARG  19  32.479  -8.059   3.044
  129   1HB   ARG  19          HB2       ARG  19  30.253  -9.566   1.765
  130   2HB   ARG  19          HB1       ARG  19  31.358  -8.690   0.708
  131   1HG   ARG  19          HG2       ARG  19  33.219  -9.878   2.016
  132   2HG   ARG  19          HG1       ARG  19  31.936 -10.957   2.571
  133   1HD   ARG  19          HD2       ARG  19  31.394 -11.536   0.279
  134   2HD   ARG  19          HD1       ARG  19  32.604 -10.394  -0.316
  135    HE   ARG  19           HE       ARG  19  34.281 -11.875   0.256
  136   1HH1  ARG  19          HH11      ARG  19  31.148 -13.115   1.210
  137   2HH1  ARG  19          HH12      ARG  19  31.785 -14.618   1.819
  138   1HH2  ARG  19          HH21      ARG  19  35.118 -13.863   0.969
  139   2HH2  ARG  19          HH22      ARG  19  34.059 -15.053   1.658
  140    H    TYR  20           HN       TYR  20  29.165  -7.344   1.912
  141    HA   TYR  20           HA       TYR  20  29.914  -5.060   0.445
  142   1HB   TYR  20          HB2       TYR  20  27.796  -5.226  -0.281
  143   2HB   TYR  20          HB1       TYR  20  27.571  -6.562   0.838
  144    HD1  TYR  20           HD1      TYR  20  26.915  -3.006   0.220
  145    HD2  TYR  20           HD2      TYR  20  26.370  -6.235   2.934
  146    HE1  TYR  20           HE1      TYR  20  25.187  -1.715   1.396
  147    HE2  TYR  20           HE2      TYR  20  24.645  -4.953   4.127
  148    HH   TYR  20           HH       TYR  20  22.998  -2.624   3.030
  149    H    TYR  21           HN       TYR  21  29.041  -5.543   3.775
  150    HA   TYR  21           HA       TYR  21  28.420  -2.960   4.585
  151   1HB   TYR  21          HB2       TYR  21  28.612  -5.377   5.811
  152   2HB   TYR  21          HB1       TYR  21  30.022  -4.555   6.476
  153    HD1  TYR  21           HD1      TYR  21  26.408  -4.760   6.449
  154    HD2  TYR  21           HD2      TYR  21  29.742  -2.486   7.777
  155    HE1  TYR  21           HE1      TYR  21  24.965  -3.608   8.059
  156    HE2  TYR  21           HE2      TYR  21  28.326  -1.323   9.391
  157    HH   TYR  21           HH       TYR  21  24.822  -2.000   9.563
  158    H    ALA  22           HN       ALA  22  31.560  -4.606   4.921
  159    HA   ALA  22           HA       ALA  22  32.788  -2.206   5.864
  160   1HB   ALA  22          HB1       ALA  22  33.534  -4.241   6.781
  161   2HB   ALA  22          HB2       ALA  22  34.866  -3.600   5.815
  162   3HB   ALA  22          HB3       ALA  22  33.877  -4.920   5.189
  163    H    SER  23           HN       SER  23  32.482  -3.742   2.734
  164    HA   SER  23           HA       SER  23  34.471  -2.206   1.413
  165   1HB   SER  23          HB2       SER  23  31.886  -3.202   0.190
  166   2HB   SER  23          HB1       SER  23  33.404  -2.855  -0.641
  167    HG   SER  23           HG       SER  23  32.776  -4.996   1.098
  168    H    LEU  24           HN       LEU  24  31.122  -1.623   2.252
  169    HA   LEU  24           HA       LEU  24  30.915   0.910   0.952
  170   1HB   LEU  24          HB2       LEU  24  28.955  -0.525   1.375
  171   2HB   LEU  24          HB1       LEU  24  29.229  -0.379   3.100
  172    HG   LEU  24           HG       LEU  24  28.994   2.249   2.003
  173   1HD1  LEU  24          HD11      LEU  24  27.758   1.482   0.167
  174   2HD1  LEU  24          HD12      LEU  24  26.551   1.994   1.346
  175   3HD1  LEU  24          HD13      LEU  24  26.902   0.280   1.135
  176   1HD2  LEU  24          HD21      LEU  24  27.626   2.562   3.794
  177   2HD2  LEU  24          HD22      LEU  24  28.437   1.084   4.322
  178   3HD2  LEU  24          HD23      LEU  24  26.828   0.999   3.603
  179    H    ARG  25           HN       ARG  25  31.978  -0.318   4.006
  180    HA   ARG  25           HA       ARG  25  31.843   2.072   5.501
  181   1HB   ARG  25          HB2       ARG  25  32.497  -0.522   6.064
  182   2HB   ARG  25          HB1       ARG  25  34.071   0.257   6.135
  183   1HG   ARG  25          HG2       ARG  25  33.166   0.260   8.322
  184   2HG   ARG  25          HG1       ARG  25  33.086   1.917   7.718
  185   1HD   ARG  25          HD2       ARG  25  30.699   1.367   7.010
  186   2HD   ARG  25          HD1       ARG  25  30.858  -0.079   8.009
  187    HE   ARG  25           HE       ARG  25  31.243   1.415   9.918
  188   1HH1  ARG  25          HH11      ARG  25  29.711   2.762   7.063
  189   2HH1  ARG  25          HH12      ARG  25  28.989   4.081   7.922
  190   1HH2  ARG  25          HH21      ARG  25  30.323   3.158  11.036
  191   2HH2  ARG  25          HH22      ARG  25  29.329   4.311  10.187
  192    H    HIS  26           HN       HIS  26  34.497   0.569   3.652
  193    HA   HIS  26           HA       HIS  26  36.306   2.722   4.075
  194   1HB   HIS  26          HB2       HIS  26  36.687   0.241   3.215
  195   2HB   HIS  26          HB1       HIS  26  36.522   1.009   1.639
  196    HD1  HIS  26           HD1      HIS  26  38.507   2.335   0.773
  197    HD2  HIS  26           HD2      HIS  26  38.921   1.182   4.751
  198    HE1  HIS  26           HE1      HIS  26  40.870   2.917   1.414
  199    HE2  HIS  26           HE2      HIS  26  41.043   2.362   3.866
  200    H    TYR  27           HN       TYR  27  34.088   1.870   1.449
  201    HA   TYR  27           HA       TYR  27  34.738   3.972  -0.284
  202   1HB   TYR  27          HB2       TYR  27  33.429   2.445  -1.372
  203   2HB   TYR  27          HB1       TYR  27  32.460   2.100   0.053
  204    HD1  TYR  27           HD1      TYR  27  30.321   3.012   0.279
  205    HD2  TYR  27           HD2      TYR  27  32.966   4.642  -2.632
  206    HE1  TYR  27           HE1      TYR  27  28.478   4.359  -0.634
  207    HE2  TYR  27           HE2      TYR  27  31.130   5.993  -3.548
  208    HH   TYR  27           HH       TYR  27  28.691   5.961  -3.637
  209    H    LEU  28           HN       LEU  28  32.266   3.753   2.282
  210    HA   LEU  28           HA       LEU  28  31.248   6.369   1.993
  211   1HB   LEU  28          HB2       LEU  28  30.940   4.194   3.815
  212   2HB   LEU  28          HB1       LEU  28  31.195   5.655   4.746
  213    HG   LEU  28           HG       LEU  28  28.824   5.234   4.439
  214   1HD1  LEU  28          HD11      LEU  28  29.509   7.538   4.596
  215   2HD1  LEU  28          HD12      LEU  28  28.179   7.399   3.448
  216   3HD1  LEU  28          HD13      LEU  28  29.832   7.594   2.865
  217   1HD2  LEU  28          HD21      LEU  28  29.110   4.020   2.259
  218   2HD2  LEU  28          HD22      LEU  28  29.258   5.599   1.484
  219   3HD2  LEU  28          HD23      LEU  28  27.764   5.158   2.313
  220    H    ASN  29           HN       ASN  29  33.867   5.120   4.026
  221    HA   ASN  29           HA       ASN  29  34.424   7.490   5.419
  222   1HB   ASN  29          HB2       ASN  29  35.259   5.129   5.909
  223   2HB   ASN  29          HB1       ASN  29  36.490   5.416   4.681
  224   1HD2  ASN  29          HD21      ASN  29  35.404   6.152   7.881
  225   2HD2  ASN  29          HD22      ASN  29  36.816   7.015   8.382
  226    H    LEU  30           HN       LEU  30  35.377   6.392   2.240
  227    HA   LEU  30           HA       LEU  30  37.409   8.368   1.879
  228   1HB   LEU  30          HB2       LEU  30  36.205   6.219   0.284
  229   2HB   LEU  30          HB1       LEU  30  36.734   7.603  -0.651
  230    HG   LEU  30           HG       LEU  30  38.342   5.604   0.851
  231   1HD1  LEU  30          HD11      LEU  30  38.765   7.146  -1.701
  232   2HD1  LEU  30          HD12      LEU  30  38.140   5.502  -1.574
  233   3HD1  LEU  30          HD13      LEU  30  39.800   5.855  -1.091
  234   1HD2  LEU  30          HD21      LEU  30  39.623   7.093   1.892
  235   2HD2  LEU  30          HD22      LEU  30  38.725   8.432   1.178
  236   3HD2  LEU  30          HD23      LEU  30  40.089   7.725   0.315
  237    H    VAL  31           HN       VAL  31  34.013   8.079   0.841
  238    HA   VAL  31           HA       VAL  31  34.136  10.513  -0.676
  239    HB   VAL  31           HB       VAL  31  31.678  10.294  -0.909
  240   1HG1  VAL  31          HG11      VAL  31  32.924   7.630  -1.478
  241   2HG1  VAL  31          HG12      VAL  31  33.455   9.088  -2.318
  242   3HG1  VAL  31          HG13      VAL  31  31.777   8.555  -2.451
  243   1HG2  VAL  31          HG21      VAL  31  30.521   8.345  -0.058
  244   2HG2  VAL  31          HG22      VAL  31  31.230   9.249   1.279
  245   3HG2  VAL  31          HG23      VAL  31  32.000   7.769   0.710
  246    H    THR  32           HN       THR  32  33.225   9.685   2.600
  247    HA   THR  32           HA       THR  32  32.106  12.310   3.087
  248    HB   THR  32           HB       THR  32  32.827  10.419   5.300
  249    HG1  THR  32           HG1      THR  32  31.756   9.091   3.815
  250   1HG2  THR  32          HG21      THR  32  30.316  12.032   4.966
  251   2HG2  THR  32          HG22      THR  32  31.793  12.756   5.597
  252   3HG2  THR  32          HG23      THR  32  31.039  11.410   6.448
  253    H    ARG  33           HN       ARG  33  34.789  12.217   2.111
  254    HA   ARG  33           HA       ARG  33  36.494  13.003   4.315
  255   1HB   ARG  33          HB2       ARG  33  36.860  12.180   1.612
  256   2HB   ARG  33          HB1       ARG  33  37.563  13.783   1.779
  257   1HG   ARG  33          HG2       ARG  33  38.198  11.414   3.529
  258   2HG   ARG  33          HG1       ARG  33  39.185  11.990   2.186
  259   1HD   ARG  33          HD2       ARG  33  39.563  14.090   3.301
  260   2HD   ARG  33          HD1       ARG  33  38.453  13.640   4.595
  261    HE   ARG  33           HE       ARG  33  40.244  11.679   4.756
  262   1HH1  ARG  33          HH11      ARG  33  40.674  15.135   4.444
  263   2HH1  ARG  33          HH12      ARG  33  42.176  15.155   5.313
  264   1HH2  ARG  33          HH21      ARG  33  42.227  11.687   5.907
  265   2HH2  ARG  33          HH22      ARG  33  43.070  13.195   6.152
  266    H    GLN  34           HN       GLN  34  34.056  14.401   2.578
  267    HA   GLN  34           HA       GLN  34  33.251  16.505   2.312
  268   1HB   GLN  34          HB2       GLN  34  34.792  16.562   4.823
  269   2HB   GLN  34          HB1       GLN  34  34.502  18.140   4.106
  270   1HG   GLN  34          HG2       GLN  34  32.600  16.208   5.292
  271   2HG   GLN  34          HG1       GLN  34  32.657  17.967   5.417
  272   1HE2  GLN  34          HE21      GLN  34  31.746  19.220   3.750
  273   2HE2  GLN  34          HE22      GLN  34  30.589  18.547   2.649
  274    H    ARG  35           HN       ARG  35  34.774  16.109   0.335
  275    HA   ARG  35           HA       ARG  35  36.694  18.324   0.195
  276   1HB   ARG  35          HB2       ARG  35  37.726  17.153  -1.688
  277   2HB   ARG  35          HB1       ARG  35  37.691  16.134  -0.257
  278   1HG   ARG  35          HG2       ARG  35  36.554  14.562  -1.320
  279   2HG   ARG  35          HG1       ARG  35  35.341  15.724  -1.864
  280   1HD   ARG  35          HD2       ARG  35  37.912  15.926  -3.247
  281   2HD   ARG  35          HD1       ARG  35  37.080  14.390  -3.488
  282    HE   ARG  35           HE       ARG  35  35.153  15.700  -4.277
  283   1HH1  ARG  35          HH11      ARG  35  38.272  17.309  -4.148
  284   2HH1  ARG  35          HH12      ARG  35  37.896  18.403  -5.452
  285   1HH2  ARG  35          HH21      ARG  35  34.655  17.156  -5.976
  286   2HH2  ARG  35          HH22      ARG  35  35.843  18.327  -6.467
  287    H    TYR  36           HN       TYR  36  36.576  19.792  -1.469
  288    HA   TYR  36           HA       TYR  36  34.047  19.750  -2.987
  289   1HB   TYR  36          HB2       TYR  36  35.345  22.310  -2.104
  290   2HB   TYR  36          HB1       TYR  36  33.673  22.024  -2.576
  291    HD1  TYR  36           HD1      TYR  36  35.929  22.362   0.149
  292    HD2  TYR  36           HD2      TYR  36  32.254  20.542  -0.988
  293    HE1  TYR  36           HE1      TYR  36  35.313  22.141   2.518
  294    HE2  TYR  36           HE2      TYR  36  31.626  20.318   1.380
  295    HH   TYR  36           HH       TYR  36  32.221  21.503   3.578
  296   1HN   NH2  37          H1        NH2  37  37.532  21.123  -4.647
  297   2HN   NH2  37          H2        NH2  37  37.371  21.017  -2.932
  Start of MODEL    4
    1   1H    TYR   1          HT1       TYR   1  38.559   1.954  -5.970
    2   2H    TYR   1          HT2       TYR   1  39.001   0.334  -5.757
    3   3H    TYR   1          HT3       TYR   1  37.903   1.057  -4.692
    4    HA   TYR   1           HA       TYR   1  37.293   0.969  -7.551
    5   1HB   TYR   1          HB2       TYR   1  35.961  -1.218  -6.753
    6   2HB   TYR   1          HB1       TYR   1  37.565  -1.294  -7.470
    7    HD1  TYR   1           HD1      TYR   1  35.971  -0.926  -4.100
    8    HD2  TYR   1           HD2      TYR   1  39.166  -2.568  -6.387
    9    HE1  TYR   1           HE1      TYR   1  36.789  -2.100  -2.101
   10    HE2  TYR   1           HE2      TYR   1  39.992  -3.744  -4.393
   11    HH   TYR   1           HH       TYR   1  38.223  -4.219  -1.656
   12    HA   PRO   2           HA       PRO   2  33.814   2.937  -5.411
   13   1HB   PRO   2          HB2       PRO   2  33.303   4.181  -7.984
   14   2HB   PRO   2          HB1       PRO   2  33.745   4.945  -6.458
   15   1HG   PRO   2          HG2       PRO   2  35.407   4.858  -8.611
   16   2HG   PRO   2          HG1       PRO   2  35.984   4.905  -6.935
   17   1HD   PRO   2          HD2       PRO   2  35.725   2.562  -8.784
   18   2HD   PRO   2          HD1       PRO   2  37.039   2.963  -7.657
   19    H    ILE   3           HN       ILE   3  33.196   0.574  -5.624
   20    HA   ILE   3           HA       ILE   3  31.998  -0.458  -7.935
   21    HB   ILE   3           HB       ILE   3  32.730  -2.045  -6.384
   22   1HG1  ILE   3          HG12      ILE   3  29.941  -2.406  -5.548
   23   2HG1  ILE   3          HG11      ILE   3  30.130  -2.112  -7.273
   24   1HG2  ILE   3          HG21      ILE   3  30.959  -0.923  -4.232
   25   2HG2  ILE   3          HG22      ILE   3  32.648  -0.458  -4.435
   26   3HG2  ILE   3          HG23      ILE   3  32.233  -2.134  -4.076
   27   1HD1  ILE   3          HD11      ILE   3  30.547  -4.277  -7.483
   28   2HD1  ILE   3          HD12      ILE   3  30.677  -4.487  -5.736
   29   3HD1  ILE   3          HD13      ILE   3  32.086  -3.987  -6.672
   30    H    LYS   4           HN       LYS   4  30.582   1.151  -5.131
   31    HA   LYS   4           HA       LYS   4  28.520   2.007  -4.695
   32   1HB   LYS   4          HB2       LYS   4  28.838   2.293  -7.607
   33   2HB   LYS   4          HB1       LYS   4  27.170   2.306  -7.053
   34   1HG   LYS   4          HG2       LYS   4  27.717   4.128  -5.498
   35   2HG   LYS   4          HG1       LYS   4  29.372   4.129  -6.112
   36   1HD   LYS   4          HD2       LYS   4  28.542   5.744  -7.471
   37   2HD   LYS   4          HD1       LYS   4  28.044   4.350  -8.433
   38   1HE   LYS   4          HE2       LYS   4  25.985   5.221  -8.308
   39   2HE   LYS   4          HE1       LYS   4  25.979   4.614  -6.651
   40   1HZ   LYS   4          HZ1       LYS   4  26.585   7.356  -7.588
   41   2HZ   LYS   4          HZ2       LYS   4  26.991   6.822  -6.032
   42   3HZ   LYS   4          HZ3       LYS   4  25.367   6.857  -6.516
   43    HA   PRO   5           HA       PRO   5  26.650  -2.219  -5.192
   44   1HB   PRO   5          HB2       PRO   5  26.375  -2.129  -2.284
   45   2HB   PRO   5          HB1       PRO   5  27.221  -3.315  -3.283
   46   1HG   PRO   5          HG2       PRO   5  28.523  -1.576  -1.672
   47   2HG   PRO   5          HG1       PRO   5  29.209  -2.164  -3.197
   48   1HD   PRO   5          HD2       PRO   5  27.861   0.450  -2.610
   49   2HD   PRO   5          HD1       PRO   5  29.317   0.125  -3.578
   50    H    GLU   6           HN       GLU   6  24.538  -2.330  -5.616
   51    HA   GLU   6           HA       GLU   6  22.771  -0.237  -4.741
   52   1HB   GLU   6          HB2       GLU   6  21.781  -2.638  -6.204
   53   2HB   GLU   6          HB1       GLU   6  21.327  -0.951  -6.394
   54   1HG   GLU   6          HG2       GLU   6  23.797  -0.723  -7.254
   55   2HG   GLU   6          HG1       GLU   6  23.614  -2.449  -7.559
   56    H    ALA   7           HN       ALA   7  23.507  -1.375  -2.499
   57    HA   ALA   7           HA       ALA   7  22.894  -2.420  -0.586
   58   1HB   ALA   7          HB1       ALA   7  20.088  -1.927  -1.545
   59   2HB   ALA   7          HB2       ALA   7  21.137  -0.675  -0.880
   60   3HB   ALA   7          HB3       ALA   7  20.657  -2.045   0.119
   61    HA   PRO   8           HA       PRO   8  21.724  -6.519  -2.429
   62   1HB   PRO   8          HB2       PRO   8  24.399  -7.485  -2.119
   63   2HB   PRO   8          HB1       PRO   8  23.528  -7.188  -3.622
   64   1HG   PRO   8          HG2       PRO   8  25.732  -5.757  -2.758
   65   2HG   PRO   8          HG1       PRO   8  24.550  -5.186  -3.950
   66   1HD   PRO   8          HD2       PRO   8  24.766  -4.553  -1.036
   67   2HD   PRO   8          HD1       PRO   8  24.316  -3.494  -2.391
   68    H    GLY   9           HN       GLY   9  20.712  -6.344  -0.247
   69   1HA   GLY   9          HA2       GLY   9  22.169  -8.051   1.668
   70   2HA   GLY   9          HA1       GLY   9  21.354  -6.590   2.210
   71    H    GLU  10           HN       GLU  10  20.041  -8.636  -0.295
   72    HA   GLU  10           HA       GLU  10  17.839  -9.340   1.512
   73   1HB   GLU  10          HB2       GLU  10  18.092  -8.877  -1.391
   74   2HB   GLU  10          HB1       GLU  10  17.026 -10.201  -0.935
   75   1HG   GLU  10          HG2       GLU  10  16.093  -8.384   0.748
   76   2HG   GLU  10          HG1       GLU  10  16.739  -7.287  -0.471
   77    H    ASP  11           HN       ASP  11  20.332 -10.703  -0.519
   78    HA   ASP  11           HA       ASP  11  19.579 -13.407   0.344
   79   1HB   ASP  11          HB2       ASP  11  21.435 -14.026  -1.388
   80   2HB   ASP  11          HB1       ASP  11  19.845 -13.545  -1.958
   81    H    ALA  12           HN       ALA  12  22.418 -11.325  -0.035
   82    HA   ALA  12           HA       ALA  12  24.183 -12.810   1.565
   83   1HB   ALA  12          HB1       ALA  12  25.154 -11.152   0.224
   84   2HB   ALA  12          HB2       ALA  12  25.310 -10.524   1.865
   85   3HB   ALA  12          HB3       ALA  12  24.041  -9.910   0.801
   86    H    SER  13           HN       SER  13  24.150 -13.197   3.689
   87    HA   SER  13           HA       SER  13  22.687 -11.294   5.386
   88   1HB   SER  13          HB2       SER  13  22.650 -14.046   6.384
   89   2HB   SER  13          HB1       SER  13  21.331 -12.885   6.215
   90    HG   SER  13           HG       SER  13  21.851 -13.494   3.786
   91    HA   PRO  14           HA       PRO  14  26.159 -12.871   8.143
   92   1HB   PRO  14          HB2       PRO  14  27.638 -15.082   7.148
   93   2HB   PRO  14          HB1       PRO  14  26.432 -15.093   8.433
   94   1HG   PRO  14          HG2       PRO  14  26.163 -16.324   5.953
   95   2HG   PRO  14          HG1       PRO  14  24.836 -15.948   7.064
   96   1HD   PRO  14          HD2       PRO  14  25.768 -14.464   4.645
   97   2HD   PRO  14          HD1       PRO  14  24.115 -14.716   5.253
   98    H    GLU  15           HN       GLU  15  28.434 -14.428   6.134
   99    HA   GLU  15           HA       GLU  15  30.283 -12.310   6.584
  100   1HB   GLU  15          HB2       GLU  15  30.407 -14.923   5.111
  101   2HB   GLU  15          HB1       GLU  15  31.731 -13.770   5.008
  102   1HG   GLU  15          HG2       GLU  15  32.366 -14.087   7.171
  103   2HG   GLU  15          HG1       GLU  15  30.738 -14.505   7.705
  104    H    GLU  16           HN       GLU  16  28.344 -13.326   3.909
  105    HA   GLU  16           HA       GLU  16  29.572 -11.803   1.883
  106   1HB   GLU  16          HB2       GLU  16  26.632 -12.435   1.967
  107   2HB   GLU  16          HB1       GLU  16  27.680 -12.303   0.564
  108   1HG   GLU  16          HG2       GLU  16  27.450 -14.559   0.672
  109   2HG   GLU  16          HG1       GLU  16  28.879 -14.357   1.689
  110    H    LEU  17           HN       LEU  17  26.958 -11.155   4.198
  111    HA   LEU  17           HA       LEU  17  26.400  -8.558   3.174
  112   1HB   LEU  17          HB2       LEU  17  24.837  -9.851   4.631
  113   2HB   LEU  17          HB1       LEU  17  25.924  -9.560   5.977
  114    HG   LEU  17           HG       LEU  17  25.493  -7.016   5.076
  115   1HD1  LEU  17          HD11      LEU  17  23.162  -6.724   4.633
  116   2HD1  LEU  17          HD12      LEU  17  22.852  -8.445   4.861
  117   3HD1  LEU  17          HD13      LEU  17  23.799  -7.896   3.479
  118   1HD2  LEU  17          HD21      LEU  17  24.551  -8.713   7.271
  119   2HD2  LEU  17          HD22      LEU  17  23.545  -7.297   6.955
  120   3HD2  LEU  17          HD23      LEU  17  25.264  -7.100   7.306
  121    H    ASN  18           HN       ASN  18  28.390  -9.794   5.834
  122    HA   ASN  18           HA       ASN  18  29.317  -7.305   6.749
  123   1HB   ASN  18          HB2       ASN  18  29.569  -9.525   7.936
  124   2HB   ASN  18          HB1       ASN  18  30.902  -9.880   6.837
  125   1HD2  ASN  18          HD21      ASN  18  32.883  -9.083   7.305
  126   2HD2  ASN  18          HD22      ASN  18  33.224  -7.978   8.594
  127    H    ARG  19           HN       ARG  19  30.489  -9.445   4.187
  128    HA   ARG  19           HA       ARG  19  32.917  -8.122   3.661
  129   1HB   ARG  19          HB2       ARG  19  31.125  -9.955   2.179
  130   2HB   ARG  19          HB1       ARG  19  32.218  -8.990   1.196
  131   1HG   ARG  19          HG2       ARG  19  34.060  -9.819   2.762
  132   2HG   ARG  19          HG1       ARG  19  32.881 -11.017   3.295
  133   1HD   ARG  19          HD2       ARG  19  33.424 -10.637   0.382
  134   2HD   ARG  19          HD1       ARG  19  34.530 -11.593   1.366
  135    HE   ARG  19           HE       ARG  19  31.900 -12.340   0.482
  136   1HH1  ARG  19          HH11      ARG  19  34.321 -12.864   2.967
  137   2HH1  ARG  19          HH12      ARG  19  33.748 -14.460   3.364
  138   1HH2  ARG  19          HH21      ARG  19  31.162 -14.418   0.983
  139   2HH2  ARG  19          HH22      ARG  19  31.944 -15.348   2.236
  140    H    TYR  20           HN       TYR  20  29.783  -7.752   1.991
  141    HA   TYR  20           HA       TYR  20  30.593  -5.478   0.515
  142   1HB   TYR  20          HB2       TYR  20  28.678  -5.918  -0.546
  143   2HB   TYR  20          HB1       TYR  20  28.319  -7.152   0.651
  144    HD1  TYR  20           HD1      TYR  20  26.707  -6.740   2.414
  145    HD2  TYR  20           HD2      TYR  20  27.657  -3.698  -0.408
  146    HE1  TYR  20           HE1      TYR  20  24.730  -5.465   3.127
  147    HE2  TYR  20           HE2      TYR  20  25.684  -2.413   0.303
  148    HH   TYR  20           HH       TYR  20  23.550  -3.613   2.877
  149    H    TYR  21           HN       TYR  21  29.266  -5.940   3.669
  150    HA   TYR  21           HA       TYR  21  28.292  -3.416   4.311
  151   1HB   TYR  21          HB2       TYR  21  28.502  -5.797   5.564
  152   2HB   TYR  21          HB1       TYR  21  29.758  -4.901   6.405
  153    HD1  TYR  21           HD1      TYR  21  29.204  -3.642   8.221
  154    HD2  TYR  21           HD2      TYR  21  26.181  -4.617   5.401
  155    HE1  TYR  21           HE1      TYR  21  27.531  -2.654   9.700
  156    HE2  TYR  21           HE2      TYR  21  24.480  -3.635   6.866
  157    HH   TYR  21           HH       TYR  21  24.360  -3.223   9.544
  158    H    ALA  22           HN       ALA  22  31.466  -4.790   5.111
  159    HA   ALA  22           HA       ALA  22  32.384  -2.302   6.167
  160   1HB   ALA  22          HB1       ALA  22  34.533  -3.509   6.445
  161   2HB   ALA  22          HB2       ALA  22  33.815  -4.892   5.619
  162   3HB   ALA  22          HB3       ALA  22  33.143  -4.333   7.155
  163    H    SER  23           HN       SER  23  32.658  -3.938   3.071
  164    HA   SER  23           HA       SER  23  34.608  -2.167   1.997
  165   1HB   SER  23          HB2       SER  23  32.457  -3.727   0.545
  166   2HB   SER  23          HB1       SER  23  33.905  -3.026  -0.180
  167    HG   SER  23           HG       SER  23  33.621  -5.286   1.436
  168    H    LEU  24           HN       LEU  24  31.146  -2.038   2.379
  169    HA   LEU  24           HA       LEU  24  30.665   0.281   0.832
  170   1HB   LEU  24          HB2       LEU  24  29.148  -1.576   2.336
  171   2HB   LEU  24          HB1       LEU  24  28.837  -0.002   3.035
  172    HG   LEU  24           HG       LEU  24  28.064  -1.083   0.391
  173   1HD1  LEU  24          HD11      LEU  24  25.995  -0.094   0.878
  174   2HD1  LEU  24          HD12      LEU  24  26.701   0.968   2.096
  175   3HD1  LEU  24          HD13      LEU  24  26.570  -0.764   2.409
  176   1HD2  LEU  24          HD21      LEU  24  29.068   1.678   0.815
  177   2HD2  LEU  24          HD22      LEU  24  27.649   1.445  -0.206
  178   3HD2  LEU  24          HD23      LEU  24  29.168   0.644  -0.612
  179    H    ARG  25           HN       ARG  25  31.081  -0.358   4.306
  180    HA   ARG  25           HA       ARG  25  30.947   2.298   5.169
  181   1HB   ARG  25          HB2       ARG  25  31.840  -0.256   6.277
  182   2HB   ARG  25          HB1       ARG  25  32.721   1.124   6.918
  183   1HG   ARG  25          HG2       ARG  25  30.978   1.829   8.120
  184   2HG   ARG  25          HG1       ARG  25  29.834   1.532   6.809
  185   1HD   ARG  25          HD2       ARG  25  29.947  -0.890   7.346
  186   2HD   ARG  25          HD1       ARG  25  30.952  -0.494   8.740
  187    HE   ARG  25           HE       ARG  25  28.093  -0.112   8.468
  188   1HH1  ARG  25          HH11      ARG  25  30.979   0.765  10.289
  189   2HH1  ARG  25          HH12      ARG  25  30.074   1.293  11.682
  190   1HH2  ARG  25          HH21      ARG  25  26.942   0.524  10.324
  191   2HH2  ARG  25          HH22      ARG  25  27.798   1.114  11.717
  192    H    HIS  26           HN       HIS  26  33.546   0.477   3.726
  193    HA   HIS  26           HA       HIS  26  35.652   2.304   4.295
  194   1HB   HIS  26          HB2       HIS  26  35.353  -0.209   2.990
  195   2HB   HIS  26          HB1       HIS  26  36.109   0.891   1.844
  196    HD1  HIS  26           HD1      HIS  26  37.574  -1.551   3.090
  197    HD2  HIS  26           HD2      HIS  26  37.829   2.362   4.479
  198    HE1  HIS  26           HE1      HIS  26  39.760  -1.410   4.329
  199    HE2  HIS  26           HE2      HIS  26  39.981   1.017   4.982
  200    H    TYR  27           HN       TYR  27  33.946   1.566   1.265
  201    HA   TYR  27           HA       TYR  27  34.958   3.712  -0.200
  202   1HB   TYR  27          HB2       TYR  27  34.003   1.988  -1.470
  203   2HB   TYR  27          HB1       TYR  27  32.538   1.955  -0.498
  204    HD1  TYR  27           HD1      TYR  27  30.615   2.917  -1.361
  205    HD2  TYR  27           HD2      TYR  27  34.393   4.234  -2.816
  206    HE1  TYR  27           HE1      TYR  27  29.479   4.339  -3.012
  207    HE2  TYR  27           HE2      TYR  27  33.262   5.658  -4.469
  208    HH   TYR  27           HH       TYR  27  31.321   6.392  -5.256
  209    H    LEU  28           HN       LEU  28  31.939   3.380   1.629
  210    HA   LEU  28           HA       LEU  28  30.874   5.899   0.964
  211   1HB   LEU  28          HB2       LEU  28  30.425   4.049   3.279
  212   2HB   LEU  28          HB1       LEU  28  29.645   5.620   3.222
  213    HG   LEU  28           HG       LEU  28  29.372   3.633   0.979
  214   1HD1  LEU  28          HD11      LEU  28  27.974   2.364   2.136
  215   2HD1  LEU  28          HD12      LEU  28  27.042   3.777   2.641
  216   3HD1  LEU  28          HD13      LEU  28  28.431   3.255   3.593
  217   1HD2  LEU  28          HD21      LEU  28  28.593   5.611   0.155
  218   2HD2  LEU  28          HD22      LEU  28  28.126   6.221   1.742
  219   3HD2  LEU  28          HD23      LEU  28  27.124   5.018   0.930
  220    H    ASN  29           HN       ASN  29  32.802   4.936   3.829
  221    HA   ASN  29           HA       ASN  29  32.769   7.431   5.090
  222   1HB   ASN  29          HB2       ASN  29  33.739   5.077   5.837
  223   2HB   ASN  29          HB1       ASN  29  35.247   5.765   5.248
  224   1HD2  ASN  29          HD21      ASN  29  34.721   5.026   7.912
  225   2HD2  ASN  29          HD22      ASN  29  34.792   6.454   8.891
  226    H    LEU  30           HN       LEU  30  34.747   6.229   2.465
  227    HA   LEU  30           HA       LEU  30  36.631   8.347   2.485
  228   1HB   LEU  30          HB2       LEU  30  35.847   6.207   0.590
  229   2HB   LEU  30          HB1       LEU  30  36.734   7.572  -0.064
  230    HG   LEU  30           HG       LEU  30  37.651   5.691   2.110
  231   1HD1  LEU  30          HD11      LEU  30  38.531   6.187  -0.723
  232   2HD1  LEU  30          HD12      LEU  30  37.915   4.691  -0.020
  233   3HD1  LEU  30          HD13      LEU  30  39.501   5.301   0.451
  234   1HD2  LEU  30          HD21      LEU  30  39.014   8.157   1.022
  235   2HD2  LEU  30          HD22      LEU  30  39.738   6.985   2.124
  236   3HD2  LEU  30          HD23      LEU  30  38.366   7.959   2.649
  237    H    VAL  31           HN       VAL  31  33.506   7.952   0.842
  238    HA   VAL  31           HA       VAL  31  33.968  10.497  -0.548
  239    HB   VAL  31           HB       VAL  31  31.891   9.895  -1.849
  240   1HG1  VAL  31          HG11      VAL  31  33.061   8.381  -3.322
  241   2HG1  VAL  31          HG12      VAL  31  34.187   7.951  -2.032
  242   3HG1  VAL  31          HG13      VAL  31  34.181   9.586  -2.691
  243   1HG2  VAL  31          HG21      VAL  31  30.635   8.217  -1.108
  244   2HG2  VAL  31          HG22      VAL  31  31.874   7.713   0.042
  245   3HG2  VAL  31          HG23      VAL  31  31.915   7.119  -1.617
  246    H    THR  32           HN       THR  32  31.511   8.964   1.547
  247    HA   THR  32           HA       THR  32  29.949  11.415   1.497
  248    HB   THR  32           HB       THR  32  28.466  10.100   3.151
  249    HG1  THR  32           HG1      THR  32  30.469   8.396   2.998
  250   1HG2  THR  32          HG21      THR  32  28.518   8.592   0.622
  251   2HG2  THR  32          HG22      THR  32  28.448  10.347   0.462
  252   3HG2  THR  32          HG23      THR  32  27.204   9.499   1.379
  253    H    ARG  33           HN       ARG  33  32.666  11.234   2.820
  254    HA   ARG  33           HA       ARG  33  32.121  11.652   5.599
  255   1HB   ARG  33          HB2       ARG  33  34.389  12.123   5.888
  256   2HB   ARG  33          HB1       ARG  33  34.354  10.921   4.604
  257   1HG   ARG  33          HG2       ARG  33  35.774  12.332   3.591
  258   2HG   ARG  33          HG1       ARG  33  34.301  13.199   3.150
  259   1HD   ARG  33          HD2       ARG  33  34.976  14.067   5.736
  260   2HD   ARG  33          HD1       ARG  33  36.485  14.049   4.818
  261    HE   ARG  33           HE       ARG  33  34.717  15.284   3.155
  262   1HH1  ARG  33          HH11      ARG  33  35.816  15.855   6.429
  263   2HH1  ARG  33          HH12      ARG  33  35.446  17.555   6.394
  264   1HH2  ARG  33          HH21      ARG  33  34.259  17.500   3.087
  265   2HH2  ARG  33          HH22      ARG  33  34.592  18.502   4.469
  266    H    GLN  34           HN       GLN  34  31.673  13.499   2.824
  267    HA   GLN  34           HA       GLN  34  31.929  16.123   3.682
  268   1HB   GLN  34          HB2       GLN  34  29.754  14.845   2.011
  269   2HB   GLN  34          HB1       GLN  34  29.898  16.580   2.245
  270   1HG   GLN  34          HG2       GLN  34  31.805  14.741   0.838
  271   2HG   GLN  34          HG1       GLN  34  30.889  16.085   0.160
  272   1HE2  GLN  34          HE21      GLN  34  31.544  18.213   0.640
  273   2HE2  GLN  34          HE22      GLN  34  33.162  18.558   1.164
  274    H    ARG  35           HN       ARG  35  29.477  13.718   4.365
  275    HA   ARG  35           HA       ARG  35  28.243  13.347   6.202
  276   1HB   ARG  35          HB2       ARG  35  30.590  14.036   7.148
  277   2HB   ARG  35          HB1       ARG  35  29.727  15.475   7.690
  278   1HG   ARG  35          HG2       ARG  35  28.042  13.633   8.623
  279   2HG   ARG  35          HG1       ARG  35  29.525  12.676   8.629
  280   1HD   ARG  35          HD2       ARG  35  28.865  15.162  10.157
  281   2HD   ARG  35          HD1       ARG  35  29.536  13.639  10.739
  282    HE   ARG  35           HE       ARG  35  30.982  15.854   9.526
  283   1HH1  ARG  35          HH11      ARG  35  31.053  12.529  10.654
  284   2HH1  ARG  35          HH12      ARG  35  32.787  12.463  10.731
  285   1HH2  ARG  35          HH21      ARG  35  33.273  15.766   9.635
  286   2HH2  ARG  35          HH22      ARG  35  34.046  14.291  10.162
  287    H    TYR  36           HN       TYR  36  28.553  16.471   7.602
  288    HA   TYR  36           HA       TYR  36  25.792  17.040   6.750
  289   1HB   TYR  36          HB2       TYR  36  27.138  17.267   9.412
  290   2HB   TYR  36          HB1       TYR  36  25.852  18.401   9.018
  291    HD1  TYR  36           HD1      TYR  36  24.553  17.497  10.925
  292    HD2  TYR  36           HD2      TYR  36  25.651  15.053   7.617
  293    HE1  TYR  36           HE1      TYR  36  22.877  15.829  11.600
  294    HE2  TYR  36           HE2      TYR  36  23.976  13.387   8.282
  295    HH   TYR  36           HH       TYR  36  21.512  13.862  10.069
  296   1HN   NH2  37          H1        NH2  37  26.547  20.294   5.751
  297   2HN   NH2  37          H2        NH2  37  25.379  19.027   5.883
  Start of MODEL    5
    1   1H    TYR   1          HT1       TYR   1  23.235  11.580   3.831
    2   2H    TYR   1          HT2       TYR   1  24.060  10.327   4.619
    3   3H    TYR   1          HT3       TYR   1  22.365  10.368   4.640
    4    HA   TYR   1           HA       TYR   1  23.070   8.720   3.108
    5   1HB   TYR   1          HB2       TYR   1  21.827   9.407   1.192
    6   2HB   TYR   1          HB1       TYR   1  21.100  10.219   2.571
    7    HD1  TYR   1           HD1      TYR   1  22.494  10.631  -0.675
    8    HD2  TYR   1           HD2      TYR   1  21.816  12.666   2.998
    9    HE1  TYR   1           HE1      TYR   1  22.753  12.786  -1.830
   10    HE2  TYR   1           HE2      TYR   1  22.074  14.829   1.856
   11    HH   TYR   1           HH       TYR   1  22.084  15.125  -1.543
   12    HA   PRO   2           HA       PRO   2  26.888   9.578   0.957
   13   1HB   PRO   2          HB2       PRO   2  27.335   7.113   0.034
   14   2HB   PRO   2          HB1       PRO   2  27.459   7.472   1.758
   15   1HG   PRO   2          HG2       PRO   2  25.303   6.069   0.265
   16   2HG   PRO   2          HG1       PRO   2  25.898   5.792   1.910
   17   1HD   PRO   2          HD2       PRO   2  23.601   7.252   1.183
   18   2HD   PRO   2          HD1       PRO   2  24.365   7.216   2.781
   19    H    ILE   3           HN       ILE   3  27.656   8.519  -1.398
   20    HA   ILE   3           HA       ILE   3  25.742   9.587  -3.274
   21    HB   ILE   3           HB       ILE   3  27.847  10.229  -3.925
   22   1HG1  ILE   3          HG12      ILE   3  28.568   8.576  -5.843
   23   2HG1  ILE   3          HG11      ILE   3  27.043   7.787  -5.455
   24   1HG2  ILE   3          HG21      ILE   3  29.846   9.144  -3.605
   25   2HG2  ILE   3          HG22      ILE   3  29.118   7.540  -3.688
   26   3HG2  ILE   3          HG23      ILE   3  28.887   8.541  -2.256
   27   1HD1  ILE   3          HD11      ILE   3  27.545  10.187  -6.970
   28   2HD1  ILE   3          HD12      ILE   3  26.402  10.481  -5.658
   29   3HD1  ILE   3          HD13      ILE   3  26.078   9.215  -6.843
   30    H    LYS   4           HN       LYS   4  27.558   6.506  -3.366
   31    HA   LYS   4           HA       LYS   4  25.254   4.895  -3.320
   32   1HB   LYS   4          HB2       LYS   4  24.857   5.804  -5.554
   33   2HB   LYS   4          HB1       LYS   4  26.471   5.320  -6.057
   34   1HG   LYS   4          HG2       LYS   4  25.036   3.060  -5.014
   35   2HG   LYS   4          HG1       LYS   4  24.105   3.855  -6.285
   36   1HD   LYS   4          HD2       LYS   4  26.140   3.778  -7.726
   37   2HD   LYS   4          HD1       LYS   4  26.936   2.826  -6.471
   38   1HE   LYS   4          HE2       LYS   4  24.399   2.058  -7.909
   39   2HE   LYS   4          HE1       LYS   4  26.006   1.431  -8.271
   40   1HZ   LYS   4          HZ1       LYS   4  24.208   0.781  -6.086
   41   2HZ   LYS   4          HZ2       LYS   4  25.849   0.909  -5.666
   42   3HZ   LYS   4          HZ3       LYS   4  25.365  -0.186  -6.869
   43    HA   PRO   5           HA       PRO   5  28.798   2.229  -2.664
   44   1HB   PRO   5          HB2       PRO   5  27.508   0.932  -0.554
   45   2HB   PRO   5          HB1       PRO   5  28.622   2.292  -0.402
   46   1HG   PRO   5          HG2       PRO   5  25.845   2.276   0.179
   47   2HG   PRO   5          HG1       PRO   5  26.930   3.675   0.169
   48   1HD   PRO   5          HD2       PRO   5  25.023   2.743  -1.909
   49   2HD   PRO   5          HD1       PRO   5  25.597   4.387  -1.551
   50    H    GLU   6           HN       GLU   6  27.876  -0.301  -1.472
   51    HA   GLU   6           HA       GLU   6  26.769  -1.522  -3.890
   52   1HB   GLU   6          HB2       GLU   6  28.325  -2.649  -1.562
   53   2HB   GLU   6          HB1       GLU   6  27.542  -3.668  -2.763
   54   1HG   GLU   6          HG2       GLU   6  28.948  -2.920  -4.478
   55   2HG   GLU   6          HG1       GLU   6  29.497  -1.535  -3.536
   56    H    ALA   7           HN       ALA   7  25.896  -3.898  -2.680
   57    HA   ALA   7           HA       ALA   7  23.953  -3.398  -0.653
   58   1HB   ALA   7          HB1       ALA   7  22.805  -3.947  -3.383
   59   2HB   ALA   7          HB2       ALA   7  22.982  -2.306  -2.762
   60   3HB   ALA   7          HB3       ALA   7  21.956  -3.462  -1.912
   61    HA   PRO   8           HA       PRO   8  24.101  -7.885  -0.470
   62   1HB   PRO   8          HB2       PRO   8  21.421  -8.522  -0.210
   63   2HB   PRO   8          HB1       PRO   8  22.474  -8.049   1.126
   64   1HG   PRO   8          HG2       PRO   8  20.527  -6.397  -0.430
   65   2HG   PRO   8          HG1       PRO   8  20.866  -6.388   1.312
   66   1HD   PRO   8          HD2       PRO   8  21.844  -4.492  -0.314
   67   2HD   PRO   8          HD1       PRO   8  22.791  -5.114   1.056
   68    H    GLY   9           HN       GLY   9  23.666  -9.751  -1.808
   69   1HA   GLY   9          HA2       GLY   9  22.839  -8.866  -4.500
   70   2HA   GLY   9          HA1       GLY   9  24.121 -10.029  -4.184
   71    H    GLU  10           HN       GLU  10  22.987 -11.712  -2.365
   72    HA   GLU  10           HA       GLU  10  20.657 -12.719  -3.821
   73   1HB   GLU  10          HB2       GLU  10  23.082 -14.342  -3.047
   74   2HB   GLU  10          HB1       GLU  10  21.588 -15.015  -3.685
   75   1HG   GLU  10          HG2       GLU  10  22.323 -13.044  -5.506
   76   2HG   GLU  10          HG1       GLU  10  23.826 -13.861  -5.075
   77    H    ASP  11           HN       ASP  11  22.624 -13.940  -1.115
   78    HA   ASP  11           HA       ASP  11  20.121 -14.628   0.237
   79   1HB   ASP  11          HB2       ASP  11  21.841 -16.373  -0.124
   80   2HB   ASP  11          HB1       ASP  11  22.966 -15.448   0.860
   81    H    ALA  12           HN       ALA  12  22.800 -12.485   0.467
   82    HA   ALA  12           HA       ALA  12  23.501 -10.941   1.969
   83   1HB   ALA  12          HB1       ALA  12  21.381  -9.896   1.932
   84   2HB   ALA  12          HB2       ALA  12  21.817 -10.057   3.635
   85   3HB   ALA  12          HB3       ALA  12  20.652 -11.170   2.910
   86    H    SER  13           HN       SER  13  24.064 -13.615   2.369
   87    HA   SER  13           HA       SER  13  23.716 -14.583   4.957
   88   1HB   SER  13          HB2       SER  13  26.240 -15.014   3.376
   89   2HB   SER  13          HB1       SER  13  25.371 -16.157   4.402
   90    HG   SER  13           HG       SER  13  23.602 -15.812   2.746
   91    HA   PRO  14           HA       PRO  14  26.121 -12.340   7.845
   92   1HB   PRO  14          HB2       PRO  14  27.975 -14.677   8.089
   93   2HB   PRO  14          HB1       PRO  14  27.176 -13.742   9.357
   94   1HG   PRO  14          HG2       PRO  14  26.250 -16.134   8.663
   95   2HG   PRO  14          HG1       PRO  14  25.132 -14.806   9.037
   96   1HD   PRO  14          HD2       PRO  14  25.870 -15.981   6.404
   97   2HD   PRO  14          HD1       PRO  14  24.333 -15.274   6.937
   98    H    GLU  15           HN       GLU  15  28.126 -14.020   5.409
   99    HA   GLU  15           HA       GLU  15  30.207 -11.995   5.749
  100   1HB   GLU  15          HB2       GLU  15  30.819 -14.383   5.419
  101   2HB   GLU  15          HB1       GLU  15  30.110 -14.316   3.813
  102   1HG   GLU  15          HG2       GLU  15  32.542 -14.112   3.755
  103   2HG   GLU  15          HG1       GLU  15  31.742 -12.675   3.121
  104    H    GLU  16           HN       GLU  16  27.518 -12.669   3.721
  105    HA   GLU  16           HA       GLU  16  28.388 -11.164   1.449
  106   1HB   GLU  16          HB2       GLU  16  26.503 -13.015   1.721
  107   2HB   GLU  16          HB1       GLU  16  25.494 -11.609   2.020
  108   1HG   GLU  16          HG2       GLU  16  26.472 -10.703  -0.182
  109   2HG   GLU  16          HG1       GLU  16  26.974 -12.370  -0.467
  110    H    LEU  17           HN       LEU  17  26.065 -10.570   4.099
  111    HA   LEU  17           HA       LEU  17  25.712  -7.859   3.272
  112   1HB   LEU  17          HB2       LEU  17  24.068  -7.662   4.828
  113   2HB   LEU  17          HB1       LEU  17  24.077  -9.396   4.621
  114    HG   LEU  17           HG       LEU  17  23.762  -9.008   6.902
  115   1HD1  LEU  17          HD11      LEU  17  25.439 -10.737   6.343
  116   2HD1  LEU  17          HD12      LEU  17  25.574 -10.069   7.974
  117   3HD1  LEU  17          HD13      LEU  17  26.700  -9.561   6.712
  118   1HD2  LEU  17          HD21      LEU  17  24.533  -7.303   8.118
  119   2HD2  LEU  17          HD22      LEU  17  24.942  -6.601   6.552
  120   3HD2  LEU  17          HD23      LEU  17  26.173  -7.452   7.487
  121    H    ASN  18           HN       ASN  18  27.941  -9.519   5.293
  122    HA   ASN  18           HA       ASN  18  28.974  -7.215   6.633
  123   1HB   ASN  18          HB2       ASN  18  29.396  -9.414   7.582
  124   2HB   ASN  18          HB1       ASN  18  30.210  -9.931   6.107
  125   1HD2  ASN  18          HD21      ASN  18  32.330  -9.932   6.221
  126   2HD2  ASN  18          HD22      ASN  18  33.296  -8.879   7.213
  127    H    ARG  19           HN       ARG  19  29.773  -9.003   3.697
  128    HA   ARG  19           HA       ARG  19  32.041  -7.626   2.882
  129   1HB   ARG  19          HB2       ARG  19  30.205  -9.436   1.731
  130   2HB   ARG  19          HB1       ARG  19  30.304  -8.072   0.629
  131   1HG   ARG  19          HG2       ARG  19  32.902  -8.435   1.040
  132   2HG   ARG  19          HG1       ARG  19  32.347 -10.078   1.371
  133   1HD   ARG  19          HD2       ARG  19  33.005  -9.580  -1.023
  134   2HD   ARG  19          HD1       ARG  19  31.414 -10.306  -0.785
  135    HE   ARG  19           HE       ARG  19  31.728  -7.390  -1.141
  136   1HH1  ARG  19          HH11      ARG  19  30.363 -10.459  -2.157
  137   2HH1  ARG  19          HH12      ARG  19  29.250  -9.733  -3.270
  138   1HH2  ARG  19          HH21      ARG  19  30.258  -6.436  -2.618
  139   2HH2  ARG  19          HH22      ARG  19  29.195  -7.458  -3.543
  140    H    TYR  20           HN       TYR  20  28.677  -6.948   1.946
  141    HA   TYR  20           HA       TYR  20  29.227  -4.473   0.714
  142   1HB   TYR  20          HB2       TYR  20  27.128  -4.876   0.042
  143   2HB   TYR  20          HB1       TYR  20  26.945  -6.127   1.262
  144    HD1  TYR  20           HD1      TYR  20  25.842  -5.629   3.389
  145    HD2  TYR  20           HD2      TYR  20  26.245  -2.654   0.373
  146    HE1  TYR  20           HE1      TYR  20  24.138  -4.259   4.520
  147    HE2  TYR  20           HE2      TYR  20  24.545  -1.280   1.492
  148    HH   TYR  20           HH       TYR  20  23.674  -1.062   3.930
  149    H    TYR  21           HN       TYR  21  28.555  -5.364   4.012
  150    HA   TYR  21           HA       TYR  21  27.917  -2.885   5.126
  151   1HB   TYR  21          HB2       TYR  21  28.030  -5.393   6.063
  152   2HB   TYR  21          HB1       TYR  21  29.541  -4.782   6.723
  153    HD1  TYR  21           HD1      TYR  21  25.888  -4.183   6.624
  154    HD2  TYR  21           HD2      TYR  21  29.565  -3.444   8.616
  155    HE1  TYR  21           HE1      TYR  21  24.658  -3.195   8.499
  156    HE2  TYR  21           HE2      TYR  21  28.364  -2.445  10.497
  157    HH   TYR  21           HH       TYR  21  24.804  -2.176  10.470
  158    H    ALA  22           HN       ALA  22  31.052  -4.579   5.234
  159    HA   ALA  22           HA       ALA  22  32.372  -2.325   6.363
  160   1HB   ALA  22          HB1       ALA  22  34.442  -3.705   5.911
  161   2HB   ALA  22          HB2       ALA  22  33.360  -4.938   5.266
  162   3HB   ALA  22          HB3       ALA  22  33.218  -4.435   6.953
  163    H    SER  23           HN       SER  23  31.775  -3.406   3.120
  164    HA   SER  23           HA       SER  23  33.709  -1.696   1.890
  165   1HB   SER  23          HB2       SER  23  31.188  -2.894   0.714
  166   2HB   SER  23          HB1       SER  23  32.512  -2.168  -0.196
  167    HG   SER  23           HG       SER  23  32.567  -4.528   1.380
  168    H    LEU  24           HN       LEU  24  30.480  -1.278   3.108
  169    HA   LEU  24           HA       LEU  24  29.979   1.258   1.932
  170   1HB   LEU  24          HB2       LEU  24  28.442  -0.513   3.281
  171   2HB   LEU  24          HB1       LEU  24  28.812   0.609   4.578
  172    HG   LEU  24           HG       LEU  24  27.876   1.856   2.077
  173   1HD1  LEU  24          HD11      LEU  24  26.056   0.157   3.775
  174   2HD1  LEU  24          HD12      LEU  24  26.454  -0.098   2.075
  175   3HD1  LEU  24          HD13      LEU  24  25.522   1.319   2.562
  176   1HD2  LEU  24          HD21      LEU  24  27.717   2.260   4.998
  177   2HD2  LEU  24          HD22      LEU  24  26.339   2.820   4.054
  178   3HD2  LEU  24          HD23      LEU  24  27.958   3.438   3.704
  179    H    ARG  25           HN       ARG  25  31.318   0.078   4.975
  180    HA   ARG  25           HA       ARG  25  31.811   2.599   6.139
  181   1HB   ARG  25          HB2       ARG  25  31.979   0.124   7.090
  182   2HB   ARG  25          HB1       ARG  25  33.671   0.316   6.655
  183   1HG   ARG  25          HG2       ARG  25  33.042   0.884   9.033
  184   2HG   ARG  25          HG1       ARG  25  33.958   2.111   8.154
  185   1HD   ARG  25          HD2       ARG  25  31.067   2.370   7.854
  186   2HD   ARG  25          HD1       ARG  25  31.612   2.525   9.526
  187    HE   ARG  25           HE       ARG  25  33.305   4.121   8.036
  188   1HH1  ARG  25          HH11      ARG  25  29.870   3.966   8.736
  189   2HH1  ARG  25          HH12      ARG  25  29.608   5.667   8.473
  190   1HH2  ARG  25          HH21      ARG  25  32.964   6.367   7.689
  191   2HH2  ARG  25          HH22      ARG  25  31.357   7.023   7.859
  192    H    HIS  26           HN       HIS  26  33.701   0.546   3.992
  193    HA   HIS  26           HA       HIS  26  36.028   2.178   3.965
  194   1HB   HIS  26          HB2       HIS  26  35.073  -0.206   2.575
  195   2HB   HIS  26          HB1       HIS  26  35.966   0.869   1.510
  196    HD1  HIS  26           HD1      HIS  26  36.763  -2.028   2.902
  197    HD2  HIS  26           HD2      HIS  26  38.327   1.759   3.654
  198    HE1  HIS  26           HE1      HIS  26  39.045  -2.415   3.881
  199    HE2  HIS  26           HE2      HIS  26  40.034  -0.119   4.195
  200    H    TYR  27           HN       TYR  27  33.298   1.826   1.737
  201    HA   TYR  27           HA       TYR  27  33.979   3.781  -0.111
  202   1HB   TYR  27          HB2       TYR  27  32.051   2.094  -0.192
  203   2HB   TYR  27          HB1       TYR  27  31.147   3.246   0.785
  204    HD1  TYR  27           HD1      TYR  27  33.320   3.429  -2.257
  205    HD2  TYR  27           HD2      TYR  27  29.612   4.487  -0.442
  206    HE1  TYR  27           HE1      TYR  27  32.657   4.623  -4.303
  207    HE2  TYR  27           HE2      TYR  27  28.956   5.685  -2.469
  208    HH   TYR  27           HH       TYR  27  30.012   5.274  -5.277
  209    H    LEU  28           HN       LEU  28  31.950   4.054   2.794
  210    HA   LEU  28           HA       LEU  28  31.436   6.826   2.500
  211   1HB   LEU  28          HB2       LEU  28  31.128   4.819   4.652
  212   2HB   LEU  28          HB1       LEU  28  31.182   6.494   5.162
  213    HG   LEU  28           HG       LEU  28  29.251   7.032   3.826
  214   1HD1  LEU  28          HD11      LEU  28  28.247   4.612   2.904
  215   2HD1  LEU  28          HD12      LEU  28  29.940   4.627   2.413
  216   3HD1  LEU  28          HD13      LEU  28  28.874   5.949   1.937
  217   1HD2  LEU  28          HD21      LEU  28  27.819   6.240   5.332
  218   2HD2  LEU  28          HD22      LEU  28  29.224   5.447   6.044
  219   3HD2  LEU  28          HD23      LEU  28  28.184   4.562   4.928
  220    H    ASN  29           HN       ASN  29  34.064   5.083   4.025
  221    HA   ASN  29           HA       ASN  29  35.200   7.336   5.360
  222   1HB   ASN  29          HB2       ASN  29  35.601   4.682   5.574
  223   2HB   ASN  29          HB1       ASN  29  36.963   5.091   4.539
  224   1HD2  ASN  29          HD21      ASN  29  37.871   4.150   6.679
  225   2HD2  ASN  29          HD22      ASN  29  38.353   5.345   7.842
  226    H    LEU  30           HN       LEU  30  35.420   6.052   2.138
  227    HA   LEU  30           HA       LEU  30  37.800   7.569   1.521
  228   1HB   LEU  30          HB2       LEU  30  36.440   5.324   0.424
  229   2HB   LEU  30          HB1       LEU  30  36.599   6.541  -0.827
  230    HG   LEU  30           HG       LEU  30  38.493   4.665  -0.143
  231   1HD1  LEU  30          HD11      LEU  30  39.892   5.797  -1.727
  232   2HD1  LEU  30          HD12      LEU  30  39.030   7.316  -1.475
  233   3HD1  LEU  30          HD13      LEU  30  38.217   5.960  -2.256
  234   1HD2  LEU  30          HD21      LEU  30  39.428   7.329   0.929
  235   2HD2  LEU  30          HD22      LEU  30  40.372   5.839   0.823
  236   3HD2  LEU  30          HD23      LEU  30  38.998   5.939   1.926
  237    H    VAL  31           HN       VAL  31  34.379   7.609   0.447
  238    HA   VAL  31           HA       VAL  31  34.856   9.757  -1.384
  239    HB   VAL  31           HB       VAL  31  32.109   9.037  -0.400
  240   1HG1  VAL  31          HG11      VAL  31  32.241  10.892  -1.942
  241   2HG1  VAL  31          HG12      VAL  31  31.535   9.501  -2.768
  242   3HG1  VAL  31          HG13      VAL  31  33.219   9.938  -3.058
  243   1HG2  VAL  31          HG21      VAL  31  32.341   7.415  -2.512
  244   2HG2  VAL  31          HG22      VAL  31  32.671   6.888  -0.863
  245   3HG2  VAL  31          HG23      VAL  31  34.000   7.349  -1.923
  246    H    THR  32           HN       THR  32  34.964   9.906   1.832
  247    HA   THR  32           HA       THR  32  33.541  12.411   2.156
  248    HB   THR  32           HB       THR  32  35.088  12.177   4.393
  249    HG1  THR  32           HG1      THR  32  34.304   9.513   4.068
  250   1HG2  THR  32          HG21      THR  32  32.765  10.498   4.675
  251   2HG2  THR  32          HG22      THR  32  32.389  11.914   3.696
  252   3HG2  THR  32          HG23      THR  32  33.056  12.116   5.315
  253    H    ARG  33           HN       ARG  33  36.338  11.541   0.701
  254    HA   ARG  33           HA       ARG  33  37.414  14.206   0.743
  255   1HB   ARG  33          HB2       ARG  33  39.736  13.294   1.441
  256   2HB   ARG  33          HB1       ARG  33  38.561  13.675   2.689
  257   1HG   ARG  33          HG2       ARG  33  37.968  11.089   2.305
  258   2HG   ARG  33          HG1       ARG  33  39.680  11.075   1.873
  259   1HD   ARG  33          HD2       ARG  33  40.281  11.217   4.009
  260   2HD   ARG  33          HD1       ARG  33  39.271  12.642   4.244
  261    HE   ARG  33           HE       ARG  33  37.529  10.521   4.281
  262   1HH1  ARG  33          HH11      ARG  33  40.396  11.441   6.065
  263   2HH1  ARG  33          HH12      ARG  33  39.900  10.631   7.519
  264   1HH2  ARG  33          HH21      ARG  33  36.845   9.509   6.201
  265   2HH2  ARG  33          HH22      ARG  33  37.857   9.552   7.611
  266    H    GLN  34           HN       GLN  34  37.649  10.863  -0.254
  267    HA   GLN  34           HA       GLN  34  38.164   9.892  -2.230
  268   1HB   GLN  34          HB2       GLN  34  37.254  11.788  -3.451
  269   2HB   GLN  34          HB1       GLN  34  38.735  12.701  -3.198
  270   1HG   GLN  34          HG2       GLN  34  38.576  11.798  -5.463
  271   2HG   GLN  34          HG1       GLN  34  39.967  11.160  -4.589
  272   1HE2  GLN  34          HE21      GLN  34  40.148   9.004  -4.300
  273   2HE2  GLN  34          HE22      GLN  34  38.993   7.839  -4.852
  274    H    ARG  35           HN       ARG  35  40.479  12.556  -1.673
  275    HA   ARG  35           HA       ARG  35  42.740  12.600  -1.536
  276   1HB   ARG  35          HB2       ARG  35  41.880  10.266  -0.009
  277   2HB   ARG  35          HB1       ARG  35  43.528  10.110  -0.599
  278   1HG   ARG  35          HG2       ARG  35  42.971  12.721   0.559
  279   2HG   ARG  35          HG1       ARG  35  42.756  11.387   1.695
  280   1HD   ARG  35          HD2       ARG  35  45.093  10.745   0.386
  281   2HD   ARG  35          HD1       ARG  35  45.193  12.497   0.546
  282    HE   ARG  35           HE       ARG  35  44.771  12.103   2.990
  283   1HH1  ARG  35          HH11      ARG  35  46.238   9.644   0.974
  284   2HH1  ARG  35          HH12      ARG  35  47.079   8.870   2.279
  285   1HH2  ARG  35          HH21      ARG  35  45.899  11.119   4.722
  286   2HH2  ARG  35          HH22      ARG  35  46.897   9.722   4.420
  287    H    TYR  36           HN       TYR  36  43.701   9.428  -1.786
  288    HA   TYR  36           HA       TYR  36  43.537   9.086  -4.614
  289   1HB   TYR  36          HB2       TYR  36  45.590   9.753  -5.329
  290   2HB   TYR  36          HB1       TYR  36  45.484  10.833  -3.947
  291    HD1  TYR  36           HD1      TYR  36  47.468   8.441  -5.587
  292    HD2  TYR  36           HD2      TYR  36  46.465   9.844  -1.692
  293    HE1  TYR  36           HE1      TYR  36  49.563   7.498  -4.714
  294    HE2  TYR  36           HE2      TYR  36  48.557   8.898  -0.813
  295    HH   TYR  36           HH       TYR  36  50.983   7.486  -2.949
  296   1HN   NH2  37          H1        NH2  37  44.891   5.823  -4.085
  297   2HN   NH2  37          H2        NH2  37  44.665   7.057  -5.276
  Start of MODEL    6
    1   1H    TYR   1          HT1       TYR   1  35.885   5.773  -5.800
    2   2H    TYR   1          HT2       TYR   1  34.328   5.157  -6.078
    3   3H    TYR   1          HT3       TYR   1  34.755   6.685  -6.674
    4    HA   TYR   1           HA       TYR   1  34.940   5.459  -8.542
    5   1HB   TYR   1          HB2       TYR   1  37.386   6.136  -7.263
    6   2HB   TYR   1          HB1       TYR   1  37.630   4.626  -8.135
    7    HD1  TYR   1           HD1      TYR   1  38.562   4.932 -10.216
    8    HD2  TYR   1           HD2      TYR   1  35.754   7.792  -8.789
    9    HE1  TYR   1           HE1      TYR   1  38.769   6.180 -12.327
   10    HE2  TYR   1           HE2      TYR   1  35.955   9.047 -10.889
   11    HH   TYR   1           HH       TYR   1  37.361   7.797 -13.661
   12    HA   PRO   2           HA       PRO   2  36.261   0.883  -7.011
   13   1HB   PRO   2          HB2       PRO   2  34.923   0.733  -4.502
   14   2HB   PRO   2          HB1       PRO   2  36.646   0.525  -4.813
   15   1HG   PRO   2          HG2       PRO   2  35.175   2.892  -3.830
   16   2HG   PRO   2          HG1       PRO   2  36.862   2.423  -3.570
   17   1HD   PRO   2          HD2       PRO   2  36.178   4.450  -5.197
   18   2HD   PRO   2          HD1       PRO   2  37.568   3.398  -5.537
   19    H    ILE   3           HN       ILE   3  34.713  -0.833  -7.007
   20    HA   ILE   3           HA       ILE   3  32.737  -0.512  -8.771
   21    HB   ILE   3           HB       ILE   3  33.419  -2.693  -8.282
   22   1HG1  ILE   3          HG12      ILE   3  31.009  -3.603  -7.285
   23   2HG1  ILE   3          HG11      ILE   3  30.592  -2.043  -7.993
   24   1HG2  ILE   3          HG21      ILE   3  32.186  -3.087  -5.670
   25   2HG2  ILE   3          HG22      ILE   3  33.528  -1.945  -5.663
   26   3HG2  ILE   3          HG23      ILE   3  33.768  -3.585  -6.269
   27   1HD1  ILE   3          HD11      ILE   3  32.098  -4.199  -9.448
   28   2HD1  ILE   3          HD12      ILE   3  31.429  -2.712 -10.118
   29   3HD1  ILE   3          HD13      ILE   3  30.349  -3.974  -9.530
   30    H    LYS   4           HN       LYS   4  31.602  -1.214  -5.468
   31    HA   LYS   4           HA       LYS   4  30.121   0.977  -4.826
   32   1HB   LYS   4          HB2       LYS   4  28.967  -0.280  -7.133
   33   2HB   LYS   4          HB1       LYS   4  27.877  -0.500  -5.773
   34   1HG   LYS   4          HG2       LYS   4  27.814   1.895  -5.399
   35   2HG   LYS   4          HG1       LYS   4  28.978   2.146  -6.701
   36   1HD   LYS   4          HD2       LYS   4  26.171   1.068  -6.949
   37   2HD   LYS   4          HD1       LYS   4  26.777   2.613  -7.543
   38   1HE   LYS   4          HE2       LYS   4  27.627  -0.122  -8.497
   39   2HE   LYS   4          HE1       LYS   4  26.571   0.994  -9.359
   40   1HZ   LYS   4          HZ1       LYS   4  28.579   1.406 -10.341
   41   2HZ   LYS   4          HZ2       LYS   4  29.475   1.147  -8.921
   42   3HZ   LYS   4          HZ3       LYS   4  28.598   2.583  -9.125
   43    HA   PRO   5           HA       PRO   5  28.887  -2.028  -1.674
   44   1HB   PRO   5          HB2       PRO   5  27.205  -0.478  -0.242
   45   2HB   PRO   5          HB1       PRO   5  28.958  -0.262  -0.170
   46   1HG   PRO   5          HG2       PRO   5  26.915   1.293  -1.697
   47   2HG   PRO   5          HG1       PRO   5  28.325   1.879  -0.797
   48   1HD   PRO   5          HD2       PRO   5  28.273   1.573  -3.521
   49   2HD   PRO   5          HD1       PRO   5  29.753   1.492  -2.546
   50    H    GLU   6           HN       GLU   6  27.828  -3.238  -3.387
   51    HA   GLU   6           HA       GLU   6  25.455  -2.564  -4.644
   52   1HB   GLU   6          HB2       GLU   6  25.274  -5.119  -5.007
   53   2HB   GLU   6          HB1       GLU   6  26.654  -4.260  -5.675
   54   1HG   GLU   6          HG2       GLU   6  28.012  -5.638  -4.616
   55   2HG   GLU   6          HG1       GLU   6  27.372  -5.075  -3.073
   56    H    ALA   7           HN       ALA   7  25.926  -4.202  -1.580
   57    HA   ALA   7           HA       ALA   7  24.527  -4.751   0.117
   58   1HB   ALA   7          HB1       ALA   7  22.080  -3.765  -0.156
   59   2HB   ALA   7          HB2       ALA   7  22.889  -2.754  -1.353
   60   3HB   ALA   7          HB3       ALA   7  23.446  -2.755   0.320
   61    HA   PRO   8           HA       PRO   8  22.953  -8.337  -2.031
   62   1HB   PRO   8          HB2       PRO   8  23.186 -10.063   0.007
   63   2HB   PRO   8          HB1       PRO   8  24.601  -9.445  -0.855
   64   1HG   PRO   8          HG2       PRO   8  23.460  -8.573   1.772
   65   2HG   PRO   8          HG1       PRO   8  25.152  -8.849   1.321
   66   1HD   PRO   8          HD2       PRO   8  23.988  -6.371   1.404
   67   2HD   PRO   8          HD1       PRO   8  25.357  -6.783   0.351
   68    H    GLY   9           HN       GLY   9  21.072  -6.380  -0.903
   69   1HA   GLY   9          HA2       GLY   9  18.730  -6.508  -0.950
   70   2HA   GLY   9          HA1       GLY   9  18.843  -8.234  -0.637
   71    H    GLU  10           HN       GLU  10  20.865  -6.716   1.453
   72    HA   GLU  10           HA       GLU  10  20.889  -6.334   3.672
   73   1HB   GLU  10          HB2       GLU  10  17.983  -5.583   3.393
   74   2HB   GLU  10          HB1       GLU  10  19.083  -5.099   4.676
   75   1HG   GLU  10          HG2       GLU  10  19.343  -4.319   1.778
   76   2HG   GLU  10          HG1       GLU  10  18.668  -3.308   3.054
   77    H    ASP  11           HN       ASP  11  19.685  -8.852   2.400
   78    HA   ASP  11           HA       ASP  11  19.240 -10.250   4.885
   79   1HB   ASP  11          HB2       ASP  11  16.955  -9.436   4.222
   80   2HB   ASP  11          HB1       ASP  11  17.118 -10.338   2.719
   81    H    ALA  12           HN       ALA  12  21.213 -11.214   4.225
   82    HA   ALA  12           HA       ALA  12  20.977 -13.183   2.082
   83   1HB   ALA  12          HB1       ALA  12  22.976 -12.381   0.937
   84   2HB   ALA  12          HB2       ALA  12  23.072 -11.016   2.056
   85   3HB   ALA  12          HB3       ALA  12  21.706 -11.154   0.942
   86    H    SER  13           HN       SER  13  23.760 -13.644   1.842
   87    HA   SER  13           HA       SER  13  24.303 -15.259   4.087
   88   1HB   SER  13          HB2       SER  13  26.707 -14.679   2.677
   89   2HB   SER  13          HB1       SER  13  25.727 -16.142   2.598
   90    HG   SER  13           HG       SER  13  26.134 -14.568   0.638
   91    HA   PRO  14           HA       PRO  14  25.852 -12.454   7.070
   92   1HB   PRO  14          HB2       PRO  14  27.925 -14.030   8.056
   93   2HB   PRO  14          HB1       PRO  14  26.241 -14.087   8.589
   94   1HG   PRO  14          HG2       PRO  14  27.678 -15.840   6.643
   95   2HG   PRO  14          HG1       PRO  14  26.455 -16.272   7.852
   96   1HD   PRO  14          HD2       PRO  14  25.836 -16.086   5.262
   97   2HD   PRO  14          HD1       PRO  14  24.702 -15.536   6.518
   98    H    GLU  15           HN       GLU  15  28.344 -14.121   5.142
   99    HA   GLU  15           HA       GLU  15  30.301 -12.092   5.583
  100   1HB   GLU  15          HB2       GLU  15  30.124 -14.559   3.929
  101   2HB   GLU  15          HB1       GLU  15  31.303 -13.345   3.452
  102   1HG   GLU  15          HG2       GLU  15  31.122 -14.696   6.132
  103   2HG   GLU  15          HG1       GLU  15  32.318 -15.007   4.876
  104    H    GLU  16           HN       GLU  16  27.771 -12.577   3.253
  105    HA   GLU  16           HA       GLU  16  28.761 -10.745   1.300
  106   1HB   GLU  16          HB2       GLU  16  26.435 -12.424   1.634
  107   2HB   GLU  16          HB1       GLU  16  25.957 -10.815   1.109
  108   1HG   GLU  16          HG2       GLU  16  26.300 -12.283  -0.788
  109   2HG   GLU  16          HG1       GLU  16  27.483 -10.973  -0.782
  110    H    LEU  17           HN       LEU  17  26.371 -10.606   3.893
  111    HA   LEU  17           HA       LEU  17  25.820  -7.852   3.634
  112   1HB   LEU  17          HB2       LEU  17  24.464  -9.569   4.900
  113   2HB   LEU  17          HB1       LEU  17  25.664  -9.457   6.180
  114    HG   LEU  17           HG       LEU  17  25.094  -6.872   6.019
  115   1HD1  LEU  17          HD11      LEU  17  22.589  -8.218   5.015
  116   2HD1  LEU  17          HD12      LEU  17  23.574  -7.042   4.148
  117   3HD1  LEU  17          HD13      LEU  17  22.686  -6.553   5.590
  118   1HD2  LEU  17          HD21      LEU  17  24.854  -8.367   7.985
  119   2HD2  LEU  17          HD22      LEU  17  23.256  -8.828   7.396
  120   3HD2  LEU  17          HD23      LEU  17  23.576  -7.158   7.862
  121    H    ASN  18           HN       ASN  18  28.181  -9.652   5.550
  122    HA   ASN  18           HA       ASN  18  29.318  -7.468   6.919
  123   1HB   ASN  18          HB2       ASN  18  29.818  -9.657   7.717
  124   2HB   ASN  18          HB1       ASN  18  30.389 -10.181   6.137
  125   1HD2  ASN  18          HD21      ASN  18  32.459 -10.632   6.334
  126   2HD2  ASN  18          HD22      ASN  18  33.640  -9.614   7.094
  127    H    ARG  19           HN       ARG  19  30.000  -8.919   3.770
  128    HA   ARG  19           HA       ARG  19  32.301  -7.443   3.141
  129   1HB   ARG  19          HB2       ARG  19  30.338  -9.048   1.676
  130   2HB   ARG  19          HB1       ARG  19  31.065  -7.770   0.709
  131   1HG   ARG  19          HG2       ARG  19  33.303  -8.608   1.381
  132   2HG   ARG  19          HG1       ARG  19  32.506  -9.949   2.203
  133   1HD   ARG  19          HD2       ARG  19  31.863  -9.435  -0.658
  134   2HD   ARG  19          HD1       ARG  19  33.407 -10.187  -0.260
  135    HE   ARG  19           HE       ARG  19  30.811 -11.399  -0.154
  136   1HH1  ARG  19          HH11      ARG  19  34.024 -11.496   1.249
  137   2HH1  ARG  19          HH12      ARG  19  33.885 -13.145   1.768
  138   1HH2  ARG  19          HH21      ARG  19  30.630 -13.554   0.497
  139   2HH2  ARG  19          HH22      ARG  19  31.956 -14.333   1.326
  140    H    TYR  20           HN       TYR  20  28.929  -6.806   2.162
  141    HA   TYR  20           HA       TYR  20  29.451  -4.284   1.019
  142   1HB   TYR  20          HB2       TYR  20  27.339  -4.605   0.342
  143   2HB   TYR  20          HB1       TYR  20  27.173  -5.958   1.451
  144    HD1  TYR  20           HD1      TYR  20  26.104  -5.657   3.632
  145    HD2  TYR  20           HD2      TYR  20  26.435  -2.423   0.878
  146    HE1  TYR  20           HE1      TYR  20  24.425  -4.401   4.918
  147    HE2  TYR  20           HE2      TYR  20  24.758  -1.154   2.158
  148    HH   TYR  20           HH       TYR  20  22.650  -2.343   4.080
  149    H    TYR  21           HN       TYR  21  28.697  -5.300   4.267
  150    HA   TYR  21           HA       TYR  21  28.090  -2.985   5.603
  151   1HB   TYR  21          HB2       TYR  21  28.707  -5.559   6.272
  152   2HB   TYR  21          HB1       TYR  21  30.092  -4.697   6.923
  153    HD1  TYR  21           HD1      TYR  21  29.953  -3.572   8.952
  154    HD2  TYR  21           HD2      TYR  21  26.393  -4.860   7.019
  155    HE1  TYR  21           HE1      TYR  21  28.683  -3.047  10.975
  156    HE2  TYR  21           HE2      TYR  21  25.095  -4.329   9.038
  157    HH   TYR  21           HH       TYR  21  25.740  -2.466  11.219
  158    H    ALA  22           HN       ALA  22  31.366  -4.348   5.556
  159    HA   ALA  22           HA       ALA  22  32.516  -1.940   6.528
  160   1HB   ALA  22          HB1       ALA  22  33.486  -4.070   7.070
  161   2HB   ALA  22          HB2       ALA  22  34.660  -3.095   6.190
  162   3HB   ALA  22          HB3       ALA  22  33.806  -4.398   5.367
  163    H    SER  23           HN       SER  23  32.043  -3.271   3.323
  164    HA   SER  23           HA       SER  23  33.851  -1.603   1.946
  165   1HB   SER  23          HB2       SER  23  31.282  -2.890   0.998
  166   2HB   SER  23          HB1       SER  23  32.459  -2.112  -0.060
  167    HG   SER  23           HG       SER  23  32.729  -4.460   1.477
  168    H    LEU  24           HN       LEU  24  30.457  -1.152   2.842
  169    HA   LEU  24           HA       LEU  24  30.126   1.309   1.485
  170   1HB   LEU  24          HB2       LEU  24  28.067   0.446   1.896
  171   2HB   LEU  24          HB1       LEU  24  28.587  -0.377   3.350
  172    HG   LEU  24           HG       LEU  24  28.550   2.438   3.861
  173   1HD1  LEU  24          HD11      LEU  24  26.973   2.854   2.195
  174   2HD1  LEU  24          HD12      LEU  24  25.998   2.604   3.646
  175   3HD1  LEU  24          HD13      LEU  24  26.156   1.312   2.453
  176   1HD2  LEU  24          HD21      LEU  24  28.012   0.075   5.159
  177   2HD2  LEU  24          HD22      LEU  24  26.419   0.821   5.014
  178   3HD2  LEU  24          HD23      LEU  24  27.737   1.693   5.804
  179    H    ARG  25           HN       ARG  25  31.045   0.351   4.749
  180    HA   ARG  25           HA       ARG  25  31.192   2.901   5.901
  181   1HB   ARG  25          HB2       ARG  25  32.359   0.243   6.450
  182   2HB   ARG  25          HB1       ARG  25  33.239   1.609   7.125
  183   1HG   ARG  25          HG2       ARG  25  31.826   1.589   8.825
  184   2HG   ARG  25          HG1       ARG  25  30.549   2.086   7.709
  185   1HD   ARG  25          HD2       ARG  25  30.524  -0.502   7.169
  186   2HD   ARG  25          HD1       ARG  25  31.192  -0.604   8.798
  187    HE   ARG  25           HE       ARG  25  28.523   0.295   8.045
  188   1HH1  ARG  25          HH11      ARG  25  30.918  -0.187  10.559
  189   2HH1  ARG  25          HH12      ARG  25  29.758  -0.081  11.850
  190   1HH2  ARG  25          HH21      ARG  25  26.996   0.414   9.747
  191   2HH2  ARG  25          HH22      ARG  25  27.546   0.262  11.395
  192    H    HIS  26           HN       HIS  26  33.796   0.970   4.415
  193    HA   HIS  26           HA       HIS  26  35.722   3.026   4.588
  194   1HB   HIS  26          HB2       HIS  26  36.142   0.521   4.261
  195   2HB   HIS  26          HB1       HIS  26  35.804   0.801   2.554
  196    HD1  HIS  26           HD1      HIS  26  37.909   0.998   1.289
  197    HD2  HIS  26           HD2      HIS  26  38.225   2.667   5.085
  198    HE1  HIS  26           HE1      HIS  26  40.217   1.998   1.403
  199    HE2  HIS  26           HE2      HIS  26  40.303   3.179   3.633
  200    H    TYR  27           HN       TYR  27  33.489   2.064   2.025
  201    HA   TYR  27           HA       TYR  27  34.441   3.816   0.053
  202   1HB   TYR  27          HB2       TYR  27  32.596   1.930  -0.050
  203   2HB   TYR  27          HB1       TYR  27  31.507   3.271   0.291
  204    HD1  TYR  27           HD1      TYR  27  31.969   5.419  -1.258
  205    HD2  TYR  27           HD2      TYR  27  32.960   1.404  -2.255
  206    HE1  TYR  27           HE1      TYR  27  31.996   6.026  -3.632
  207    HE2  TYR  27           HE2      TYR  27  32.992   2.001  -4.639
  208    HH   TYR  27           HH       TYR  27  32.408   3.586  -6.155
  209    H    LEU  28           HN       LEU  28  31.787   4.199   2.395
  210    HA   LEU  28           HA       LEU  28  31.252   6.869   1.540
  211   1HB   LEU  28          HB2       LEU  28  30.353   5.326   3.965
  212   2HB   LEU  28          HB1       LEU  28  29.807   6.952   3.604
  213    HG   LEU  28           HG       LEU  28  29.044   4.378   2.358
  214   1HD1  LEU  28          HD11      LEU  28  27.201   5.150   3.353
  215   2HD1  LEU  28          HD12      LEU  28  27.056   6.198   1.940
  216   3HD1  LEU  28          HD13      LEU  28  27.811   6.805   3.416
  217   1HD2  LEU  28          HD21      LEU  28  28.269   5.852   0.326
  218   2HD2  LEU  28          HD22      LEU  28  29.874   5.114   0.345
  219   3HD2  LEU  28          HD23      LEU  28  29.680   6.817   0.764
  220    H    ASN  29           HN       ASN  29  33.698   5.668   3.581
  221    HA   ASN  29           HA       ASN  29  34.162   8.451   4.455
  222   1HB   ASN  29          HB2       ASN  29  34.927   7.796   6.505
  223   2HB   ASN  29          HB1       ASN  29  33.835   6.458   6.202
  224   1HD2  ASN  29          HD21      ASN  29  34.639   4.437   5.895
  225   2HD2  ASN  29          HD22      ASN  29  36.300   4.022   6.181
  226    H    LEU  30           HN       LEU  30  35.127   6.417   2.116
  227    HA   LEU  30           HA       LEU  30  37.825   7.438   2.088
  228   1HB   LEU  30          HB2       LEU  30  37.528   5.339   0.996
  229   2HB   LEU  30          HB1       LEU  30  36.155   5.937   0.078
  230    HG   LEU  30           HG       LEU  30  37.623   7.416  -1.171
  231   1HD1  LEU  30          HD11      LEU  30  39.963   6.062   0.136
  232   2HD1  LEU  30          HD12      LEU  30  39.296   7.575   0.758
  233   3HD1  LEU  30          HD13      LEU  30  39.955   7.504  -0.880
  234   1HD2  LEU  30          HD21      LEU  30  39.061   5.531  -2.222
  235   2HD2  LEU  30          HD22      LEU  30  37.302   5.421  -2.303
  236   3HD2  LEU  30          HD23      LEU  30  38.191   4.484  -1.100
  237    H    VAL  31           HN       VAL  31  34.646   8.198   0.885
  238    HA   VAL  31           HA       VAL  31  35.501  10.401  -0.736
  239    HB   VAL  31           HB       VAL  31  33.003  11.014  -0.623
  240   1HG1  VAL  31          HG11      VAL  31  33.957  10.024  -2.581
  241   2HG1  VAL  31          HG12      VAL  31  32.433   9.206  -2.235
  242   3HG1  VAL  31          HG13      VAL  31  33.963   8.429  -1.830
  243   1HG2  VAL  31          HG21      VAL  31  32.820   8.204   0.451
  244   2HG2  VAL  31          HG22      VAL  31  31.483   9.282   0.051
  245   3HG2  VAL  31          HG23      VAL  31  32.544   9.661   1.408
  246    H    THR  32           HN       THR  32  36.866  11.255   0.984
  247    HA   THR  32           HA       THR  32  37.301  13.263   2.017
  248    HB   THR  32           HB       THR  32  34.296  13.490   1.859
  249    HG1  THR  32           HG1      THR  32  34.998  14.344   0.058
  250   1HG2  THR  32          HG21      THR  32  36.097  15.463   3.265
  251   2HG2  THR  32          HG22      THR  32  34.875  14.445   4.027
  252   3HG2  THR  32          HG23      THR  32  34.391  15.705   2.891
  253    H    ARG  33           HN       ARG  33  35.926  10.529   3.050
  254    HA   ARG  33           HA       ARG  33  35.633   9.427   4.998
  255   1HB   ARG  33          HB2       ARG  33  37.974  10.566   5.309
  256   2HB   ARG  33          HB1       ARG  33  37.122  11.571   6.481
  257   1HG   ARG  33          HG2       ARG  33  36.417   8.910   7.054
  258   2HG   ARG  33          HG1       ARG  33  38.159   8.924   6.770
  259   1HD   ARG  33          HD2       ARG  33  37.933   9.352   9.063
  260   2HD   ARG  33          HD1       ARG  33  38.227  10.933   8.338
  261    HE   ARG  33           HE       ARG  33  35.493  10.649   8.401
  262   1HH1  ARG  33          HH11      ARG  33  38.093  10.704  10.753
  263   2HH1  ARG  33          HH12      ARG  33  37.093  11.330  12.035
  264   1HH2  ARG  33          HH21      ARG  33  34.187  11.458  10.066
  265   2HH2  ARG  33          HH22      ARG  33  34.852  11.737  11.645
  266    H    GLN  34           HN       GLN  34  33.995  11.763   4.059
  267    HA   GLN  34           HA       GLN  34  32.239  13.067   4.684
  268   1HB   GLN  34          HB2       GLN  34  32.029  10.583   6.226
  269   2HB   GLN  34          HB1       GLN  34  31.124  11.924   6.914
  270   1HG   GLN  34          HG2       GLN  34  29.935  12.235   4.825
  271   2HG   GLN  34          HG1       GLN  34  30.888  10.952   4.075
  272   1HE2  GLN  34          HE21      GLN  34  30.481   8.825   4.612
  273   2HE2  GLN  34          HE22      GLN  34  29.030   8.337   5.422
  274    H    ARG  35           HN       ARG  35  34.849  13.729   5.872
  275    HA   ARG  35           HA       ARG  35  34.055  14.794   8.486
  276   1HB   ARG  35          HB2       ARG  35  36.295  13.439   7.842
  277   2HB   ARG  35          HB1       ARG  35  36.854  15.084   7.563
  278   1HG   ARG  35          HG2       ARG  35  35.786  15.494   9.931
  279   2HG   ARG  35          HG1       ARG  35  36.050  13.755  10.096
  280   1HD   ARG  35          HD2       ARG  35  38.007  14.721  10.939
  281   2HD   ARG  35          HD1       ARG  35  38.433  14.232   9.299
  282    HE   ARG  35           HE       ARG  35  38.509  16.472   8.659
  283   1HH1  ARG  35          HH11      ARG  35  37.573  16.150  12.020
  284   2HH1  ARG  35          HH12      ARG  35  37.819  17.837  12.379
  285   1HH2  ARG  35          HH21      ARG  35  38.889  18.665   9.133
  286   2HH2  ARG  35          HH22      ARG  35  38.591  19.266  10.746
  287    H    TYR  36           HN       TYR  36  32.749  16.207   6.834
  288    HA   TYR  36           HA       TYR  36  32.284  18.289   6.064
  289   1HB   TYR  36          HB2       TYR  36  34.496  18.836   8.012
  290   2HB   TYR  36          HB1       TYR  36  33.816  20.149   7.057
  291    HD1  TYR  36           HD1      TYR  36  31.589  20.965   7.486
  292    HD2  TYR  36           HD2      TYR  36  33.139  17.683   9.705
  293    HE1  TYR  36           HE1      TYR  36  29.760  21.205   9.108
  294    HE2  TYR  36           HE2      TYR  36  31.309  17.916  11.328
  295    HH   TYR  36           HH       TYR  36  29.685  20.317  11.921
  296   1HN   NH2  37          H1        NH2  37  34.360  18.210   3.160
  297   2HN   NH2  37          H2        NH2  37  32.998  17.461   3.914
  Start of MODEL    7
    1   1H    TYR   1          HT1       TYR   1  34.344   9.667 -10.200
    2   2H    TYR   1          HT2       TYR   1  35.037  11.111  -9.640
    3   3H    TYR   1          HT3       TYR   1  33.370  11.042  -9.972
    4    HA   TYR   1           HA       TYR   1  34.847  10.203  -7.642
    5   1HB   TYR   1          HB2       TYR   1  32.276  11.437  -8.378
    6   2HB   TYR   1          HB1       TYR   1  32.188  10.353  -6.992
    7    HD1  TYR   1           HD1      TYR   1  32.755  11.147  -4.879
    8    HD2  TYR   1           HD2      TYR   1  34.158  13.238  -8.311
    9    HE1  TYR   1           HE1      TYR   1  33.639  12.924  -3.426
   10    HE2  TYR   1           HE2      TYR   1  35.039  15.023  -6.868
   11    HH   TYR   1           HH       TYR   1  35.842  15.076  -4.274
   12    HA   PRO   2           HA       PRO   2  33.580   5.953  -7.656
   13   1HB   PRO   2          HB2       PRO   2  33.389   5.406  -5.038
   14   2HB   PRO   2          HB1       PRO   2  34.948   5.761  -5.795
   15   1HG   PRO   2          HG2       PRO   2  33.159   7.568  -4.207
   16   2HG   PRO   2          HG1       PRO   2  34.916   7.355  -4.095
   17   1HD   PRO   2          HD2       PRO   2  33.761   9.410  -5.456
   18   2HD   PRO   2          HD1       PRO   2  35.325   8.703  -5.911
   19    H    ILE   3           HN       ILE   3  31.909   4.498  -6.235
   20    HA   ILE   3           HA       ILE   3  29.398   5.958  -5.984
   21    HB   ILE   3           HB       ILE   3  29.398   5.169  -8.268
   22   1HG1  ILE   3          HG12      ILE   3  27.522   3.347  -6.765
   23   2HG1  ILE   3          HG11      ILE   3  27.288   5.090  -6.842
   24   1HG2  ILE   3          HG21      ILE   3  30.747   2.939  -7.286
   25   2HG2  ILE   3          HG22      ILE   3  30.276   3.266  -8.954
   26   3HG2  ILE   3          HG23      ILE   3  29.213   2.329  -7.905
   27   1HD1  ILE   3          HD11      ILE   3  27.335   4.830  -9.367
   28   2HD1  ILE   3          HD12      ILE   3  25.926   4.194  -8.518
   29   3HD1  ILE   3          HD13      ILE   3  27.188   3.098  -9.077
   30    H    LYS   4           HN       LYS   4  28.823   2.637  -6.073
   31    HA   LYS   4           HA       LYS   4  29.648   1.818  -3.501
   32   1HB   LYS   4          HB2       LYS   4  27.350   1.792  -2.452
   33   2HB   LYS   4          HB1       LYS   4  28.067   3.390  -2.604
   34   1HG   LYS   4          HG2       LYS   4  26.544   4.087  -4.138
   35   2HG   LYS   4          HG1       LYS   4  26.316   2.474  -4.812
   36   1HD   LYS   4          HD2       LYS   4  25.312   3.314  -2.097
   37   2HD   LYS   4          HD1       LYS   4  24.339   3.395  -3.567
   38   1HE   LYS   4          HE2       LYS   4  25.490   0.811  -3.428
   39   2HE   LYS   4          HE1       LYS   4  24.797   1.170  -1.846
   40   1HZ   LYS   4          HZ1       LYS   4  23.240   0.090  -3.424
   41   2HZ   LYS   4          HZ2       LYS   4  23.320   1.472  -4.407
   42   3HZ   LYS   4          HZ3       LYS   4  22.685   1.583  -2.840
   43    HA   PRO   5           HA       PRO   5  28.244  -2.011  -5.363
   44   1HB   PRO   5          HB2       PRO   5  27.740  -3.031  -2.653
   45   2HB   PRO   5          HB1       PRO   5  28.881  -3.612  -3.868
   46   1HG   PRO   5          HG2       PRO   5  29.696  -2.346  -1.637
   47   2HG   PRO   5          HG1       PRO   5  30.546  -2.174  -3.182
   48   1HD   PRO   5          HD2       PRO   5  28.637  -0.294  -1.848
   49   2HD   PRO   5          HD1       PRO   5  30.131   0.062  -2.746
   50    H    GLU   6           HN       GLU   6  26.278  -2.339  -6.189
   51    HA   GLU   6           HA       GLU   6  24.041  -0.912  -5.663
   52   1HB   GLU   6          HB2       GLU   6  24.551  -2.497  -7.602
   53   2HB   GLU   6          HB1       GLU   6  23.852  -3.761  -6.599
   54   1HG   GLU   6          HG2       GLU   6  22.038  -3.141  -7.834
   55   2HG   GLU   6          HG1       GLU   6  21.847  -2.097  -6.425
   56    H    ALA   7           HN       ALA   7  23.767  -4.365  -5.009
   57    HA   ALA   7           HA       ALA   7  23.156  -4.291  -2.291
   58   1HB   ALA   7          HB1       ALA   7  20.581  -4.722  -2.710
   59   2HB   ALA   7          HB2       ALA   7  20.873  -3.678  -4.102
   60   3HB   ALA   7          HB3       ALA   7  21.209  -3.091  -2.473
   61    HA   PRO   8           HA       PRO   8  23.578  -8.571  -3.522
   62   1HB   PRO   8          HB2       PRO   8  23.254  -9.180  -0.681
   63   2HB   PRO   8          HB1       PRO   8  24.663  -9.415  -1.716
   64   1HG   PRO   8          HG2       PRO   8  24.588  -7.556   0.247
   65   2HG   PRO   8          HG1       PRO   8  25.516  -7.332  -1.247
   66   1HD   PRO   8          HD2       PRO   8  22.851  -6.203  -0.479
   67   2HD   PRO   8          HD1       PRO   8  24.201  -5.426  -1.333
   68    H    GLY   9           HN       GLY   9  20.994  -7.185  -1.674
   69   1HA   GLY   9          HA2       GLY   9  18.803  -8.039  -2.721
   70   2HA   GLY   9          HA1       GLY   9  19.335  -9.572  -2.037
   71    H    GLU  10           HN       GLU  10  17.415  -9.549  -0.708
   72    HA   GLU  10           HA       GLU  10  17.628  -7.637   1.509
   73   1HB   GLU  10          HB2       GLU  10  15.287  -9.327   1.670
   74   2HB   GLU  10          HB1       GLU  10  15.387  -7.576   1.591
   75   1HG   GLU  10          HG2       GLU  10  15.898  -8.684  -0.998
   76   2HG   GLU  10          HG1       GLU  10  14.398  -9.338  -0.348
   77    H    ASP  11           HN       ASP  11  18.658 -10.560   0.640
   78    HA   ASP  11           HA       ASP  11  19.151 -11.424   3.324
   79   1HB   ASP  11          HB2       ASP  11  17.131 -12.569   3.296
   80   2HB   ASP  11          HB1       ASP  11  17.183 -12.828   1.558
   81    H    ALA  12           HN       ALA  12  21.214 -11.845   3.202
   82    HA   ALA  12           HA       ALA  12  22.223 -13.589   1.086
   83   1HB   ALA  12          HB1       ALA  12  24.081 -11.431   1.777
   84   2HB   ALA  12          HB2       ALA  12  22.641 -10.901   0.907
   85   3HB   ALA  12          HB3       ALA  12  23.691 -12.135   0.207
   86    H    SER  13           HN       SER  13  24.554 -14.233   1.639
   87    HA   SER  13           HA       SER  13  24.611 -15.417   4.180
   88   1HB   SER  13          HB2       SER  13  27.201 -15.037   2.818
   89   2HB   SER  13          HB1       SER  13  26.408 -16.524   3.345
   90    HG   SER  13           HG       SER  13  26.639 -15.841   0.917
   91    HA   PRO  14           HA       PRO  14  25.699 -12.244   6.958
   92   1HB   PRO  14          HB2       PRO  14  27.529 -13.693   8.517
   93   2HB   PRO  14          HB1       PRO  14  25.785 -13.586   8.771
   94   1HG   PRO  14          HG2       PRO  14  27.384 -15.706   7.431
   95   2HG   PRO  14          HG1       PRO  14  25.917 -15.853   8.416
   96   1HD   PRO  14          HD2       PRO  14  25.835 -16.090   5.755
   97   2HD   PRO  14          HD1       PRO  14  24.525 -15.284   6.644
   98    H    GLU  15           HN       GLU  15  28.553 -14.145   5.908
   99    HA   GLU  15           HA       GLU  15  30.331 -11.978   6.558
  100   1HB   GLU  15          HB2       GLU  15  31.470 -13.968   4.771
  101   2HB   GLU  15          HB1       GLU  15  31.957 -13.510   6.396
  102   1HG   GLU  15          HG2       GLU  15  31.409 -15.701   6.717
  103   2HG   GLU  15          HG1       GLU  15  29.866 -14.929   7.085
  104    H    GLU  16           HN       GLU  16  28.627 -13.045   3.750
  105    HA   GLU  16           HA       GLU  16  30.160 -11.523   1.865
  106   1HB   GLU  16          HB2       GLU  16  27.414 -12.783   1.675
  107   2HB   GLU  16          HB1       GLU  16  28.242 -12.007   0.329
  108   1HG   GLU  16          HG2       GLU  16  30.125 -13.651   0.716
  109   2HG   GLU  16          HG1       GLU  16  29.027 -14.510   1.795
  110    H    LEU  17           HN       LEU  17  27.100 -11.128   3.598
  111    HA   LEU  17           HA       LEU  17  26.498  -8.530   2.707
  112   1HB   LEU  17          HB2       LEU  17  25.340 -10.331   4.437
  113   2HB   LEU  17          HB1       LEU  17  25.885  -9.068   5.526
  114    HG   LEU  17           HG       LEU  17  24.505  -7.992   3.203
  115   1HD1  LEU  17          HD11      LEU  17  22.248  -8.738   4.204
  116   2HD1  LEU  17          HD12      LEU  17  23.171 -10.081   4.881
  117   3HD1  LEU  17          HD13      LEU  17  23.112  -9.843   3.133
  118   1HD2  LEU  17          HD21      LEU  17  24.623  -7.647   6.130
  119   2HD2  LEU  17          HD22      LEU  17  23.107  -7.190   5.351
  120   3HD2  LEU  17          HD23      LEU  17  24.622  -6.443   4.842
  121    H    ASN  18           HN       ASN  18  28.428  -9.727   5.418
  122    HA   ASN  18           HA       ASN  18  29.160  -7.242   6.497
  123   1HB   ASN  18          HB2       ASN  18  29.709  -8.910   7.964
  124   2HB   ASN  18          HB1       ASN  18  30.163 -10.032   6.686
  125   1HD2  ASN  18          HD21      ASN  18  31.234  -7.201   8.486
  126   2HD2  ASN  18          HD22      ASN  18  32.925  -7.489   8.279
  127    H    ARG  19           HN       ARG  19  30.588  -9.187   3.921
  128    HA   ARG  19           HA       ARG  19  32.931  -7.709   3.532
  129   1HB   ARG  19          HB2       ARG  19  31.285  -9.548   1.907
  130   2HB   ARG  19          HB1       ARG  19  32.340  -8.474   1.002
  131   1HG   ARG  19          HG2       ARG  19  33.642  -9.780   3.267
  132   2HG   ARG  19          HG1       ARG  19  33.060 -10.893   2.028
  133   1HD   ARG  19          HD2       ARG  19  34.201  -9.104   0.432
  134   2HD   ARG  19          HD1       ARG  19  35.164  -8.799   1.878
  135    HE   ARG  19           HE       ARG  19  35.081 -11.279   0.310
  136   1HH1  ARG  19          HH11      ARG  19  36.404  -9.459   3.001
  137   2HH1  ARG  19          HH12      ARG  19  37.748 -10.529   3.233
  138   1HH2  ARG  19          HH21      ARG  19  36.847 -12.695   0.625
  139   2HH2  ARG  19          HH22      ARG  19  37.985 -12.380   1.909
  140    H    TYR  20           HN       TYR  20  29.847  -7.420   1.765
  141    HA   TYR  20           HA       TYR  20  30.566  -5.058   0.387
  142   1HB   TYR  20          HB2       TYR  20  28.731  -5.675  -0.734
  143   2HB   TYR  20          HB1       TYR  20  28.334  -6.840   0.517
  144    HD1  TYR  20           HD1      TYR  20  26.868  -6.073   2.453
  145    HD2  TYR  20           HD2      TYR  20  27.431  -3.759  -1.070
  146    HE1  TYR  20           HE1      TYR  20  24.818  -4.809   2.961
  147    HE2  TYR  20           HE2      TYR  20  25.384  -2.490  -0.576
  148    HH   TYR  20           HH       TYR  20  24.065  -2.035   1.924
  149    H    TYR  21           HN       TYR  21  29.145  -5.682   3.478
  150    HA   TYR  21           HA       TYR  21  28.131  -3.207   4.207
  151   1HB   TYR  21          HB2       TYR  21  28.348  -5.605   5.410
  152   2HB   TYR  21          HB1       TYR  21  29.623  -4.745   6.257
  153    HD1  TYR  21           HD1      TYR  21  29.123  -3.360   8.040
  154    HD2  TYR  21           HD2      TYR  21  26.008  -4.572   5.420
  155    HE1  TYR  21           HE1      TYR  21  27.474  -2.404   9.577
  156    HE2  TYR  21           HE2      TYR  21  24.339  -3.618   6.946
  157    HH   TYR  21           HH       TYR  21  24.425  -3.137   9.705
  158    H    ALA  22           HN       ALA  22  31.299  -4.488   5.196
  159    HA   ALA  22           HA       ALA  22  32.155  -1.987   6.213
  160   1HB   ALA  22          HB1       ALA  22  33.635  -4.539   5.631
  161   2HB   ALA  22          HB2       ALA  22  33.022  -3.968   7.185
  162   3HB   ALA  22          HB3       ALA  22  34.371  -3.136   6.409
  163    H    SER  23           HN       SER  23  32.482  -3.561   3.111
  164    HA   SER  23           HA       SER  23  34.550  -1.952   2.077
  165   1HB   SER  23          HB2       SER  23  32.296  -3.400   0.672
  166   2HB   SER  23          HB1       SER  23  33.651  -2.638  -0.164
  167    HG   SER  23           HG       SER  23  33.634  -4.891   1.535
  168    H    LEU  24           HN       LEU  24  31.039  -1.514   2.144
  169    HA   LEU  24           HA       LEU  24  31.155   0.896   0.576
  170   1HB   LEU  24          HB2       LEU  24  29.119   0.079   0.108
  171   2HB   LEU  24          HB1       LEU  24  29.119  -0.957   1.519
  172    HG   LEU  24           HG       LEU  24  28.680   1.757   2.340
  173   1HD1  LEU  24          HD11      LEU  24  27.796   1.555  -0.186
  174   2HD1  LEU  24          HD12      LEU  24  26.999   2.535   1.046
  175   3HD1  LEU  24          HD13      LEU  24  26.392   0.921   0.674
  176   1HD2  LEU  24          HD21      LEU  24  26.417  -0.069   2.443
  177   2HD2  LEU  24          HD22      LEU  24  27.303   0.714   3.752
  178   3HD2  LEU  24          HD23      LEU  24  27.910  -0.789   3.053
  179    H    ARG  25           HN       ARG  25  31.100  -0.080   3.903
  180    HA   ARG  25           HA       ARG  25  30.393   2.395   5.050
  181   1HB   ARG  25          HB2       ARG  25  31.304  -0.166   5.978
  182   2HB   ARG  25          HB1       ARG  25  32.205   1.107   6.791
  183   1HG   ARG  25          HG2       ARG  25  30.356   0.735   8.167
  184   2HG   ARG  25          HG1       ARG  25  29.931   2.181   7.248
  185   1HD   ARG  25          HD2       ARG  25  29.117  -0.162   5.810
  186   2HD   ARG  25          HD1       ARG  25  28.485  -0.222   7.455
  187    HE   ARG  25           HE       ARG  25  28.005   1.999   5.562
  188   1HH1  ARG  25          HH11      ARG  25  27.086   0.087   8.341
  189   2HH1  ARG  25          HH12      ARG  25  25.465   0.717   8.412
  190   1HH2  ARG  25          HH21      ARG  25  25.867   2.858   5.646
  191   2HH2  ARG  25          HH22      ARG  25  24.766   2.289   6.873
  192    H    HIS  26           HN       HIS  26  33.616   0.915   4.557
  193    HA   HIS  26           HA       HIS  26  34.967   3.326   5.267
  194   1HB   HIS  26          HB2       HIS  26  35.771   0.727   4.977
  195   2HB   HIS  26          HB1       HIS  26  36.460   1.481   3.540
  196    HD1  HIS  26           HD1      HIS  26  38.130   0.430   6.061
  197    HD2  HIS  26           HD2      HIS  26  37.085   4.379   5.242
  198    HE1  HIS  26           HE1      HIS  26  39.784   1.853   7.316
  199    HE2  HIS  26           HE2      HIS  26  39.054   4.232   6.912
  200    H    TYR  27           HN       TYR  27  33.782   1.964   2.266
  201    HA   TYR  27           HA       TYR  27  34.966   3.687   0.416
  202   1HB   TYR  27          HB2       TYR  27  33.163   1.683   0.245
  203   2HB   TYR  27          HB1       TYR  27  32.090   3.061   0.055
  204    HD1  TYR  27           HD1      TYR  27  35.505   2.225  -1.223
  205    HD2  TYR  27           HD2      TYR  27  31.528   3.405  -2.130
  206    HE1  TYR  27           HE1      TYR  27  36.086   2.333  -3.608
  207    HE2  TYR  27           HE2      TYR  27  32.090   3.519  -4.514
  208    HH   TYR  27           HH       TYR  27  35.404   2.797  -5.643
  209    H    LEU  28           HN       LEU  28  31.740   3.964   1.893
  210    HA   LEU  28           HA       LEU  28  31.420   6.658   0.958
  211   1HB   LEU  28          HB2       LEU  28  29.814   4.725   2.501
  212   2HB   LEU  28          HB1       LEU  28  29.471   6.414   2.817
  213    HG   LEU  28           HG       LEU  28  27.949   5.649   1.129
  214   1HD1  LEU  28          HD11      LEU  28  30.142   7.320  -0.087
  215   2HD1  LEU  28          HD12      LEU  28  28.756   7.908   0.829
  216   3HD1  LEU  28          HD13      LEU  28  28.514   7.146  -0.743
  217   1HD2  LEU  28          HD21      LEU  28  30.231   4.151   0.228
  218   2HD2  LEU  28          HD22      LEU  28  29.553   5.083  -1.105
  219   3HD2  LEU  28          HD23      LEU  28  28.529   3.965  -0.204
  220    H    ASN  29           HN       ASN  29  33.063   5.388   3.606
  221    HA   ASN  29           HA       ASN  29  32.789   7.734   5.268
  222   1HB   ASN  29          HB2       ASN  29  33.205   5.805   6.532
  223   2HB   ASN  29          HB1       ASN  29  34.431   5.220   5.415
  224   1HD2  ASN  29          HD21      ASN  29  33.739   7.441   8.014
  225   2HD2  ASN  29          HD22      ASN  29  35.390   7.762   8.433
  226    H    LEU  30           HN       LEU  30  35.450   6.265   3.392
  227    HA   LEU  30           HA       LEU  30  37.284   8.317   4.032
  228   1HB   LEU  30          HB2       LEU  30  38.591   6.639   3.394
  229   2HB   LEU  30          HB1       LEU  30  37.272   5.843   2.561
  230    HG   LEU  30           HG       LEU  30  38.015   7.912   0.845
  231   1HD1  LEU  30          HD11      LEU  30  40.470   7.384   0.556
  232   2HD1  LEU  30          HD12      LEU  30  40.412   6.675   2.170
  233   3HD1  LEU  30          HD13      LEU  30  40.048   8.386   1.947
  234   1HD2  LEU  30          HD21      LEU  30  37.939   5.033   0.923
  235   2HD2  LEU  30          HD22      LEU  30  39.312   5.604  -0.027
  236   3HD2  LEU  30          HD23      LEU  30  37.678   6.128  -0.436
  237    H    VAL  31           HN       VAL  31  35.169   7.833   1.234
  238    HA   VAL  31           HA       VAL  31  36.460   9.845  -0.334
  239    HB   VAL  31           HB       VAL  31  34.678   9.572  -1.940
  240   1HG1  VAL  31          HG11      VAL  31  34.742   6.811  -1.611
  241   2HG1  VAL  31          HG12      VAL  31  36.228   7.398  -0.865
  242   3HG1  VAL  31          HG13      VAL  31  35.864   7.804  -2.543
  243   1HG2  VAL  31          HG21      VAL  31  33.042   9.077   0.219
  244   2HG2  VAL  31          HG22      VAL  31  33.184   7.495  -0.548
  245   3HG2  VAL  31          HG23      VAL  31  32.607   8.876  -1.480
  246    H    THR  32           HN       THR  32  33.886   9.896   1.998
  247    HA   THR  32           HA       THR  32  33.089  12.579   1.188
  248    HB   THR  32           HB       THR  32  31.978  11.287   3.633
  249    HG1  THR  32           HG1      THR  32  31.339   9.587   2.539
  250   1HG2  THR  32          HG21      THR  32  30.121  12.298   1.660
  251   2HG2  THR  32          HG22      THR  32  31.355  13.500   2.038
  252   3HG2  THR  32          HG23      THR  32  30.367  12.812   3.328
  253    H    ARG  33           HN       ARG  33  35.076  10.987   3.501
  254    HA   ARG  33           HA       ARG  33  35.258  13.265   5.271
  255   1HB   ARG  33          HB2       ARG  33  36.549  10.561   5.157
  256   2HB   ARG  33          HB1       ARG  33  37.231  11.812   6.183
  257   1HG   ARG  33          HG2       ARG  33  34.403  11.648   6.601
  258   2HG   ARG  33          HG1       ARG  33  35.138  10.055   6.779
  259   1HD   ARG  33          HD2       ARG  33  35.181  11.086   8.920
  260   2HD   ARG  33          HD1       ARG  33  36.830  11.120   8.299
  261    HE   ARG  33           HE       ARG  33  36.752  13.401   8.268
  262   1HH1  ARG  33          HH11      ARG  33  33.502  12.131   8.645
  263   2HH1  ARG  33          HH12      ARG  33  32.786  13.692   8.912
  264   1HH2  ARG  33          HH21      ARG  33  35.817  15.452   8.636
  265   2HH2  ARG  33          HH22      ARG  33  34.107  15.586   8.925
  266    H    GLN  34           HN       GLN  34  36.760  12.192   2.398
  267    HA   GLN  34           HA       GLN  34  38.637  12.747   1.248
  268   1HB   GLN  34          HB2       GLN  34  37.700  15.193   2.429
  269   2HB   GLN  34          HB1       GLN  34  39.457  15.195   2.437
  270   1HG   GLN  34          HG2       GLN  34  38.991  16.161   0.413
  271   2HG   GLN  34          HG1       GLN  34  39.220  14.474  -0.040
  272   1HE2  GLN  34          HE21      GLN  34  36.378  14.713   1.622
  273   2HE2  GLN  34          HE22      GLN  34  35.281  14.859   0.290
  274    H    ARG  35           HN       ARG  35  39.176  10.932   2.925
  275    HA   ARG  35           HA       ARG  35  40.828  11.625   5.138
  276   1HB   ARG  35          HB2       ARG  35  39.493   9.659   5.304
  277   2HB   ARG  35          HB1       ARG  35  40.159   9.002   3.816
  278   1HG   ARG  35          HG2       ARG  35  41.969   8.166   4.848
  279   2HG   ARG  35          HG1       ARG  35  42.130   9.558   5.921
  280   1HD   ARG  35          HD2       ARG  35  39.821   8.416   6.816
  281   2HD   ARG  35          HD1       ARG  35  40.764   7.003   6.337
  282    HE   ARG  35           HE       ARG  35  41.640   9.040   8.289
  283   1HH1  ARG  35          HH11      ARG  35  41.715   5.780   7.000
  284   2HH1  ARG  35          HH12      ARG  35  42.749   5.168   8.263
  285   1HH2  ARG  35          HH21      ARG  35  43.002   8.246   9.936
  286   2HH2  ARG  35          HH22      ARG  35  43.465   6.573   9.948
  287    H    TYR  36           HN       TYR  36  42.571  12.768   4.401
  288    HA   TYR  36           HA       TYR  36  44.907  11.311   4.061
  289   1HB   TYR  36          HB2       TYR  36  43.629  12.013   1.526
  290   2HB   TYR  36          HB1       TYR  36  45.250  12.684   1.664
  291    HD1  TYR  36           HD1      TYR  36  46.346  10.404   3.427
  292    HD2  TYR  36           HD2      TYR  36  44.126  10.427  -0.199
  293    HE1  TYR  36           HE1      TYR  36  47.281   8.206   2.848
  294    HE2  TYR  36           HE2      TYR  36  45.057   8.228  -0.789
  295    HH   TYR  36           HH       TYR  36  47.468   6.954   0.034
  296   1HN   NH2  37          H1        NH2  37  46.347  14.802   3.617
  297   2HN   NH2  37          H2        NH2  37  46.340  13.424   2.574
  Start of MODEL    8
    1   1H    TYR   1          HT1       TYR   1  32.773   4.108  -9.991
    2   2H    TYR   1          HT2       TYR   1  31.263   4.874 -10.014
    3   3H    TYR   1          HT3       TYR   1  32.101   4.601 -11.465
    4    HA   TYR   1           HA       TYR   1  30.328   3.045 -11.261
    5   1HB   TYR   1          HB2       TYR   1  33.145   2.066 -11.093
    6   2HB   TYR   1          HB1       TYR   1  31.840   0.885 -11.071
    7    HD1  TYR   1           HD1      TYR   1  29.906   1.968 -12.944
    8    HD2  TYR   1           HD2      TYR   1  34.151   1.939 -13.165
    9    HE1  TYR   1           HE1      TYR   1  29.771   2.084 -15.397
   10    HE2  TYR   1           HE2      TYR   1  34.029   2.056 -15.617
   11    HH   TYR   1           HH       TYR   1  32.564   1.657 -17.416
   12    HA   PRO   2           HA       PRO   2  30.605   0.954  -6.991
   13   1HB   PRO   2          HB2       PRO   2  32.617   1.523  -5.288
   14   2HB   PRO   2          HB1       PRO   2  32.755   0.260  -6.516
   15   1HG   PRO   2          HG2       PRO   2  33.842   3.041  -6.522
   16   2HG   PRO   2          HG1       PRO   2  34.590   1.541  -7.102
   17   1HD   PRO   2          HD2       PRO   2  33.380   3.399  -8.731
   18   2HD   PRO   2          HD1       PRO   2  33.568   1.687  -9.143
   19    H    ILE   3           HN       ILE   3  29.049   1.885  -5.808
   20    HA   ILE   3           HA       ILE   3  29.563   4.532  -4.651
   21    HB   ILE   3           HB       ILE   3  26.930   4.759  -4.954
   22   1HG1  ILE   3          HG12      ILE   3  27.779   3.084  -7.334
   23   2HG1  ILE   3          HG11      ILE   3  26.668   2.576  -6.063
   24   1HG2  ILE   3          HG21      ILE   3  28.167   6.512  -5.760
   25   2HG2  ILE   3          HG22      ILE   3  27.564   5.837  -7.273
   26   3HG2  ILE   3          HG23      ILE   3  29.204   5.473  -6.739
   27   1HD1  ILE   3          HD11      ILE   3  25.035   4.147  -6.761
   28   2HD1  ILE   3          HD12      ILE   3  25.598   3.298  -8.200
   29   3HD1  ILE   3          HD13      ILE   3  26.171   4.931  -7.858
   30    H    LYS   4           HN       LYS   4  26.420   3.499  -4.145
   31    HA   LYS   4           HA       LYS   4  27.154   2.498  -1.478
   32   1HB   LYS   4          HB2       LYS   4  26.316   4.693  -1.167
   33   2HB   LYS   4          HB1       LYS   4  25.022   4.443  -2.330
   34   1HG   LYS   4          HG2       LYS   4  24.638   2.524  -0.319
   35   2HG   LYS   4          HG1       LYS   4  25.022   4.039   0.501
   36   1HD   LYS   4          HD2       LYS   4  22.803   4.410   0.249
   37   2HD   LYS   4          HD1       LYS   4  23.301   4.946  -1.358
   38   1HE   LYS   4          HE2       LYS   4  22.981   2.126  -1.434
   39   2HE   LYS   4          HE1       LYS   4  21.561   2.813  -0.648
   40   1HZ   LYS   4          HZ1       LYS   4  21.198   2.700  -2.998
   41   2HZ   LYS   4          HZ2       LYS   4  22.631   3.551  -3.321
   42   3HZ   LYS   4          HZ3       LYS   4  21.335   4.328  -2.551
   43    HA   PRO   5           HA       PRO   5  24.424  -0.860  -2.744
   44   1HB   PRO   5          HB2       PRO   5  25.556  -2.482  -0.714
   45   2HB   PRO   5          HB1       PRO   5  25.966  -2.485  -2.430
   46   1HG   PRO   5          HG2       PRO   5  27.657  -1.695  -0.363
   47   2HG   PRO   5          HG1       PRO   5  27.872  -1.309  -2.078
   48   1HD   PRO   5          HD2       PRO   5  26.725   0.367   0.116
   49   2HD   PRO   5          HD1       PRO   5  27.744   0.847  -1.260
   50    H    GLU   6           HN       GLU   6  22.363  -0.865  -2.047
   51    HA   GLU   6           HA       GLU   6  21.768  -0.330   0.743
   52   1HB   GLU   6          HB2       GLU   6  19.344  -0.650  -0.143
   53   2HB   GLU   6          HB1       GLU   6  20.249   0.789  -0.583
   54   1HG   GLU   6          HG2       GLU   6  20.411  -1.546  -2.405
   55   2HG   GLU   6          HG1       GLU   6  18.900  -0.636  -2.359
   56    H    ALA   7           HN       ALA   7  21.952  -3.073  -1.371
   57    HA   ALA   7           HA       ALA   7  21.491  -4.856   0.846
   58   1HB   ALA   7          HB1       ALA   7  19.614  -6.030  -0.002
   59   2HB   ALA   7          HB2       ALA   7  19.631  -5.109  -1.507
   60   3HB   ALA   7          HB3       ALA   7  19.192  -4.319   0.008
   61    HA   PRO   8           HA       PRO   8  24.107  -7.285  -1.782
   62   1HB   PRO   8          HB2       PRO   8  24.367  -9.423  -0.158
   63   2HB   PRO   8          HB1       PRO   8  25.105  -7.862   0.205
   64   1HG   PRO   8          HG2       PRO   8  22.800  -9.181   1.471
   65   2HG   PRO   8          HG1       PRO   8  23.865  -7.919   2.108
   66   1HD   PRO   8          HD2       PRO   8  21.250  -7.632   0.966
   67   2HD   PRO   8          HD1       PRO   8  22.308  -6.368   1.618
   68    H    GLY   9           HN       GLY   9  20.947  -8.350  -0.823
   69   1HA   GLY   9          HA2       GLY   9  20.062  -9.509  -3.052
   70   2HA   GLY   9          HA1       GLY   9  21.065 -10.790  -2.378
   71    H    GLU  10           HN       GLU  10  19.610 -12.247  -1.658
   72    HA   GLU  10           HA       GLU  10  17.489 -11.259   0.109
   73   1HB   GLU  10          HB2       GLU  10  17.768 -13.718  -1.578
   74   2HB   GLU  10          HB1       GLU  10  16.718 -13.748  -0.167
   75   1HG   GLU  10          HG2       GLU  10  16.127 -11.395  -1.627
   76   2HG   GLU  10          HG1       GLU  10  16.177 -12.743  -2.761
   77    H    ASP  11           HN       ASP  11  18.846 -14.502   0.069
   78    HA   ASP  11           HA       ASP  11  19.225 -14.459   2.918
   79   1HB   ASP  11          HB2       ASP  11  18.435 -16.449   1.604
   80   2HB   ASP  11          HB1       ASP  11  20.057 -16.580   0.934
   81    H    ALA  12           HN       ALA  12  20.732 -12.566   2.592
   82    HA   ALA  12           HA       ALA  12  23.501 -13.515   2.227
   83   1HB   ALA  12          HB1       ALA  12  22.087 -11.465   0.791
   84   2HB   ALA  12          HB2       ALA  12  23.711 -12.100   0.525
   85   3HB   ALA  12          HB3       ALA  12  23.458 -10.774   1.666
   86    H    SER  13           HN       SER  13  22.219 -13.516   4.678
   87    HA   SER  13           HA       SER  13  22.316 -11.175   6.163
   88   1HB   SER  13          HB2       SER  13  22.939 -13.457   7.807
   89   2HB   SER  13          HB1       SER  13  21.446 -12.519   7.713
   90    HG   SER  13           HG       SER  13  20.718 -14.358   6.925
   91    HA   PRO  14           HA       PRO  14  26.674 -12.071   7.634
   92   1HB   PRO  14          HB2       PRO  14  27.954 -14.372   6.675
   93   2HB   PRO  14          HB1       PRO  14  27.100 -14.214   8.209
   94   1HG   PRO  14          HG2       PRO  14  26.344 -15.818   6.019
   95   2HG   PRO  14          HG1       PRO  14  25.369 -15.448   7.451
   96   1HD   PRO  14          HD2       PRO  14  25.302 -14.220   4.739
   97   2HD   PRO  14          HD1       PRO  14  23.980 -14.486   5.898
   98    H    GLU  15           HN       GLU  15  27.948 -13.950   4.965
   99    HA   GLU  15           HA       GLU  15  30.100 -12.169   4.793
  100   1HB   GLU  15          HB2       GLU  15  29.517 -14.728   3.867
  101   2HB   GLU  15          HB1       GLU  15  29.839 -13.790   2.415
  102   1HG   GLU  15          HG2       GLU  15  31.668 -13.951   4.800
  103   2HG   GLU  15          HG1       GLU  15  31.844 -14.889   3.317
  104    H    GLU  16           HN       GLU  16  27.307 -12.532   2.657
  105    HA   GLU  16           HA       GLU  16  28.288 -10.735   0.698
  106   1HB   GLU  16          HB2       GLU  16  25.557 -11.834   1.305
  107   2HB   GLU  16          HB1       GLU  16  25.808 -10.643   0.035
  108   1HG   GLU  16          HG2       GLU  16  26.089 -12.417  -1.276
  109   2HG   GLU  16          HG1       GLU  16  27.712 -12.470  -0.587
  110    H    LEU  17           HN       LEU  17  26.274 -10.349   3.590
  111    HA   LEU  17           HA       LEU  17  25.666  -7.603   3.040
  112   1HB   LEU  17          HB2       LEU  17  24.542  -9.341   4.700
  113   2HB   LEU  17          HB1       LEU  17  25.710  -8.662   5.828
  114    HG   LEU  17           HG       LEU  17  24.373  -6.521   4.487
  115   1HD1  LEU  17          HD11      LEU  17  22.317  -7.871   6.066
  116   2HD1  LEU  17          HD12      LEU  17  22.701  -8.679   4.545
  117   3HD1  LEU  17          HD13      LEU  17  22.187  -6.992   4.543
  118   1HD2  LEU  17          HD21      LEU  17  25.394  -7.109   6.973
  119   2HD2  LEU  17          HD22      LEU  17  23.657  -7.008   7.262
  120   3HD2  LEU  17          HD23      LEU  17  24.509  -5.649   6.530
  121    H    ASN  18           HN       ASN  18  28.018  -9.350   5.002
  122    HA   ASN  18           HA       ASN  18  29.453  -7.190   6.044
  123   1HB   ASN  18          HB2       ASN  18  29.959  -9.349   6.891
  124   2HB   ASN  18          HB1       ASN  18  30.260  -9.994   5.282
  125   1HD2  ASN  18          HD21      ASN  18  32.314 -10.370   4.882
  126   2HD2  ASN  18          HD22      ASN  18  33.648  -9.477   5.540
  127    H    ARG  19           HN       ARG  19  29.643  -8.835   2.937
  128    HA   ARG  19           HA       ARG  19  31.929  -7.624   1.905
  129   1HB   ARG  19          HB2       ARG  19  29.596  -9.022   0.823
  130   2HB   ARG  19          HB1       ARG  19  30.280  -7.843  -0.285
  131   1HG   ARG  19          HG2       ARG  19  31.117 -10.425   0.001
  132   2HG   ARG  19          HG1       ARG  19  32.046  -9.120  -0.735
  133   1HD   ARG  19          HD2       ARG  19  32.846  -8.656   1.688
  134   2HD   ARG  19          HD1       ARG  19  32.281 -10.295   2.013
  135    HE   ARG  19           HE       ARG  19  33.837 -10.624  -0.167
  136   1HH1  ARG  19          HH11      ARG  19  34.373  -9.087   2.921
  137   2HH1  ARG  19          HH12      ARG  19  36.083  -9.384   2.928
  138   1HH2  ARG  19          HH21      ARG  19  36.056 -11.026  -0.191
  139   2HH2  ARG  19          HH22      ARG  19  37.053 -10.511   1.142
  140    H    TYR  20           HN       TYR  20  28.549  -6.610   1.221
  141    HA   TYR  20           HA       TYR  20  29.376  -4.155   0.086
  142   1HB   TYR  20          HB2       TYR  20  27.162  -3.717  -0.304
  143   2HB   TYR  20          HB1       TYR  20  27.070  -5.451  -0.065
  144    HD1  TYR  20           HD1      TYR  20  26.833  -2.329   2.046
  145    HD2  TYR  20           HD2      TYR  20  25.308  -6.200   1.171
  146    HE1  TYR  20           HE1      TYR  20  25.060  -2.004   3.721
  147    HE2  TYR  20           HE2      TYR  20  23.535  -5.879   2.837
  148    HH   TYR  20           HH       TYR  20  22.674  -2.975   4.083
  149    H    TYR  21           HN       TYR  21  28.716  -5.157   3.319
  150    HA   TYR  21           HA       TYR  21  28.267  -2.734   4.595
  151   1HB   TYR  21          HB2       TYR  21  28.391  -5.303   5.396
  152   2HB   TYR  21          HB1       TYR  21  29.933  -4.720   6.019
  153    HD1  TYR  21           HD1      TYR  21  30.030  -3.443   7.968
  154    HD2  TYR  21           HD2      TYR  21  26.296  -4.081   6.050
  155    HE1  TYR  21           HE1      TYR  21  28.890  -2.453   9.891
  156    HE2  TYR  21           HE2      TYR  21  25.128  -3.096   7.957
  157    HH   TYR  21           HH       TYR  21  26.218  -2.816  10.832
  158    H    ALA  22           HN       ALA  22  31.340  -4.518   4.508
  159    HA   ALA  22           HA       ALA  22  32.773  -2.329   5.616
  160   1HB   ALA  22          HB1       ALA  22  33.703  -4.900   4.363
  161   2HB   ALA  22          HB2       ALA  22  33.531  -4.532   6.081
  162   3HB   ALA  22          HB3       ALA  22  34.778  -3.728   5.125
  163    H    SER  23           HN       SER  23  32.050  -3.351   2.352
  164    HA   SER  23           HA       SER  23  33.987  -1.733   1.056
  165   1HB   SER  23          HB2       SER  23  31.272  -2.621   0.040
  166   2HB   SER  23          HB1       SER  23  32.596  -2.003  -0.951
  167    HG   SER  23           HG       SER  23  32.388  -4.457   0.423
  168    H    LEU  24           HN       LEU  24  30.718  -1.102   2.237
  169    HA   LEU  24           HA       LEU  24  30.656   1.542   1.083
  170   1HB   LEU  24          HB2       LEU  24  28.456   1.282   1.226
  171   2HB   LEU  24          HB1       LEU  24  28.727  -0.317   1.885
  172    HG   LEU  24           HG       LEU  24  28.967   1.540   4.027
  173   1HD1  LEU  24          HD11      LEU  24  26.698   2.511   3.989
  174   2HD1  LEU  24          HD12      LEU  24  26.504   1.935   2.333
  175   3HD1  LEU  24          HD13      LEU  24  27.734   3.142   2.707
  176   1HD2  LEU  24          HD21      LEU  24  27.556   0.090   5.067
  177   2HD2  LEU  24          HD22      LEU  24  28.074  -0.936   3.730
  178   3HD2  LEU  24          HD23      LEU  24  26.523  -0.099   3.647
  179    H    ARG  25           HN       ARG  25  31.422   0.040   4.118
  180    HA   ARG  25           HA       ARG  25  31.379   2.455   5.642
  181   1HB   ARG  25          HB2       ARG  25  32.134  -0.328   6.080
  182   2HB   ARG  25          HB1       ARG  25  33.237   0.789   6.869
  183   1HG   ARG  25          HG2       ARG  25  31.313  -0.022   8.262
  184   2HG   ARG  25          HG1       ARG  25  31.492   1.731   8.167
  185   1HD   ARG  25          HD2       ARG  25  29.618   1.985   6.863
  186   2HD   ARG  25          HD1       ARG  25  29.728   0.355   6.205
  187    HE   ARG  25           HE       ARG  25  28.952  -0.414   8.442
  188   1HH1  ARG  25          HH11      ARG  25  28.273   2.846   7.386
  189   2HH1  ARG  25          HH12      ARG  25  26.850   3.017   8.366
  190   1HH2  ARG  25          HH21      ARG  25  27.034  -0.225   9.703
  191   2HH2  ARG  25          HH22      ARG  25  26.136   1.267   9.674
  192    H    HIS  26           HN       HIS  26  33.891   0.617   3.957
  193    HA   HIS  26           HA       HIS  26  36.010   2.431   4.396
  194   1HB   HIS  26          HB2       HIS  26  36.082   0.011   3.508
  195   2HB   HIS  26          HB1       HIS  26  35.689   0.707   1.942
  196    HD1  HIS  26           HD1      HIS  26  38.440   0.616   4.517
  197    HD2  HIS  26           HD2      HIS  26  37.796   1.872   0.608
  198    HE1  HIS  26           HE1      HIS  26  40.714   1.161   3.599
  199    HE2  HIS  26           HE2      HIS  26  40.311   1.607   1.156
  200    H    TYR  27           HN       TYR  27  33.577   2.115   1.848
  201    HA   TYR  27           HA       TYR  27  34.474   4.195   0.188
  202   1HB   TYR  27          HB2       TYR  27  32.844   2.618  -0.639
  203   2HB   TYR  27          HB1       TYR  27  31.714   3.034   0.642
  204    HD1  TYR  27           HD1      TYR  27  33.160   4.114  -2.563
  205    HD2  TYR  27           HD2      TYR  27  30.323   5.005   0.482
  206    HE1  TYR  27           HE1      TYR  27  32.089   5.758  -4.048
  207    HE2  TYR  27           HE2      TYR  27  29.245   6.654  -0.989
  208    HH   TYR  27           HH       TYR  27  29.633   7.954  -2.903
  209    H    LEU  28           HN       LEU  28  31.900   4.188   2.653
  210    HA   LEU  28           HA       LEU  28  31.180   6.860   2.460
  211   1HB   LEU  28          HB2       LEU  28  30.697   4.692   4.256
  212   2HB   LEU  28          HB1       LEU  28  30.988   6.145   5.189
  213    HG   LEU  28           HG       LEU  28  28.600   5.780   4.750
  214   1HD1  LEU  28          HD11      LEU  28  29.432   8.181   3.170
  215   2HD1  LEU  28          HD12      LEU  28  29.724   8.085   4.905
  216   3HD1  LEU  28          HD13      LEU  28  28.077   7.995   4.283
  217   1HD2  LEU  28          HD21      LEU  28  29.313   4.876   2.323
  218   2HD2  LEU  28          HD22      LEU  28  28.848   6.524   1.905
  219   3HD2  LEU  28          HD23      LEU  28  27.693   5.459   2.704
  220    H    ASN  29           HN       ASN  29  33.662   5.421   4.557
  221    HA   ASN  29           HA       ASN  29  34.254   7.843   5.909
  222   1HB   ASN  29          HB2       ASN  29  34.800   5.757   6.960
  223   2HB   ASN  29          HB1       ASN  29  35.825   5.278   5.610
  224   1HD2  ASN  29          HD21      ASN  29  35.472   7.815   8.065
  225   2HD2  ASN  29          HD22      ASN  29  37.172   8.043   8.301
  226    H    LEU  30           HN       LEU  30  35.938   6.147   3.259
  227    HA   LEU  30           HA       LEU  30  38.031   8.078   3.165
  228   1HB   LEU  30          HB2       LEU  30  37.285   5.674   1.591
  229   2HB   LEU  30          HB1       LEU  30  38.402   6.816   0.868
  230    HG   LEU  30           HG       LEU  30  38.787   5.021   3.222
  231   1HD1  LEU  30          HD11      LEU  30  40.898   5.833   1.294
  232   2HD1  LEU  30          HD12      LEU  30  39.603   4.777   0.730
  233   3HD1  LEU  30          HD13      LEU  30  40.620   4.280   2.082
  234   1HD2  LEU  30          HD21      LEU  30  40.914   6.959   3.039
  235   2HD2  LEU  30          HD22      LEU  30  39.977   6.453   4.444
  236   3HD2  LEU  30          HD23      LEU  30  39.381   7.750   3.409
  237    H    VAL  31           HN       VAL  31  34.982   7.733   1.487
  238    HA   VAL  31           HA       VAL  31  35.680   9.542  -0.626
  239    HB   VAL  31           HB       VAL  31  33.100   8.294   0.267
  240   1HG1  VAL  31          HG11      VAL  31  31.767   9.576  -1.071
  241   2HG1  VAL  31          HG12      VAL  31  33.092  10.036  -2.140
  242   3HG1  VAL  31          HG13      VAL  31  32.929  10.800  -0.559
  243   1HG2  VAL  31          HG21      VAL  31  33.996   8.215  -2.530
  244   2HG2  VAL  31          HG22      VAL  31  33.379   6.929  -1.495
  245   3HG2  VAL  31          HG23      VAL  31  35.065   7.428  -1.370
  246    H    THR  32           HN       THR  32  33.717   9.823   2.334
  247    HA   THR  32           HA       THR  32  33.154  12.575   2.016
  248    HB   THR  32           HB       THR  32  33.336  11.174   4.677
  249    HG1  THR  32           HG1      THR  32  32.006   9.787   3.725
  250   1HG2  THR  32          HG21      THR  32  31.184  13.071   3.852
  251   2HG2  THR  32          HG22      THR  32  32.770  13.718   4.269
  252   3HG2  THR  32          HG23      THR  32  31.868  12.769   5.450
  253    H    ARG  33           HN       ARG  33  35.574  10.902   4.047
  254    HA   ARG  33           HA       ARG  33  37.016  13.445   4.293
  255   1HB   ARG  33          HB2       ARG  33  36.678  11.117   5.996
  256   2HB   ARG  33          HB1       ARG  33  38.381  11.486   5.754
  257   1HG   ARG  33          HG2       ARG  33  36.741  13.831   6.352
  258   2HG   ARG  33          HG1       ARG  33  36.780  12.627   7.641
  259   1HD   ARG  33          HD2       ARG  33  38.841  13.227   8.210
  260   2HD   ARG  33          HD1       ARG  33  39.408  12.980   6.560
  261    HE   ARG  33           HE       ARG  33  38.536  15.317   6.153
  262   1HH1  ARG  33          HH11      ARG  33  39.625  14.246   9.306
  263   2HH1  ARG  33          HH12      ARG  33  40.086  15.835   9.828
  264   1HH2  ARG  33          HH21      ARG  33  39.155  17.416   6.832
  265   2HH2  ARG  33          HH22      ARG  33  39.833  17.642   8.421
  266    H    GLN  34           HN       GLN  34  37.491  13.152   1.940
  267    HA   GLN  34           HA       GLN  34  39.115  10.956   1.126
  268   1HB   GLN  34          HB2       GLN  34  37.607  12.176  -0.421
  269   2HB   GLN  34          HB1       GLN  34  38.674  13.571  -0.317
  270   1HG   GLN  34          HG2       GLN  34  39.796  12.746  -2.035
  271   2HG   GLN  34          HG1       GLN  34  40.348  11.452  -0.976
  272   1HE2  GLN  34          HE21      GLN  34  37.715  10.271  -0.679
  273   2HE2  GLN  34          HE22      GLN  34  37.350   9.502  -2.190
  274    H    ARG  35           HN       ARG  35  40.801  11.001   2.621
  275    HA   ARG  35           HA       ARG  35  42.840  13.062   2.164
  276   1HB   ARG  35          HB2       ARG  35  43.958  12.159   4.131
  277   2HB   ARG  35          HB1       ARG  35  42.279  12.523   4.508
  278   1HG   ARG  35          HG2       ARG  35  41.824  10.051   4.038
  279   2HG   ARG  35          HG1       ARG  35  43.575   9.847   4.137
  280   1HD   ARG  35          HD2       ARG  35  42.413  11.402   6.331
  281   2HD   ARG  35          HD1       ARG  35  41.851   9.732   6.252
  282    HE   ARG  35           HE       ARG  35  44.062   8.990   6.607
  283   1HH1  ARG  35          HH11      ARG  35  43.787  12.490   6.694
  284   2HH1  ARG  35          HH12      ARG  35  45.304  12.722   7.502
  285   1HH2  ARG  35          HH21      ARG  35  46.067   9.289   7.685
  286   2HH2  ARG  35          HH22      ARG  35  46.617  10.905   8.042
  287    H    TYR  36           HN       TYR  36  41.884  10.532   0.615
  288    HA   TYR  36           HA       TYR  36  44.274   8.934   0.431
  289   1HB   TYR  36          HB2       TYR  36  41.712   8.288   0.082
  290   2HB   TYR  36          HB1       TYR  36  42.077   8.732  -1.580
  291    HD1  TYR  36           HD1      TYR  36  41.393   6.290  -1.943
  292    HD2  TYR  36           HD2      TYR  36  44.925   7.428   0.138
  293    HE1  TYR  36           HE1      TYR  36  42.329   4.049  -2.317
  294    HE2  TYR  36           HE2      TYR  36  45.870   5.190  -0.234
  295    HH   TYR  36           HH       TYR  36  44.728   2.762  -0.658
  296   1HN   NH2  37          H1        NH2  37  43.807  10.989  -3.086
  297   2HN   NH2  37          H2        NH2  37  42.424  10.346  -2.276
  Start of MODEL    9
    1   1H    TYR   1          HT1       TYR   1  38.856  -1.217  -5.000
    2   2H    TYR   1          HT2       TYR   1  38.017   0.030  -5.793
    3   3H    TYR   1          HT3       TYR   1  39.125  -0.927  -6.649
    4    HA   TYR   1           HA       TYR   1  37.338  -2.017  -7.315
    5   1HB   TYR   1          HB2       TYR   1  38.564  -3.323  -5.274
    6   2HB   TYR   1          HB1       TYR   1  36.899  -3.302  -4.698
    7    HD1  TYR   1           HD1      TYR   1  37.312  -5.856  -4.913
    8    HD2  TYR   1           HD2      TYR   1  37.020  -3.229  -8.242
    9    HE1  TYR   1           HE1      TYR   1  36.780  -7.768  -6.367
   10    HE2  TYR   1           HE2      TYR   1  36.491  -5.129  -9.706
   11    HH   TYR   1           HH       TYR   1  36.501  -7.391  -9.871
   12    HA   PRO   2           HA       PRO   2  33.621  -0.868  -4.385
   13   1HB   PRO   2          HB2       PRO   2  34.169   1.043  -2.499
   14   2HB   PRO   2          HB1       PRO   2  34.153  -0.691  -2.162
   15   1HG   PRO   2          HG2       PRO   2  36.480   1.114  -2.709
   16   2HG   PRO   2          HG1       PRO   2  36.321  -0.176  -1.500
   17   1HD   PRO   2          HD2       PRO   2  37.661  -0.550  -3.801
   18   2HD   PRO   2          HD1       PRO   2  36.717  -1.849  -3.048
   19    H    ILE   3           HN       ILE   3  32.615   0.290  -5.904
   20    HA   ILE   3           HA       ILE   3  33.499   3.063  -6.375
   21    HB   ILE   3           HB       ILE   3  32.918   2.875  -8.691
   22   1HG1  ILE   3          HG12      ILE   3  32.132   0.000  -8.176
   23   2HG1  ILE   3          HG11      ILE   3  30.978   1.315  -8.372
   24   1HG2  ILE   3          HG21      ILE   3  34.391   0.758  -9.241
   25   2HG2  ILE   3          HG22      ILE   3  34.698   0.837  -7.505
   26   3HG2  ILE   3          HG23      ILE   3  35.089   2.215  -8.537
   27   1HD1  ILE   3          HD11      ILE   3  32.457  -0.199 -10.368
   28   2HD1  ILE   3          HD12      ILE   3  32.536   1.547 -10.612
   29   3HD1  ILE   3          HD13      ILE   3  30.971   0.738 -10.522
   30    H    LYS   4           HN       LYS   4  30.901   0.797  -6.039
   31    HA   LYS   4           HA       LYS   4  29.173   2.672  -4.841
   32   1HB   LYS   4          HB2       LYS   4  29.031   2.635  -7.690
   33   2HB   LYS   4          HB1       LYS   4  27.560   1.907  -7.065
   34   1HG   LYS   4          HG2       LYS   4  26.898   3.847  -5.994
   35   2HG   LYS   4          HG1       LYS   4  28.535   4.509  -5.969
   36   1HD   LYS   4          HD2       LYS   4  27.387   3.991  -8.640
   37   2HD   LYS   4          HD1       LYS   4  26.629   5.288  -7.716
   38   1HE   LYS   4          HE2       LYS   4  28.306   6.342  -8.960
   39   2HE   LYS   4          HE1       LYS   4  28.988   6.173  -7.344
   40   1HZ   LYS   4          HZ1       LYS   4  30.625   4.920  -8.125
   41   2HZ   LYS   4          HZ2       LYS   4  30.128   5.340  -9.690
   42   3HZ   LYS   4          HZ3       LYS   4  29.564   3.908  -8.979
   43    HA   PRO   5           HA       PRO   5  28.338  -1.619  -3.777
   44   1HB   PRO   5          HB2       PRO   5  27.442  -0.613  -1.213
   45   2HB   PRO   5          HB1       PRO   5  28.881  -1.562  -1.584
   46   1HG   PRO   5          HG2       PRO   5  28.964   1.042  -0.772
   47   2HG   PRO   5          HG1       PRO   5  30.212   0.290  -1.783
   48   1HD   PRO   5          HD2       PRO   5  27.938   2.068  -2.582
   49   2HD   PRO   5          HD1       PRO   5  29.619   2.052  -3.163
   50    H    GLU   6           HN       GLU   6  26.522  -1.800  -5.181
   51    HA   GLU   6           HA       GLU   6  23.939  -0.882  -4.545
   52   1HB   GLU   6          HB2       GLU   6  25.115  -2.912  -6.332
   53   2HB   GLU   6          HB1       GLU   6  23.476  -3.270  -5.804
   54   1HG   GLU   6          HG2       GLU   6  24.001  -0.530  -6.794
   55   2HG   GLU   6          HG1       GLU   6  24.025  -1.837  -7.978
   56    H    ALA   7           HN       ALA   7  22.780  -1.340  -2.806
   57    HA   ALA   7           HA       ALA   7  23.793  -3.088  -0.837
   58   1HB   ALA   7          HB1       ALA   7  21.516  -1.227  -1.067
   59   2HB   ALA   7          HB2       ALA   7  22.752  -1.370   0.181
   60   3HB   ALA   7          HB3       ALA   7  21.393  -2.490   0.158
   61    HA   PRO   8           HA       PRO   8  21.350  -6.720  -1.916
   62   1HB   PRO   8          HB2       PRO   8  22.851  -8.467  -0.536
   63   2HB   PRO   8          HB1       PRO   8  23.393  -7.823  -2.092
   64   1HG   PRO   8          HG2       PRO   8  24.229  -7.065   0.668
   65   2HG   PRO   8          HG1       PRO   8  25.208  -7.211  -0.802
   66   1HD   PRO   8          HD2       PRO   8  24.235  -4.830   0.242
   67   2HD   PRO   8          HD1       PRO   8  24.762  -5.069  -1.435
   68    H    GLY   9           HN       GLY   9  19.569  -7.325  -0.795
   69   1HA   GLY   9          HA2       GLY   9  19.646  -6.987   2.141
   70   2HA   GLY   9          HA1       GLY   9  18.292  -6.415   1.181
   71    H    GLU  10           HN       GLU  10  18.571  -8.825  -0.585
   72    HA   GLU  10           HA       GLU  10  16.739 -10.442   0.939
   73   1HB   GLU  10          HB2       GLU  10  17.342  -9.979  -1.828
   74   2HB   GLU  10          HB1       GLU  10  17.341 -11.708  -1.504
   75   1HG   GLU  10          HG2       GLU  10  15.102 -11.274  -0.329
   76   2HG   GLU  10          HG1       GLU  10  15.116  -9.734  -1.192
   77    H    ASP  11           HN       ASP  11  18.633 -10.870   2.476
   78    HA   ASP  11           HA       ASP  11  19.965 -12.400   3.483
   79   1HB   ASP  11          HB2       ASP  11  18.031 -13.878   2.728
   80   2HB   ASP  11          HB1       ASP  11  19.076 -14.389   1.405
   81    H    ALA  12           HN       ALA  12  21.858 -11.324   2.894
   82    HA   ALA  12           HA       ALA  12  23.257 -12.279   0.515
   83   1HB   ALA  12          HB1       ALA  12  23.767 -10.107   0.412
   84   2HB   ALA  12          HB2       ALA  12  24.918 -10.438   1.706
   85   3HB   ALA  12          HB3       ALA  12  23.307  -9.830   2.093
   86    H    SER  13           HN       SER  13  22.848 -13.479   3.423
   87    HA   SER  13           HA       SER  13  23.967 -14.827   4.855
   88   1HB   SER  13          HB2       SER  13  26.354 -14.990   3.056
   89   2HB   SER  13          HB1       SER  13  25.553 -16.264   3.974
   90    HG   SER  13           HG       SER  13  25.187 -15.525   1.409
   91    HA   PRO  14           HA       PRO  14  26.657 -12.374   7.358
   92   1HB   PRO  14          HB2       PRO  14  28.461 -14.252   8.289
   93   2HB   PRO  14          HB1       PRO  14  26.859 -13.963   8.976
   94   1HG   PRO  14          HG2       PRO  14  27.750 -16.078   7.063
   95   2HG   PRO  14          HG1       PRO  14  26.618 -16.198   8.423
   96   1HD   PRO  14          HD2       PRO  14  25.765 -16.066   5.881
   97   2HD   PRO  14          HD1       PRO  14  24.869 -15.291   7.205
   98    H    GLU  15           HN       GLU  15  27.912 -14.199   4.735
   99    HA   GLU  15           HA       GLU  15  30.590 -13.183   4.855
  100   1HB   GLU  15          HB2       GLU  15  29.086 -14.553   2.615
  101   2HB   GLU  15          HB1       GLU  15  30.805 -14.190   2.595
  102   1HG   GLU  15          HG2       GLU  15  29.405 -16.020   4.528
  103   2HG   GLU  15          HG1       GLU  15  30.402 -16.515   3.162
  104    H    GLU  16           HN       GLU  16  27.958 -12.664   2.500
  105    HA   GLU  16           HA       GLU  16  29.381 -10.499   1.290
  106   1HB   GLU  16          HB2       GLU  16  27.048 -12.118   0.653
  107   2HB   GLU  16          HB1       GLU  16  26.793 -10.416   0.287
  108   1HG   GLU  16          HG2       GLU  16  27.654 -11.253  -1.685
  109   2HG   GLU  16          HG1       GLU  16  29.071 -10.557  -0.902
  110    H    LEU  17           HN       LEU  17  26.735 -10.835   3.571
  111    HA   LEU  17           HA       LEU  17  25.830  -8.178   3.512
  112   1HB   LEU  17          HB2       LEU  17  24.813 -10.162   4.761
  113   2HB   LEU  17          HB1       LEU  17  25.997  -9.843   6.013
  114    HG   LEU  17           HG       LEU  17  24.721  -7.384   5.489
  115   1HD1  LEU  17          HD11      LEU  17  22.879  -9.731   5.443
  116   2HD1  LEU  17          HD12      LEU  17  22.819  -8.237   4.505
  117   3HD1  LEU  17          HD13      LEU  17  22.368  -8.228   6.210
  118   1HD2  LEU  17          HD21      LEU  17  25.556  -7.857   7.631
  119   2HD2  LEU  17          HD22      LEU  17  24.667  -9.377   7.733
  120   3HD2  LEU  17          HD23      LEU  17  23.801  -7.842   7.821
  121    H    ASN  18           HN       ASN  18  28.320  -9.722   5.516
  122    HA   ASN  18           HA       ASN  18  29.121  -7.275   6.738
  123   1HB   ASN  18          HB2       ASN  18  30.111  -8.689   8.157
  124   2HB   ASN  18          HB1       ASN  18  29.639 -10.035   7.131
  125   1HD2  ASN  18          HD21      ASN  18  32.206  -8.146   8.317
  126   2HD2  ASN  18          HD22      ASN  18  33.483  -8.909   7.434
  127    H    ARG  19           HN       ARG  19  30.149  -9.119   3.925
  128    HA   ARG  19           HA       ARG  19  32.561  -7.787   3.381
  129   1HB   ARG  19          HB2       ARG  19  30.932  -9.709   2.121
  130   2HB   ARG  19          HB1       ARG  19  31.140  -8.418   0.950
  131   1HG   ARG  19          HG2       ARG  19  32.807 -10.419   1.041
  132   2HG   ARG  19          HG1       ARG  19  33.393  -8.782   0.741
  133   1HD   ARG  19          HD2       ARG  19  34.843  -9.819   2.337
  134   2HD   ARG  19          HD1       ARG  19  33.899  -8.587   3.170
  135    HE   ARG  19           HE       ARG  19  33.033 -10.216   4.499
  136   1HH1  ARG  19          HH11      ARG  19  34.265 -11.768   1.597
  137   2HH1  ARG  19          HH12      ARG  19  33.993 -13.370   2.195
  138   1HH2  ARG  19          HH21      ARG  19  32.698 -12.319   5.279
  139   2HH2  ARG  19          HH22      ARG  19  33.086 -13.696   4.284
  140    H    TYR  20           HN       TYR  20  29.361  -7.205   1.894
  141    HA   TYR  20           HA       TYR  20  30.100  -4.797   0.638
  142   1HB   TYR  20          HB2       TYR  20  28.092  -5.098  -0.313
  143   2HB   TYR  20          HB1       TYR  20  27.771  -6.418   0.803
  144    HD1  TYR  20           HD1      TYR  20  26.342  -6.093   2.729
  145    HD2  TYR  20           HD2      TYR  20  27.181  -2.864   0.085
  146    HE1  TYR  20           HE1      TYR  20  24.492  -4.811   3.716
  147    HE2  TYR  20           HE2      TYR  20  25.332  -1.575   1.065
  148    HH   TYR  20           HH       TYR  20  22.996  -2.984   3.095
  149    H    TYR  21           HN       TYR  21  28.901  -5.543   3.814
  150    HA   TYR  21           HA       TYR  21  28.020  -3.132   4.780
  151   1HB   TYR  21          HB2       TYR  21  28.523  -5.594   5.838
  152   2HB   TYR  21          HB1       TYR  21  29.761  -4.623   6.628
  153    HD1  TYR  21           HD1      TYR  21  26.161  -5.167   6.237
  154    HD2  TYR  21           HD2      TYR  21  29.175  -2.935   8.229
  155    HE1  TYR  21           HE1      TYR  21  24.494  -4.387   7.861
  156    HE2  TYR  21           HE2      TYR  21  27.534  -2.148   9.861
  157    HH   TYR  21           HH       TYR  21  24.102  -2.737   9.448
  158    H    ALA  22           HN       ALA  22  31.317  -4.374   5.293
  159    HA   ALA  22           HA       ALA  22  32.171  -1.818   6.235
  160   1HB   ALA  22          HB1       ALA  22  33.109  -3.764   7.222
  161   2HB   ALA  22          HB2       ALA  22  34.397  -2.885   6.394
  162   3HB   ALA  22          HB3       ALA  22  33.706  -4.334   5.662
  163    H    SER  23           HN       SER  23  32.287  -3.465   3.150
  164    HA   SER  23           HA       SER  23  34.221  -1.814   1.922
  165   1HB   SER  23          HB2       SER  23  31.850  -3.220   0.672
  166   2HB   SER  23          HB1       SER  23  33.238  -2.575  -0.205
  167    HG   SER  23           HG       SER  23  33.116  -4.766   1.573
  168    H    LEU  24           HN       LEU  24  30.760  -1.464   2.399
  169    HA   LEU  24           HA       LEU  24  30.487   0.892   0.829
  170   1HB   LEU  24          HB2       LEU  24  28.457  -0.162   1.008
  171   2HB   LEU  24          HB1       LEU  24  28.774  -0.724   2.638
  172    HG   LEU  24           HG       LEU  24  28.535   1.926   3.102
  173   1HD1  LEU  24          HD11      LEU  24  27.515   1.561   0.461
  174   2HD1  LEU  24          HD12      LEU  24  27.608   3.042   1.425
  175   3HD1  LEU  24          HD13      LEU  24  26.191   1.991   1.545
  176   1HD2  LEU  24          HD21      LEU  24  26.246   1.428   3.838
  177   2HD2  LEU  24          HD22      LEU  24  27.385   0.164   4.307
  178   3HD2  LEU  24          HD23      LEU  24  26.299  -0.089   2.941
  179    H    ARG  25           HN       ARG  25  30.762   0.129   4.266
  180    HA   ARG  25           HA       ARG  25  30.455   2.752   5.210
  181   1HB   ARG  25          HB2       ARG  25  31.255   0.171   6.309
  182   2HB   ARG  25          HB1       ARG  25  32.083   1.523   7.072
  183   1HG   ARG  25          HG2       ARG  25  30.267   2.094   8.208
  184   2HG   ARG  25          HG1       ARG  25  29.276   2.080   6.750
  185   1HD   ARG  25          HD2       ARG  25  28.587  -0.069   7.065
  186   2HD   ARG  25          HD1       ARG  25  30.066  -0.536   7.904
  187    HE   ARG  25           HE       ARG  25  27.665   0.537   9.081
  188   1HH1  ARG  25          HH11      ARG  25  31.106   0.036   9.499
  189   2HH1  ARG  25          HH12      ARG  25  31.059   0.228  11.223
  190   1HH2  ARG  25          HH21      ARG  25  27.590   0.747  11.371
  191   2HH2  ARG  25          HH22      ARG  25  29.064   0.617  12.282
  192    H    HIS  26           HN       HIS  26  33.385   0.911   4.362
  193    HA   HIS  26           HA       HIS  26  35.125   3.037   5.158
  194   1HB   HIS  26          HB2       HIS  26  35.451   0.346   4.446
  195   2HB   HIS  26          HB1       HIS  26  36.373   1.269   3.260
  196    HD1  HIS  26           HD1      HIS  26  36.782   3.490   5.805
  197    HD2  HIS  26           HD2      HIS  26  38.080  -0.443   5.382
  198    HE1  HIS  26           HE1      HIS  26  38.739   3.248   7.368
  199    HE2  HIS  26           HE2      HIS  26  39.544   0.873   7.059
  200    H    TYR  27           HN       TYR  27  33.850   1.939   2.026
  201    HA   TYR  27           HA       TYR  27  35.251   3.824   0.459
  202   1HB   TYR  27          HB2       TYR  27  34.235   2.086  -0.768
  203   2HB   TYR  27          HB1       TYR  27  32.687   2.295   0.039
  204    HD1  TYR  27           HD1      TYR  27  31.061   3.808  -0.805
  205    HD2  TYR  27           HD2      TYR  27  34.953   3.725  -2.515
  206    HE1  TYR  27           HE1      TYR  27  30.263   5.204  -2.662
  207    HE2  TYR  27           HE2      TYR  27  34.173   5.134  -4.374
  208    HH   TYR  27           HH       TYR  27  30.858   6.440  -4.433
  209    H    LEU  28           HN       LEU  28  32.023   3.892   1.944
  210    HA   LEU  28           HA       LEU  28  31.298   6.472   1.059
  211   1HB   LEU  28          HB2       LEU  28  30.334   4.535   3.013
  212   2HB   LEU  28          HB1       LEU  28  30.072   6.189   3.530
  213    HG   LEU  28           HG       LEU  28  28.824   6.633   1.456
  214   1HD1  LEU  28          HD11      LEU  28  29.259   5.350  -0.300
  215   2HD1  LEU  28          HD12      LEU  28  28.194   4.159   0.447
  216   3HD1  LEU  28          HD13      LEU  28  29.937   4.068   0.704
  217   1HD2  LEU  28          HD21      LEU  28  27.783   5.719   3.580
  218   2HD2  LEU  28          HD22      LEU  28  27.717   4.168   2.745
  219   3HD2  LEU  28          HD23      LEU  28  26.845   5.557   2.095
  220    H    ASN  29           HN       ASN  29  32.980   5.435   4.006
  221    HA   ASN  29           HA       ASN  29  32.844   8.025   5.197
  222   1HB   ASN  29          HB2       ASN  29  33.388   6.946   7.077
  223   2HB   ASN  29          HB1       ASN  29  33.281   5.467   6.136
  224   1HD2  ASN  29          HD21      ASN  29  35.353   7.719   7.709
  225   2HD2  ASN  29          HD22      ASN  29  36.823   6.816   7.551
  226    H    LEU  30           HN       LEU  30  35.273   6.358   3.278
  227    HA   LEU  30           HA       LEU  30  37.276   8.333   4.014
  228   1HB   LEU  30          HB2       LEU  30  37.283   5.701   2.685
  229   2HB   LEU  30          HB1       LEU  30  38.494   6.839   2.121
  230    HG   LEU  30           HG       LEU  30  38.137   6.042   5.009
  231   1HD1  LEU  30          HD11      LEU  30  39.402   4.661   2.828
  232   2HD1  LEU  30          HD12      LEU  30  39.188   4.156   4.503
  233   3HD1  LEU  30          HD13      LEU  30  40.589   5.124   4.046
  234   1HD2  LEU  30          HD21      LEU  30  39.516   7.714   5.468
  235   2HD2  LEU  30          HD22      LEU  30  39.517   8.181   3.767
  236   3HD2  LEU  30          HD23      LEU  30  40.718   7.036   4.368
  237    H    VAL  31           HN       VAL  31  35.100   7.704   1.386
  238    HA   VAL  31           HA       VAL  31  36.589   9.303  -0.499
  239    HB   VAL  31           HB       VAL  31  34.930   7.300  -0.944
  240   1HG1  VAL  31          HG11      VAL  31  32.742   8.078  -1.753
  241   2HG1  VAL  31          HG12      VAL  31  33.100   9.690  -1.134
  242   3HG1  VAL  31          HG13      VAL  31  32.940   8.331  -0.020
  243   1HG2  VAL  31          HG21      VAL  31  36.023   7.943  -2.820
  244   2HG2  VAL  31          HG22      VAL  31  35.672   9.653  -2.574
  245   3HG2  VAL  31          HG23      VAL  31  34.431   8.584  -3.229
  246    H    THR  32           HN       THR  32  34.844  10.135   2.122
  247    HA   THR  32           HA       THR  32  33.023  12.084   1.286
  248    HB   THR  32           HB       THR  32  33.605  13.131   3.607
  249    HG1  THR  32           HG1      THR  32  34.603  10.608   4.276
  250   1HG2  THR  32          HG21      THR  32  31.699  12.068   4.049
  251   2HG2  THR  32          HG22      THR  32  32.630  10.619   4.427
  252   3HG2  THR  32          HG23      THR  32  32.028  10.879   2.789
  253    H    ARG  33           HN       ARG  33  36.489  12.277   1.862
  254    HA   ARG  33           HA       ARG  33  36.484  15.152   1.373
  255   1HB   ARG  33          HB2       ARG  33  38.028  13.451   2.972
  256   2HB   ARG  33          HB1       ARG  33  39.108  13.976   1.688
  257   1HG   ARG  33          HG2       ARG  33  37.493  15.825   3.431
  258   2HG   ARG  33          HG1       ARG  33  39.188  15.408   3.695
  259   1HD   ARG  33          HD2       ARG  33  39.642  16.264   1.369
  260   2HD   ARG  33          HD1       ARG  33  37.992  16.880   1.358
  261    HE   ARG  33           HE       ARG  33  40.114  17.776   3.200
  262   1HH1  ARG  33          HH11      ARG  33  37.067  18.298   1.542
  263   2HH1  ARG  33          HH12      ARG  33  37.011  19.997   1.924
  264   1HH2  ARG  33          HH21      ARG  33  40.012  20.009   3.720
  265   2HH2  ARG  33          HH22      ARG  33  38.671  20.955   3.149
  266    H    GLN  34           HN       GLN  34  36.416  12.541  -0.540
  267    HA   GLN  34           HA       GLN  34  37.048  11.994  -2.644
  268   1HB   GLN  34          HB2       GLN  34  36.361  14.572  -2.817
  269   2HB   GLN  34          HB1       GLN  34  38.058  14.723  -3.252
  270   1HG   GLN  34          HG2       GLN  34  37.642  14.017  -5.306
  271   2HG   GLN  34          HG1       GLN  34  36.905  12.538  -4.688
  272   1HE2  GLN  34          HE21      GLN  34  34.678  12.454  -4.414
  273   2HE2  GLN  34          HE22      GLN  34  33.610  13.602  -5.151
  274    H    ARG  35           HN       ARG  35  39.437  14.560  -2.506
  275    HA   ARG  35           HA       ARG  35  41.675  14.628  -2.238
  276   1HB   ARG  35          HB2       ARG  35  41.465  13.330  -0.220
  277   2HB   ARG  35          HB1       ARG  35  41.333  11.838  -1.140
  278   1HG   ARG  35          HG2       ARG  35  43.521  11.688  -0.584
  279   2HG   ARG  35          HG1       ARG  35  43.698  12.662  -2.046
  280   1HD   ARG  35          HD2       ARG  35  44.227  14.551  -0.894
  281   2HD   ARG  35          HD1       ARG  35  43.246  14.108   0.504
  282    HE   ARG  35           HE       ARG  35  45.909  12.981  -0.097
  283   1HH1  ARG  35          HH11      ARG  35  43.415  13.969   2.164
  284   2HH1  ARG  35          HH12      ARG  35  44.376  13.606   3.573
  285   1HH2  ARG  35          HH21      ARG  35  47.150  12.474   1.745
  286   2HH2  ARG  35          HH22      ARG  35  46.486  12.744   3.331
  287    H    TYR  36           HN       TYR  36  40.962  11.304  -3.299
  288    HA   TYR  36           HA       TYR  36  41.770  10.027  -4.979
  289   1HB   TYR  36          HB2       TYR  36  40.887  11.943  -6.385
  290   2HB   TYR  36          HB1       TYR  36  42.529  12.576  -6.411
  291    HD1  TYR  36           HD1      TYR  36  44.096  11.785  -7.975
  292    HD2  TYR  36           HD2      TYR  36  40.488   9.621  -7.352
  293    HE1  TYR  36           HE1      TYR  36  44.631  10.354  -9.901
  294    HE2  TYR  36           HE2      TYR  36  41.017   8.184  -9.274
  295    HH   TYR  36           HH       TYR  36  43.925   8.741 -11.253
  296   1HN   NH2  37          H1        NH2  37  45.503  11.642  -5.122
  297   2HN   NH2  37          H2        NH2  37  44.151  12.498  -5.770
  Start of MODEL   10
    1   1H    TYR   1          HT1       TYR   1  38.564  -4.533  -7.211
    2   2H    TYR   1          HT2       TYR   1  36.873  -4.459  -7.096
    3   3H    TYR   1          HT3       TYR   1  37.781  -5.144  -5.836
    4    HA   TYR   1           HA       TYR   1  38.413  -3.194  -4.973
    5   1HB   TYR   1          HB2       TYR   1  38.321  -1.059  -6.505
    6   2HB   TYR   1          HB1       TYR   1  39.672  -2.177  -6.630
    7    HD1  TYR   1           HD1      TYR   1  36.376  -1.386  -8.188
    8    HD2  TYR   1           HD2      TYR   1  40.251  -3.068  -8.695
    9    HE1  TYR   1           HE1      TYR   1  35.957  -1.609 -10.598
   10    HE2  TYR   1           HE2      TYR   1  39.842  -3.296 -11.110
   11    HH   TYR   1           HH       TYR   1  37.735  -3.517 -12.610
   12    HA   PRO   2           HA       PRO   2  34.294  -1.851  -3.988
   13   1HB   PRO   2          HB2       PRO   2  34.883   0.513  -2.726
   14   2HB   PRO   2          HB1       PRO   2  35.029  -1.075  -1.966
   15   1HG   PRO   2          HG2       PRO   2  37.144   0.643  -3.193
   16   2HG   PRO   2          HG1       PRO   2  37.205  -0.328  -1.709
   17   1HD   PRO   2          HD2       PRO   2  38.324  -1.164  -4.023
   18   2HD   PRO   2          HD1       PRO   2  37.601  -2.290  -2.859
   19    H    ILE   3           HN       ILE   3  33.340  -1.387  -5.924
   20    HA   ILE   3           HA       ILE   3  33.921   1.167  -7.210
   21    HB   ILE   3           HB       ILE   3  33.895  -0.542  -8.808
   22   1HG1  ILE   3          HG12      ILE   3  31.210  -0.113  -9.598
   23   2HG1  ILE   3          HG11      ILE   3  31.753   1.366  -8.811
   24   1HG2  ILE   3          HG21      ILE   3  32.905  -2.495  -8.480
   25   2HG2  ILE   3          HG22      ILE   3  31.313  -1.740  -8.538
   26   3HG2  ILE   3          HG23      ILE   3  32.185  -1.845  -7.006
   27   1HD1  ILE   3          HD11      ILE   3  32.558   1.888 -10.821
   28   2HD1  ILE   3          HD12      ILE   3  32.506   0.217 -11.386
   29   3HD1  ILE   3          HD13      ILE   3  33.869   0.779 -10.418
   30    H    LYS   4           HN       LYS   4  31.084  -0.674  -6.118
   31    HA   LYS   4           HA       LYS   4  29.872   1.461  -4.785
   32   1HB   LYS   4          HB2       LYS   4  29.618   2.250  -7.194
   33   2HB   LYS   4          HB1       LYS   4  28.526   0.892  -7.428
   34   1HG   LYS   4          HG2       LYS   4  27.088   1.782  -5.622
   35   2HG   LYS   4          HG1       LYS   4  28.161   3.182  -5.504
   36   1HD   LYS   4          HD2       LYS   4  26.034   3.430  -6.905
   37   2HD   LYS   4          HD1       LYS   4  27.549   3.977  -7.617
   38   1HE   LYS   4          HE2       LYS   4  26.646   2.792  -9.366
   39   2HE   LYS   4          HE1       LYS   4  27.624   1.551  -8.587
   40   1HZ   LYS   4          HZ1       LYS   4  25.076   1.550  -7.405
   41   2HZ   LYS   4          HZ2       LYS   4  25.818   0.334  -8.318
   42   3HZ   LYS   4          HZ3       LYS   4  24.882   1.519  -9.091
   43    HA   PRO   5           HA       PRO   5  27.838  -2.573  -4.029
   44   1HB   PRO   5          HB2       PRO   5  28.735  -3.012  -1.531
   45   2HB   PRO   5          HB1       PRO   5  29.702  -3.426  -2.952
   46   1HG   PRO   5          HG2       PRO   5  30.025  -1.198  -1.029
   47   2HG   PRO   5          HG1       PRO   5  31.243  -2.013  -2.021
   48   1HD   PRO   5          HD2       PRO   5  29.959   0.480  -2.540
   49   2HD   PRO   5          HD1       PRO   5  31.089  -0.392  -3.592
   50    H    GLU   6           HN       GLU   6  25.817  -1.519  -3.990
   51    HA   GLU   6           HA       GLU   6  25.158  -0.132  -1.480
   52   1HB   GLU   6          HB2       GLU   6  23.667   1.251  -2.623
   53   2HB   GLU   6          HB1       GLU   6  25.037   1.119  -3.712
   54   1HG   GLU   6          HG2       GLU   6  23.050  -0.930  -4.210
   55   2HG   GLU   6          HG1       GLU   6  22.385   0.698  -4.339
   56    H    ALA   7           HN       ALA   7  24.301  -2.786  -3.558
   57    HA   ALA   7           HA       ALA   7  22.247  -3.578  -1.621
   58   1HB   ALA   7          HB1       ALA   7  21.223  -4.246  -4.166
   59   2HB   ALA   7          HB2       ALA   7  21.669  -2.541  -4.207
   60   3HB   ALA   7          HB3       ALA   7  20.553  -3.131  -2.975
   61    HA   PRO   8           HA       PRO   8  24.329  -7.433  -2.611
   62   1HB   PRO   8          HB2       PRO   8  23.743  -8.700  -0.330
   63   2HB   PRO   8          HB1       PRO   8  24.946  -7.407  -0.383
   64   1HG   PRO   8          HG2       PRO   8  22.147  -7.348   0.628
   65   2HG   PRO   8          HG1       PRO   8  23.577  -6.490   1.226
   66   1HD   PRO   8          HD2       PRO   8  21.574  -5.431  -0.433
   67   2HD   PRO   8          HD1       PRO   8  23.160  -4.704  -0.111
   68    H    GLY   9           HN       GLY   9  21.008  -6.879  -1.805
   69   1HA   GLY   9          HA2       GLY   9  19.659  -8.312  -3.561
   70   2HA   GLY   9          HA1       GLY   9  20.204  -9.599  -2.490
   71    H    GLU  10           HN       GLU  10  18.735 -10.175  -1.038
   72    HA   GLU  10           HA       GLU  10  17.165  -8.054   0.260
   73   1HB   GLU  10          HB2       GLU  10  15.879  -9.385  -1.513
   74   2HB   GLU  10          HB1       GLU  10  16.007 -10.754  -0.416
   75   1HG   GLU  10          HG2       GLU  10  14.852  -9.445   1.315
   76   2HG   GLU  10          HG1       GLU  10  14.676  -8.121   0.163
   77    H    ASP  11           HN       ASP  11  18.705  -8.204   1.941
   78    HA   ASP  11           HA       ASP  11  19.524  -8.879   3.943
   79   1HB   ASP  11          HB2       ASP  11  17.170  -9.272   4.570
   80   2HB   ASP  11          HB1       ASP  11  17.277 -10.900   3.914
   81    H    ALA  12           HN       ALA  12  21.462  -9.581   3.148
   82    HA   ALA  12           HA       ALA  12  21.752 -12.305   2.200
   83   1HB   ALA  12          HB1       ALA  12  23.899 -11.722   1.515
   84   2HB   ALA  12          HB2       ALA  12  24.040 -10.431   2.705
   85   3HB   ALA  12          HB3       ALA  12  22.993 -10.224   1.303
   86    H    SER  13           HN       SER  13  23.643 -13.588   3.122
   87    HA   SER  13           HA       SER  13  23.214 -13.946   5.938
   88   1HB   SER  13          HB2       SER  13  25.426 -15.484   5.036
   89   2HB   SER  13          HB1       SER  13  23.777 -16.036   5.336
   90    HG   SER  13           HG       SER  13  23.385 -16.043   3.262
   91    HA   PRO  14           HA       PRO  14  26.681 -11.735   7.701
   92   1HB   PRO  14          HB2       PRO  14  27.799 -13.816   9.187
   93   2HB   PRO  14          HB1       PRO  14  26.536 -12.715   9.746
   94   1HG   PRO  14          HG2       PRO  14  26.299 -15.478   8.649
   95   2HG   PRO  14          HG1       PRO  14  25.371 -14.696   9.944
   96   1HD   PRO  14          HD2       PRO  14  24.336 -15.038   7.501
   97   2HD   PRO  14          HD1       PRO  14  23.997 -13.571   8.444
   98    H    GLU  15           HN       GLU  15  28.861 -11.503   7.412
   99    HA   GLU  15           HA       GLU  15  30.956 -11.767   6.574
  100   1HB   GLU  15          HB2       GLU  15  30.464 -14.342   6.997
  101   2HB   GLU  15          HB1       GLU  15  30.360 -14.376   5.244
  102   1HG   GLU  15          HG2       GLU  15  32.624 -14.793   6.563
  103   2HG   GLU  15          HG1       GLU  15  32.575 -14.042   4.967
  104    H    GLU  16           HN       GLU  16  28.387 -13.019   4.503
  105    HA   GLU  16           HA       GLU  16  29.433 -11.920   2.098
  106   1HB   GLU  16          HB2       GLU  16  26.923 -13.199   3.011
  107   2HB   GLU  16          HB1       GLU  16  26.806 -12.189   1.577
  108   1HG   GLU  16          HG2       GLU  16  27.955 -14.844   1.912
  109   2HG   GLU  16          HG1       GLU  16  27.358 -14.043   0.461
  110    H    LEU  17           HN       LEU  17  26.654 -11.031   4.139
  111    HA   LEU  17           HA       LEU  17  26.212  -8.469   3.116
  112   1HB   LEU  17          HB2       LEU  17  25.341 -10.008   5.378
  113   2HB   LEU  17          HB1       LEU  17  25.764  -8.395   5.924
  114    HG   LEU  17           HG       LEU  17  23.765  -9.049   3.751
  115   1HD1  LEU  17          HD11      LEU  17  23.516  -8.328   6.645
  116   2HD1  LEU  17          HD12      LEU  17  22.708  -9.608   5.739
  117   3HD1  LEU  17          HD13      LEU  17  22.236  -7.925   5.501
  118   1HD2  LEU  17          HD21      LEU  17  23.222  -6.629   3.908
  119   2HD2  LEU  17          HD22      LEU  17  24.825  -6.954   3.250
  120   3HD2  LEU  17          HD23      LEU  17  24.650  -6.416   4.922
  121    H    ASN  18           HN       ASN  18  28.348  -9.623   5.669
  122    HA   ASN  18           HA       ASN  18  29.318  -7.165   6.583
  123   1HB   ASN  18          HB2       ASN  18  29.813  -9.020   7.937
  124   2HB   ASN  18          HB1       ASN  18  30.439  -9.957   6.585
  125   1HD2  ASN  18          HD21      ASN  18  32.573 -10.038   6.326
  126   2HD2  ASN  18          HD22      ASN  18  33.710  -8.986   7.103
  127    H    ARG  19           HN       ARG  19  30.495  -9.298   4.002
  128    HA   ARG  19           HA       ARG  19  32.816  -7.903   3.316
  129   1HB   ARG  19          HB2       ARG  19  31.130  -9.934   2.131
  130   2HB   ARG  19          HB1       ARG  19  31.746  -8.834   0.907
  131   1HG   ARG  19          HG2       ARG  19  33.790  -9.701   1.019
  132   2HG   ARG  19          HG1       ARG  19  33.804  -9.639   2.784
  133   1HD   ARG  19          HD2       ARG  19  34.028 -11.932   1.950
  134   2HD   ARG  19          HD1       ARG  19  32.553 -11.717   2.890
  135    HE   ARG  19           HE       ARG  19  31.295 -12.061   0.980
  136   1HH1  ARG  19          HH11      ARG  19  34.710 -11.929   0.174
  137   2HH1  ARG  19          HH12      ARG  19  34.455 -12.461  -1.470
  138   1HH2  ARG  19          HH21      ARG  19  30.966 -12.763  -1.124
  139   2HH2  ARG  19          HH22      ARG  19  32.323 -12.932  -2.205
  140    H    TYR  20           HN       TYR  20  29.620  -7.681   1.778
  141    HA   TYR  20           HA       TYR  20  30.251  -5.481   0.133
  142   1HB   TYR  20          HB2       TYR  20  28.321  -6.250  -0.713
  143   2HB   TYR  20          HB1       TYR  20  27.939  -7.105   0.771
  144    HD1  TYR  20           HD1      TYR  20  27.238  -4.220  -1.275
  145    HD2  TYR  20           HD2      TYR  20  26.652  -5.944   2.564
  146    HE1  TYR  20           HE1      TYR  20  25.361  -2.686  -0.884
  147    HE2  TYR  20           HE2      TYR  20  24.768  -4.405   2.975
  148    HH   TYR  20           HH       TYR  20  23.735  -2.077   0.471
  149    H    TYR  21           HN       TYR  21  28.954  -5.728   3.373
  150    HA   TYR  21           HA       TYR  21  28.118  -3.096   3.798
  151   1HB   TYR  21          HB2       TYR  21  27.951  -5.326   5.230
  152   2HB   TYR  21          HB1       TYR  21  29.384  -4.662   6.007
  153    HD1  TYR  21           HD1      TYR  21  25.806  -4.215   5.412
  154    HD2  TYR  21           HD2      TYR  21  29.247  -2.728   7.404
  155    HE1  TYR  21           HE1      TYR  21  24.368  -2.831   6.835
  156    HE2  TYR  21           HE2      TYR  21  27.838  -1.338   8.835
  157    HH   TYR  21           HH       TYR  21  24.296  -1.544   8.702
  158    H    ALA  22           HN       ALA  22  31.175  -4.652   4.713
  159    HA   ALA  22           HA       ALA  22  32.285  -2.273   5.764
  160   1HB   ALA  22          HB1       ALA  22  33.263  -5.024   5.248
  161   2HB   ALA  22          HB2       ALA  22  33.240  -4.079   6.738
  162   3HB   ALA  22          HB3       ALA  22  34.460  -3.749   5.503
  163    H    SER  23           HN       SER  23  32.267  -3.685   2.564
  164    HA   SER  23           HA       SER  23  34.324  -1.964   1.541
  165   1HB   SER  23          HB2       SER  23  32.160  -3.449   0.028
  166   2HB   SER  23          HB1       SER  23  33.638  -2.765  -0.654
  167    HG   SER  23           HG       SER  23  33.294  -5.027   0.977
  168    H    LEU  24           HN       LEU  24  30.925  -1.701   2.104
  169    HA   LEU  24           HA       LEU  24  30.446   0.530   0.401
  170   1HB   LEU  24          HB2       LEU  24  28.538  -0.746   0.879
  171   2HB   LEU  24          HB1       LEU  24  28.923  -0.850   2.587
  172    HG   LEU  24           HG       LEU  24  28.528   1.780   2.461
  173   1HD1  LEU  24          HD11      LEU  24  26.735   2.354   0.947
  174   2HD1  LEU  24          HD12      LEU  24  26.723   0.715   0.293
  175   3HD1  LEU  24          HD13      LEU  24  28.121   1.758   0.032
  176   1HD2  LEU  24          HD21      LEU  24  27.279   0.621   4.010
  177   2HD2  LEU  24          HD22      LEU  24  26.612  -0.482   2.808
  178   3HD2  LEU  24          HD23      LEU  24  26.032   1.178   2.898
  179    H    ARG  25           HN       ARG  25  30.860   0.064   3.906
  180    HA   ARG  25           HA       ARG  25  30.883   2.848   4.460
  181   1HB   ARG  25          HB2       ARG  25  31.859   2.151   6.676
  182   2HB   ARG  25          HB1       ARG  25  30.310   1.429   6.272
  183   1HG   ARG  25          HG2       ARG  25  32.022  -0.434   5.299
  184   2HG   ARG  25          HG1       ARG  25  32.931   0.187   6.679
  185   1HD   ARG  25          HD2       ARG  25  30.048  -0.436   7.057
  186   2HD   ARG  25          HD1       ARG  25  31.178  -1.782   6.928
  187    HE   ARG  25           HE       ARG  25  31.630   0.373   8.882
  188   1HH1  ARG  25          HH11      ARG  25  31.040  -3.013   8.190
  189   2HH1  ARG  25          HH12      ARG  25  31.451  -3.550   9.788
  190   1HH2  ARG  25          HH21      ARG  25  32.164  -0.310  10.971
  191   2HH2  ARG  25          HH22      ARG  25  32.096  -2.000  11.385
  192    H    HIS  26           HN       HIS  26  33.337   0.559   3.498
  193    HA   HIS  26           HA       HIS  26  35.624   2.088   4.137
  194   1HB   HIS  26          HB2       HIS  26  35.022  -0.272   2.555
  195   2HB   HIS  26          HB1       HIS  26  36.158   0.771   1.706
  196    HD1  HIS  26           HD1      HIS  26  36.842  -2.062   2.949
  197    HD2  HIS  26           HD2      HIS  26  37.699   1.640   4.640
  198    HE1  HIS  26           HE1      HIS  26  38.760  -2.462   4.528
  199    HE2  HIS  26           HE2      HIS  26  39.403  -0.171   5.354
  200    H    TYR  27           HN       TYR  27  33.870   1.695   1.085
  201    HA   TYR  27           HA       TYR  27  35.010   3.804  -0.313
  202   1HB   TYR  27          HB2       TYR  27  33.376   1.956  -1.115
  203   2HB   TYR  27          HB1       TYR  27  32.103   3.047  -0.588
  204    HD1  TYR  27           HD1      TYR  27  32.532   5.582  -1.514
  205    HD2  TYR  27           HD2      TYR  27  33.848   1.979  -3.366
  206    HE1  TYR  27           HE1      TYR  27  32.619   6.733  -3.677
  207    HE2  TYR  27           HE2      TYR  27  33.943   3.134  -5.533
  208    HH   TYR  27           HH       TYR  27  32.914   5.096  -6.616
  209    H    LEU  28           HN       LEU  28  32.125   3.719   1.765
  210    HA   LEU  28           HA       LEU  28  31.585   6.507   1.320
  211   1HB   LEU  28          HB2       LEU  28  30.324   4.277   2.707
  212   2HB   LEU  28          HB1       LEU  28  30.115   5.811   3.532
  213    HG   LEU  28           HG       LEU  28  28.232   5.529   2.118
  214   1HD1  LEU  28          HD11      LEU  28  29.531   7.758   2.109
  215   2HD1  LEU  28          HD12      LEU  28  28.258   7.502   0.914
  216   3HD1  LEU  28          HD13      LEU  28  29.951   7.317   0.452
  217   1HD2  LEU  28          HD21      LEU  28  28.223   4.518   0.119
  218   2HD2  LEU  28          HD22      LEU  28  29.842   3.974   0.558
  219   3HD2  LEU  28          HD23      LEU  28  29.635   5.411  -0.446
  220    H    ASN  29           HN       ASN  29  33.942   5.101   3.198
  221    HA   ASN  29           HA       ASN  29  33.913   7.417   5.019
  222   1HB   ASN  29          HB2       ASN  29  35.037   4.681   5.210
  223   2HB   ASN  29          HB1       ASN  29  36.071   5.958   5.843
  224   1HD2  ASN  29          HD21      ASN  29  32.553   5.863   5.846
  225   2HD2  ASN  29          HD22      ASN  29  32.380   5.817   7.565
  226    H    LEU  30           HN       LEU  30  35.593   6.070   2.280
  227    HA   LEU  30           HA       LEU  30  37.585   8.104   2.292
  228   1HB   LEU  30          HB2       LEU  30  36.399   6.313   0.197
  229   2HB   LEU  30          HB1       LEU  30  37.481   7.615  -0.258
  230    HG   LEU  30           HG       LEU  30  39.242   6.361   0.204
  231   1HD1  LEU  30          HD11      LEU  30  38.583   5.208   2.785
  232   2HD1  LEU  30          HD12      LEU  30  38.399   6.962   2.745
  233   3HD1  LEU  30          HD13      LEU  30  39.944   6.224   2.312
  234   1HD2  LEU  30          HD21      LEU  30  38.930   3.955   0.729
  235   2HD2  LEU  30          HD22      LEU  30  37.982   4.528  -0.643
  236   3HD2  LEU  30          HD23      LEU  30  37.205   4.279   0.922
  237    H    VAL  31           HN       VAL  31  34.243   7.906   1.630
  238    HA   VAL  31           HA       VAL  31  34.152  10.612   0.543
  239    HB   VAL  31           HB       VAL  31  31.841   8.734   1.062
  240   1HG1  VAL  31          HG11      VAL  31  30.600  10.219  -0.435
  241   2HG1  VAL  31          HG12      VAL  31  32.024  11.247  -0.609
  242   3HG1  VAL  31          HG13      VAL  31  31.221  11.109   0.956
  243   1HG2  VAL  31          HG21      VAL  31  32.152   8.951  -1.675
  244   2HG2  VAL  31          HG22      VAL  31  32.617   7.566  -0.687
  245   3HG2  VAL  31          HG23      VAL  31  33.808   8.806  -1.089
  246    H    THR  32           HN       THR  32  34.868  11.703   2.332
  247    HA   THR  32           HA       THR  32  34.549  13.169   4.021
  248    HB   THR  32           HB       THR  32  32.466  13.989   4.533
  249    HG1  THR  32           HG1      THR  32  30.682  12.080   3.990
  250   1HG2  THR  32          HG21      THR  32  30.967  13.741   2.558
  251   2HG2  THR  32          HG22      THR  32  32.040  12.472   1.969
  252   3HG2  THR  32          HG23      THR  32  32.641  14.122   2.144
  253    H    ARG  33           HN       ARG  33  34.738  10.066   4.327
  254    HA   ARG  33           HA       ARG  33  34.770   8.469   5.926
  255   1HB   ARG  33          HB2       ARG  33  36.341  10.448   6.764
  256   2HB   ARG  33          HB1       ARG  33  35.166  10.492   8.075
  257   1HG   ARG  33          HG2       ARG  33  35.856   7.786   7.654
  258   2HG   ARG  33          HG1       ARG  33  37.354   8.717   7.670
  259   1HD   ARG  33          HD2       ARG  33  37.172   9.209   9.854
  260   2HD   ARG  33          HD1       ARG  33  35.426   9.449   9.758
  261    HE   ARG  33           HE       ARG  33  35.099   7.174  10.160
  262   1HH1  ARG  33          HH11      ARG  33  38.515   7.972  10.061
  263   2HH1  ARG  33          HH12      ARG  33  39.014   6.468  10.779
  264   1HH2  ARG  33          HH21      ARG  33  35.760   5.192  11.091
  265   2HH2  ARG  33          HH22      ARG  33  37.450   4.889  11.367
  266    H    GLN  34           HN       GLN  34  32.247   9.756   5.271
  267    HA   GLN  34           HA       GLN  34  30.078   9.874   5.939
  268   1HB   GLN  34          HB2       GLN  34  30.773   7.413   6.415
  269   2HB   GLN  34          HB1       GLN  34  30.672   7.885   8.107
  270   1HG   GLN  34          HG2       GLN  34  28.570   7.056   7.753
  271   2HG   GLN  34          HG1       GLN  34  28.312   8.765   7.418
  272   1HE2  GLN  34          HE21      GLN  34  29.993   8.073   4.848
  273   2HE2  GLN  34          HE22      GLN  34  28.773   7.481   3.776
  274    H    ARG  35           HN       ARG  35  31.470  11.938   6.930
  275    HA   ARG  35           HA       ARG  35  29.979  12.535   9.338
  276   1HB   ARG  35          HB2       ARG  35  32.811  11.899   9.424
  277   2HB   ARG  35          HB1       ARG  35  32.501  13.527  10.007
  278   1HG   ARG  35          HG2       ARG  35  31.342  10.960  11.064
  279   2HG   ARG  35          HG1       ARG  35  32.476  12.043  11.872
  280   1HD   ARG  35          HD2       ARG  35  29.674  12.804  11.063
  281   2HD   ARG  35          HD1       ARG  35  30.126  12.245  12.671
  282    HE   ARG  35           HE       ARG  35  31.724  14.459  11.857
  283   1HH1  ARG  35          HH11      ARG  35  28.569  13.599  13.115
  284   2HH1  ARG  35          HH12      ARG  35  28.293  15.151  13.852
  285   1HH2  ARG  35          HH21      ARG  35  31.355  16.515  12.794
  286   2HH2  ARG  35          HH22      ARG  35  29.878  16.811  13.665
  287    H    TYR  36           HN       TYR  36  32.495  13.666   7.093
  288    HA   TYR  36           HA       TYR  36  31.576  16.417   7.466
  289   1HB   TYR  36          HB2       TYR  36  33.809  15.680   5.606
  290   2HB   TYR  36          HB1       TYR  36  33.610  17.126   6.588
  291    HD1  TYR  36           HD1      TYR  36  35.413  14.157   6.258
  292    HD2  TYR  36           HD2      TYR  36  33.615  16.631   9.211
  293    HE1  TYR  36           HE1      TYR  36  36.887  13.176   7.965
  294    HE2  TYR  36           HE2      TYR  36  35.079  15.657  10.927
  295    HH   TYR  36           HH       TYR  36  36.788  14.304  11.337
  296   1HN   NH2  37          H1        NH2  37  29.521  15.396   4.574
  297   2HN   NH2  37          H2        NH2  37  29.614  15.017   6.256
  Start of MODEL   11
    1   1H    TYR   1          HT1       TYR   1  38.222  -5.352  -5.127
    2   2H    TYR   1          HT2       TYR   1  36.984  -4.586  -4.248
    3   3H    TYR   1          HT3       TYR   1  38.605  -4.389  -3.787
    4    HA   TYR   1           HA       TYR   1  39.010  -2.809  -5.269
    5   1HB   TYR   1          HB2       TYR   1  38.204  -4.802  -7.006
    6   2HB   TYR   1          HB1       TYR   1  37.094  -3.484  -7.374
    7    HD1  TYR   1           HD1      TYR   1  40.621  -4.532  -7.358
    8    HD2  TYR   1           HD2      TYR   1  37.878  -1.450  -8.401
    9    HE1  TYR   1           HE1      TYR   1  42.362  -3.444  -8.706
   10    HE2  TYR   1           HE2      TYR   1  39.613  -0.356  -9.754
   11    HH   TYR   1           HH       TYR   1  42.896  -1.724  -9.997
   12    HA   PRO   2           HA       PRO   2  35.631  -0.176  -4.059
   13   1HB   PRO   2          HB2       PRO   2  36.973   1.911  -5.636
   14   2HB   PRO   2          HB1       PRO   2  36.658   1.846  -3.900
   15   1HG   PRO   2          HG2       PRO   2  39.138   1.571  -4.887
   16   2HG   PRO   2          HG1       PRO   2  38.598   0.674  -3.453
   17   1HD   PRO   2          HD2       PRO   2  38.836  -0.261  -6.296
   18   2HD   PRO   2          HD1       PRO   2  39.311  -1.090  -4.797
   19    H    ILE   3           HN       ILE   3  34.262  -1.462  -5.586
   20    HA   ILE   3           HA       ILE   3  33.767  -0.133  -8.119
   21    HB   ILE   3           HB       ILE   3  33.744  -2.460  -8.372
   22   1HG1  ILE   3          HG12      ILE   3  30.790  -1.980  -8.090
   23   2HG1  ILE   3          HG11      ILE   3  31.729  -1.131  -9.314
   24   1HG2  ILE   3          HG21      ILE   3  32.891  -2.528  -5.700
   25   2HG2  ILE   3          HG22      ILE   3  33.359  -3.881  -6.729
   26   3HG2  ILE   3          HG23      ILE   3  31.669  -3.386  -6.637
   27   1HD1  ILE   3          HD11      ILE   3  30.563  -3.220 -10.068
   28   2HD1  ILE   3          HD12      ILE   3  31.699  -4.123  -9.065
   29   3HD1  ILE   3          HD13      ILE   3  32.292  -3.146 -10.407
   30    H    LYS   4           HN       LYS   4  31.259  -1.456  -5.999
   31    HA   LYS   4           HA       LYS   4  30.224   1.023  -5.121
   32   1HB   LYS   4          HB2       LYS   4  29.647   0.549  -7.783
   33   2HB   LYS   4          HB1       LYS   4  28.216  -0.054  -6.956
   34   1HG   LYS   4          HG2       LYS   4  27.654   2.016  -6.125
   35   2HG   LYS   4          HG1       LYS   4  29.305   2.629  -6.255
   36   1HD   LYS   4          HD2       LYS   4  28.991   3.338  -8.351
   37   2HD   LYS   4          HD1       LYS   4  28.176   1.846  -8.824
   38   1HE   LYS   4          HE2       LYS   4  26.534   3.422  -7.043
   39   2HE   LYS   4          HE1       LYS   4  27.021   4.359  -8.456
   40   1HZ   LYS   4          HZ1       LYS   4  26.284   2.285  -9.749
   41   2HZ   LYS   4          HZ2       LYS   4  25.090   3.322  -9.144
   42   3HZ   LYS   4          HZ3       LYS   4  25.441   1.869  -8.337
   43    HA   PRO   5           HA       PRO   5  28.420  -2.453  -2.811
   44   1HB   PRO   5          HB2       PRO   5  28.643  -1.354  -0.380
   45   2HB   PRO   5          HB1       PRO   5  30.050  -2.041  -1.204
   46   1HG   PRO   5          HG2       PRO   5  29.229   0.819  -0.910
   47   2HG   PRO   5          HG1       PRO   5  30.849   0.105  -0.821
   48   1HD   PRO   5          HD2       PRO   5  29.796   1.375  -3.048
   49   2HD   PRO   5          HD1       PRO   5  31.137   0.213  -3.082
   50    H    GLU   6           HN       GLU   6  26.633  -1.208  -4.243
   51    HA   GLU   6           HA       GLU   6  24.966   0.673  -2.947
   52   1HB   GLU   6          HB2       GLU   6  25.161  -0.378  -5.492
   53   2HB   GLU   6          HB1       GLU   6  23.635  -1.031  -4.916
   54   1HG   GLU   6          HG2       GLU   6  22.629   1.001  -4.828
   55   2HG   GLU   6          HG1       GLU   6  24.133   1.854  -4.489
   56    H    ALA   7           HN       ALA   7  24.138  -2.686  -3.817
   57    HA   ALA   7           HA       ALA   7  23.279  -3.466  -1.260
   58   1HB   ALA   7          HB1       ALA   7  20.731  -3.490  -2.110
   59   2HB   ALA   7          HB2       ALA   7  21.289  -2.005  -2.879
   60   3HB   ALA   7          HB3       ALA   7  21.414  -2.192  -1.131
   61    HA   PRO   8           HA       PRO   8  23.436  -7.062  -4.070
   62   1HB   PRO   8          HB2       PRO   8  24.229  -8.445  -1.615
   63   2HB   PRO   8          HB1       PRO   8  25.102  -8.306  -3.141
   64   1HG   PRO   8          HG2       PRO   8  25.914  -7.062  -0.882
   65   2HG   PRO   8          HG1       PRO   8  26.185  -6.382  -2.496
   66   1HD   PRO   8          HD2       PRO   8  24.104  -5.674  -0.463
   67   2HD   PRO   8          HD1       PRO   8  25.053  -4.610  -1.525
   68    H    GLY   9           HN       GLY   9  22.047  -6.466  -0.942
   69   1HA   GLY   9          HA2       GLY   9  19.507  -7.251  -1.318
   70   2HA   GLY   9          HA1       GLY   9  20.316  -8.779  -0.988
   71    H    GLU  10           HN       GLU  10  18.393  -6.812   0.502
   72    HA   GLU  10           HA       GLU  10  19.886  -6.162   2.879
   73   1HB   GLU  10          HB2       GLU  10  16.910  -6.077   2.336
   74   2HB   GLU  10          HB1       GLU  10  17.704  -5.395   3.748
   75   1HG   GLU  10          HG2       GLU  10  17.515  -3.529   2.467
   76   2HG   GLU  10          HG1       GLU  10  19.095  -4.096   1.933
   77    H    ASP  11           HN       ASP  11  20.299  -8.733   2.531
   78    HA   ASP  11           HA       ASP  11  19.505  -9.923   4.951
   79   1HB   ASP  11          HB2       ASP  11  17.460 -10.684   4.281
   80   2HB   ASP  11          HB1       ASP  11  17.856 -10.544   2.574
   81    H    ALA  12           HN       ALA  12  20.200 -10.970   1.620
   82    HA   ALA  12           HA       ALA  12  21.810 -12.343   0.751
   83   1HB   ALA  12          HB1       ALA  12  23.665 -10.650   2.397
   84   2HB   ALA  12          HB2       ALA  12  22.800 -10.038   0.986
   85   3HB   ALA  12          HB3       ALA  12  23.949 -11.363   0.808
   86    H    SER  13           HN       SER  13  24.124 -11.953   3.192
   87    HA   SER  13           HA       SER  13  23.412 -14.283   4.726
   88   1HB   SER  13          HB2       SER  13  25.210 -15.681   4.115
   89   2HB   SER  13          HB1       SER  13  24.670 -15.044   2.562
   90    HG   SER  13           HG       SER  13  26.716 -14.530   2.389
   91    HA   PRO  14           HA       PRO  14  25.564 -12.118   7.949
   92   1HB   PRO  14          HB2       PRO  14  27.220 -14.560   8.382
   93   2HB   PRO  14          HB1       PRO  14  26.266 -13.623   9.539
   94   1HG   PRO  14          HG2       PRO  14  25.383 -15.974   8.649
   95   2HG   PRO  14          HG1       PRO  14  24.269 -14.616   8.905
   96   1HD   PRO  14          HD2       PRO  14  25.369 -15.713   6.355
   97   2HD   PRO  14          HD1       PRO  14  23.762 -15.041   6.697
   98    H    GLU  15           HN       GLU  15  27.557 -14.047   5.761
   99    HA   GLU  15           HA       GLU  15  29.924 -12.491   6.313
  100   1HB   GLU  15          HB2       GLU  15  29.286 -15.003   5.004
  101   2HB   GLU  15          HB1       GLU  15  30.423 -14.045   4.063
  102   1HG   GLU  15          HG2       GLU  15  30.853 -14.506   6.987
  103   2HG   GLU  15          HG1       GLU  15  31.342 -15.706   5.790
  104    H    GLU  16           HN       GLU  16  27.570 -12.794   3.702
  105    HA   GLU  16           HA       GLU  16  28.978 -11.148   1.864
  106   1HB   GLU  16          HB2       GLU  16  26.420 -12.549   1.949
  107   2HB   GLU  16          HB1       GLU  16  26.310 -10.997   1.132
  108   1HG   GLU  16          HG2       GLU  16  26.776 -12.601  -0.530
  109   2HG   GLU  16          HG1       GLU  16  28.275 -11.712  -0.260
  110    H    LEU  17           HN       LEU  17  26.400 -10.594   4.224
  111    HA   LEU  17           HA       LEU  17  25.992  -7.859   3.644
  112   1HB   LEU  17          HB2       LEU  17  24.910  -9.702   5.406
  113   2HB   LEU  17          HB1       LEU  17  25.713  -8.553   6.463
  114    HG   LEU  17           HG       LEU  17  24.447  -6.732   5.220
  115   1HD1  LEU  17          HD11      LEU  17  22.444  -7.360   4.038
  116   2HD1  LEU  17          HD12      LEU  17  22.771  -9.071   4.320
  117   3HD1  LEU  17          HD13      LEU  17  23.836  -8.129   3.275
  118   1HD2  LEU  17          HD21      LEU  17  22.209  -7.846   6.389
  119   2HD2  LEU  17          HD22      LEU  17  23.415  -6.839   7.186
  120   3HD2  LEU  17          HD23      LEU  17  23.551  -8.596   7.253
  121    H    ASN  18           HN       ASN  18  28.175  -9.570   5.832
  122    HA   ASN  18           HA       ASN  18  29.415  -7.301   6.954
  123   1HB   ASN  18          HB2       ASN  18  29.887  -9.248   8.132
  124   2HB   ASN  18          HB1       ASN  18  30.150 -10.193   6.674
  125   1HD2  ASN  18          HD21      ASN  18  32.166 -10.850   6.510
  126   2HD2  ASN  18          HD22      ASN  18  33.567  -9.948   6.979
  127    H    ARG  19           HN       ARG  19  30.088  -9.214   4.061
  128    HA   ARG  19           HA       ARG  19  32.497  -7.974   3.319
  129   1HB   ARG  19          HB2       ARG  19  30.381  -9.504   1.908
  130   2HB   ARG  19          HB1       ARG  19  31.509  -8.587   0.917
  131   1HG   ARG  19          HG2       ARG  19  33.376  -9.734   2.099
  132   2HG   ARG  19          HG1       ARG  19  32.178 -10.748   2.903
  133   1HD   ARG  19          HD2       ARG  19  31.849 -10.635   0.007
  134   2HD   ARG  19          HD1       ARG  19  33.409 -11.285   0.502
  135    HE   ARG  19           HE       ARG  19  30.944 -12.629   0.593
  136   1HH1  ARG  19          HH11      ARG  19  33.794 -12.162   2.589
  137   2HH1  ARG  19          HH12      ARG  19  33.624 -13.689   3.398
  138   1HH2  ARG  19          HH21      ARG  19  30.758 -14.629   1.612
  139   2HH2  ARG  19          HH22      ARG  19  31.927 -15.106   2.810
  140    H    TYR  20           HN       TYR  20  29.206  -7.268   2.175
  141    HA   TYR  20           HA       TYR  20  29.916  -4.950   0.725
  142   1HB   TYR  20          HB2       TYR  20  27.817  -5.319   0.020
  143   2HB   TYR  20          HB1       TYR  20  27.519  -6.414   1.361
  144    HD1  TYR  20           HD1      TYR  20  26.976  -3.082   0.030
  145    HD2  TYR  20           HD2      TYR  20  26.509  -5.564   3.455
  146    HE1  TYR  20           HE1      TYR  20  25.362  -1.478   0.956
  147    HE2  TYR  20           HE2      TYR  20  24.888  -3.963   4.401
  148    HH   TYR  20           HH       TYR  20  23.350  -2.202   3.597
  149    H    TYR  21           HN       TYR  21  29.105  -5.545   4.044
  150    HA   TYR  21           HA       TYR  21  28.535  -2.995   4.986
  151   1HB   TYR  21          HB2       TYR  21  28.650  -5.428   6.093
  152   2HB   TYR  21          HB1       TYR  21  30.178  -4.791   6.685
  153    HD1  TYR  21           HD1      TYR  21  26.529  -4.241   6.650
  154    HD2  TYR  21           HD2      TYR  21  30.248  -3.241   8.440
  155    HE1  TYR  21           HE1      TYR  21  25.334  -3.123   8.478
  156    HE2  TYR  21           HE2      TYR  21  29.084  -2.112  10.267
  157    HH   TYR  21           HH       TYR  21  25.798  -1.324  10.167
  158    H    ALA  22           HN       ALA  22  31.661  -4.694   5.162
  159    HA   ALA  22           HA       ALA  22  33.022  -2.365   6.067
  160   1HB   ALA  22          HB1       ALA  22  34.025  -5.019   5.076
  161   2HB   ALA  22          HB2       ALA  22  33.840  -4.477   6.747
  162   3HB   ALA  22          HB3       ALA  22  35.071  -3.750   5.711
  163    H    SER  23           HN       SER  23  32.376  -3.729   2.919
  164    HA   SER  23           HA       SER  23  34.173  -2.139   1.434
  165   1HB   SER  23          HB2       SER  23  31.425  -3.148   0.651
  166   2HB   SER  23          HB1       SER  23  32.633  -2.511  -0.464
  167    HG   SER  23           HG       SER  23  32.884  -4.828   1.172
  168    H    LEU  24           HN       LEU  24  30.840  -1.590   2.489
  169    HA   LEU  24           HA       LEU  24  30.522   1.016   1.487
  170   1HB   LEU  24          HB2       LEU  24  28.762  -0.635   2.385
  171   2HB   LEU  24          HB1       LEU  24  29.220  -0.058   3.978
  172    HG   LEU  24           HG       LEU  24  28.688   2.300   2.931
  173   1HD1  LEU  24          HD11      LEU  24  27.921   2.198   0.846
  174   2HD1  LEU  24          HD12      LEU  24  26.459   1.474   1.515
  175   3HD1  LEU  24          HD13      LEU  24  27.757   0.443   0.914
  176   1HD2  LEU  24          HD21      LEU  24  27.365   1.899   4.710
  177   2HD2  LEU  24          HD22      LEU  24  27.018   0.241   4.217
  178   3HD2  LEU  24          HD23      LEU  24  26.148   1.585   3.476
  179    H    ARG  25           HN       ARG  25  31.762  -0.289   4.500
  180    HA   ARG  25           HA       ARG  25  31.997   2.030   5.995
  181   1HB   ARG  25          HB2       ARG  25  33.563  -0.520   5.895
  182   2HB   ARG  25          HB1       ARG  25  34.107   0.795   6.926
  183   1HG   ARG  25          HG2       ARG  25  31.452  -0.616   7.063
  184   2HG   ARG  25          HG1       ARG  25  32.786  -0.746   8.211
  185   1HD   ARG  25          HD2       ARG  25  31.031   1.631   7.663
  186   2HD   ARG  25          HD1       ARG  25  31.203   0.732   9.169
  187    HE   ARG  25           HE       ARG  25  33.709   1.774   8.478
  188   1HH1  ARG  25          HH11      ARG  25  30.568   2.890   9.552
  189   2HH1  ARG  25          HH12      ARG  25  31.202   4.332  10.295
  190   1HH2  ARG  25          HH21      ARG  25  34.535   3.667   9.426
  191   2HH2  ARG  25          HH22      ARG  25  33.452   4.764  10.224
  192    H    HIS  26           HN       HIS  26  34.505   0.549   3.931
  193    HA   HIS  26           HA       HIS  26  36.243   2.790   4.164
  194   1HB   HIS  26          HB2       HIS  26  36.831   0.339   3.586
  195   2HB   HIS  26          HB1       HIS  26  36.403   0.781   1.937
  196    HD1  HIS  26           HD1      HIS  26  37.848   3.758   3.147
  197    HD2  HIS  26           HD2      HIS  26  39.398   0.047   2.068
  198    HE1  HIS  26           HE1      HIS  26  40.279   4.154   2.646
  199    HE2  HIS  26           HE2      HIS  26  41.228   1.873   2.137
  200    H    TYR  27           HN       TYR  27  33.941   1.731   1.688
  201    HA   TYR  27           HA       TYR  27  34.625   3.628  -0.266
  202   1HB   TYR  27          HB2       TYR  27  32.985   1.539  -0.300
  203   2HB   TYR  27          HB1       TYR  27  31.779   2.778   0.032
  204    HD1  TYR  27           HD1      TYR  27  31.139   4.362  -1.649
  205    HD2  TYR  27           HD2      TYR  27  34.252   1.567  -2.415
  206    HE1  TYR  27           HE1      TYR  27  31.035   4.915  -4.039
  207    HE2  TYR  27           HE2      TYR  27  34.159   2.114  -4.808
  208    HH   TYR  27           HH       TYR  27  32.378   3.036  -6.415
  209    H    LEU  28           HN       LEU  28  32.108   3.711   2.257
  210    HA   LEU  28           HA       LEU  28  31.342   6.388   1.524
  211   1HB   LEU  28          HB2       LEU  28  30.569   4.621   3.831
  212   2HB   LEU  28          HB1       LEU  28  29.959   6.254   3.639
  213    HG   LEU  28           HG       LEU  28  29.291   3.788   2.107
  214   1HD1  LEU  28          HD11      LEU  28  27.096   5.277   2.084
  215   2HD1  LEU  28          HD12      LEU  28  27.908   6.044   3.449
  216   3HD1  LEU  28          HD13      LEU  28  27.561   4.315   3.487
  217   1HD2  LEU  28          HD21      LEU  28  29.706   4.779   0.131
  218   2HD2  LEU  28          HD22      LEU  28  29.861   6.380   0.856
  219   3HD2  LEU  28          HD23      LEU  28  28.263   5.731   0.486
  220    H    ASN  29           HN       ASN  29  33.698   5.056   3.687
  221    HA   ASN  29           HA       ASN  29  33.967   7.403   5.292
  222   1HB   ASN  29          HB2       ASN  29  35.345   6.105   6.487
  223   2HB   ASN  29          HB1       ASN  29  35.077   4.824   5.318
  224   1HD2  ASN  29          HD21      ASN  29  37.289   7.168   6.526
  225   2HD2  ASN  29          HD22      ASN  29  38.647   6.685   5.573
  226    H    LEU  30           HN       LEU  30  35.354   6.303   2.264
  227    HA   LEU  30           HA       LEU  30  37.109   8.608   2.090
  228   1HB   LEU  30          HB2       LEU  30  36.806   6.061   0.707
  229   2HB   LEU  30          HB1       LEU  30  37.081   7.392  -0.399
  230    HG   LEU  30           HG       LEU  30  38.884   6.380   1.782
  231   1HD1  LEU  30          HD11      LEU  30  40.242   5.720   0.112
  232   2HD1  LEU  30          HD12      LEU  30  39.862   7.118  -0.894
  233   3HD1  LEU  30          HD13      LEU  30  38.753   5.747  -0.831
  234   1HD2  LEU  30          HD21      LEU  30  38.917   8.732   2.141
  235   2HD2  LEU  30          HD22      LEU  30  38.960   9.061   0.409
  236   3HD2  LEU  30          HD23      LEU  30  40.359   8.339   1.205
  237    H    VAL  31           HN       VAL  31  33.903   7.832   1.304
  238    HA   VAL  31           HA       VAL  31  33.613   9.540  -0.966
  239    HB   VAL  31           HB       VAL  31  32.111   7.517  -0.057
  240   1HG1  VAL  31          HG11      VAL  31  29.876   8.932   0.504
  241   2HG1  VAL  31          HG12      VAL  31  31.095   9.894   1.338
  242   3HG1  VAL  31          HG13      VAL  31  30.909   8.183   1.723
  243   1HG2  VAL  31          HG21      VAL  31  31.952   8.384  -2.276
  244   2HG2  VAL  31          HG22      VAL  31  31.193   9.867  -1.697
  245   3HG2  VAL  31          HG23      VAL  31  30.326   8.335  -1.593
  246    H    THR  32           HN       THR  32  34.332  10.333   2.072
  247    HA   THR  32           HA       THR  32  32.591  12.404   2.801
  248    HB   THR  32           HB       THR  32  34.926  13.308   3.787
  249    HG1  THR  32           HG1      THR  32  35.575  10.636   3.988
  250   1HG2  THR  32          HG21      THR  32  34.508  11.911   5.763
  251   2HG2  THR  32          HG22      THR  32  33.429  10.890   4.810
  252   3HG2  THR  32          HG23      THR  32  33.006  12.575   5.114
  253    H    ARG  33           HN       ARG  33  34.976  12.171   0.348
  254    HA   ARG  33           HA       ARG  33  35.413  14.963  -0.085
  255   1HB   ARG  33          HB2       ARG  33  36.832  12.887  -0.814
  256   2HB   ARG  33          HB1       ARG  33  35.748  12.861  -2.199
  257   1HG   ARG  33          HG2       ARG  33  36.922  14.447  -3.191
  258   2HG   ARG  33          HG1       ARG  33  36.714  15.519  -1.805
  259   1HD   ARG  33          HD2       ARG  33  38.590  13.751  -0.898
  260   2HD   ARG  33          HD1       ARG  33  39.011  13.892  -2.605
  261    HE   ARG  33           HE       ARG  33  39.428  16.187  -2.303
  262   1HH1  ARG  33          HH11      ARG  33  38.618  14.536   0.682
  263   2HH1  ARG  33          HH12      ARG  33  39.210  15.816   1.696
  264   1HH2  ARG  33          HH21      ARG  33  40.186  17.866  -0.969
  265   2HH2  ARG  33          HH22      ARG  33  40.076  17.710   0.759
  266    H    GLN  34           HN       GLN  34  32.747  13.047  -0.519
  267    HA   GLN  34           HA       GLN  34  30.759  13.280  -1.568
  268   1HB   GLN  34          HB2       GLN  34  31.914  16.000  -2.110
  269   2HB   GLN  34          HB1       GLN  34  30.376  15.518  -2.817
  270   1HG   GLN  34          HG2       GLN  34  30.733  15.131   0.100
  271   2HG   GLN  34          HG1       GLN  34  30.543  16.779  -0.496
  272   1HE2  GLN  34          HE21      GLN  34  28.569  17.500  -0.887
  273   2HE2  GLN  34          HE22      GLN  34  27.133  16.533  -0.918
  274    H    ARG  35           HN       ARG  35  33.282  12.319  -2.860
  275    HA   ARG  35           HA       ARG  35  32.255  12.240  -5.604
  276   1HB   ARG  35          HB2       ARG  35  34.972  13.064  -4.682
  277   2HB   ARG  35          HB1       ARG  35  34.856  12.110  -6.154
  278   1HG   ARG  35          HG2       ARG  35  33.446  14.724  -5.654
  279   2HG   ARG  35          HG1       ARG  35  34.913  14.514  -6.610
  280   1HD   ARG  35          HD2       ARG  35  33.785  13.271  -8.260
  281   2HD   ARG  35          HD1       ARG  35  32.379  13.030  -7.227
  282    HE   ARG  35           HE       ARG  35  33.099  15.495  -8.651
  283   1HH1  ARG  35          HH11      ARG  35  30.840  13.710  -6.657
  284   2HH1  ARG  35          HH12      ARG  35  29.495  14.742  -7.016
  285   1HH2  ARG  35          HH21      ARG  35  31.337  16.899  -9.088
  286   2HH2  ARG  35          HH22      ARG  35  29.786  16.588  -8.353
  287    H    TYR  36           HN       TYR  36  33.226  10.381  -6.826
  288    HA   TYR  36           HA       TYR  36  33.031   8.042  -5.144
  289   1HB   TYR  36          HB2       TYR  36  32.919   8.595  -8.064
  290   2HB   TYR  36          HB1       TYR  36  33.429   6.984  -7.568
  291    HD1  TYR  36           HD1      TYR  36  31.716   5.474  -7.794
  292    HD2  TYR  36           HD2      TYR  36  30.816   9.366  -6.322
  293    HE1  TYR  36           HE1      TYR  36  29.369   4.814  -7.498
  294    HE2  TYR  36           HE2      TYR  36  28.465   8.714  -6.022
  295    HH   TYR  36           HH       TYR  36  26.901   7.137  -6.628
  296   1HN   NH2  37          H1        NH2  37  36.302   6.775  -5.249
  297   2HN   NH2  37          H2        NH2  37  34.646   6.474  -4.867
  Start of MODEL   12
    1   1H    TYR   1          HT1       TYR   1  34.540   5.915  -9.928
    2   2H    TYR   1          HT2       TYR   1  35.261   6.229 -11.424
    3   3H    TYR   1          HT3       TYR   1  35.176   7.453 -10.255
    4    HA   TYR   1           HA       TYR   1  37.034   5.282 -10.559
    5   1HB   TYR   1          HB2       TYR   1  37.091   8.077 -10.111
    6   2HB   TYR   1          HB1       TYR   1  37.882   7.314  -8.731
    7    HD1  TYR   1           HD1      TYR   1  39.687   5.552  -9.255
    8    HD2  TYR   1           HD2      TYR   1  38.262   8.369 -12.105
    9    HE1  TYR   1           HE1      TYR   1  41.714   5.208 -10.597
   10    HE2  TYR   1           HE2      TYR   1  40.287   8.031 -13.458
   11    HH   TYR   1           HH       TYR   1  42.013   6.313 -13.799
   12    HA   PRO   2           HA       PRO   2  36.267   4.891  -5.766
   13   1HB   PRO   2          HB2       PRO   2  33.754   5.677  -4.991
   14   2HB   PRO   2          HB1       PRO   2  35.200   6.669  -4.779
   15   1HG   PRO   2          HG2       PRO   2  33.115   6.786  -6.922
   16   2HG   PRO   2          HG1       PRO   2  33.904   8.117  -6.054
   17   1HD   PRO   2          HD2       PRO   2  34.649   7.428  -8.535
   18   2HD   PRO   2          HD1       PRO   2  35.834   7.968  -7.328
   19    H    ILE   3           HN       ILE   3  34.868   3.207  -4.748
   20    HA   ILE   3           HA       ILE   3  33.782   1.570  -6.882
   21    HB   ILE   3           HB       ILE   3  35.598   0.648  -5.510
   22   1HG1  ILE   3          HG12      ILE   3  34.363  -1.515  -4.811
   23   2HG1  ILE   3          HG11      ILE   3  32.928  -0.735  -5.470
   24   1HG2  ILE   3          HG21      ILE   3  34.125  -0.041  -3.143
   25   2HG2  ILE   3          HG22      ILE   3  34.220   1.708  -3.342
   26   3HG2  ILE   3          HG23      ILE   3  35.696   0.742  -3.312
   27   1HD1  ILE   3          HD11      ILE   3  33.636  -1.887  -7.295
   28   2HD1  ILE   3          HD12      ILE   3  35.337  -1.765  -6.854
   29   3HD1  ILE   3          HD13      ILE   3  34.507  -0.374  -7.547
   30    H    LYS   4           HN       LYS   4  32.550   0.319  -4.119
   31    HA   LYS   4           HA       LYS   4  30.217   1.632  -3.524
   32   1HB   LYS   4          HB2       LYS   4  30.202   0.892  -6.245
   33   2HB   LYS   4          HB1       LYS   4  29.182  -0.288  -5.436
   34   1HG   LYS   4          HG2       LYS   4  27.730   1.411  -4.621
   35   2HG   LYS   4          HG1       LYS   4  28.841   2.684  -5.133
   36   1HD   LYS   4          HD2       LYS   4  27.073   2.580  -6.736
   37   2HD   LYS   4          HD1       LYS   4  28.516   1.901  -7.489
   38   1HE   LYS   4          HE2       LYS   4  27.141  -0.213  -6.192
   39   2HE   LYS   4          HE1       LYS   4  25.956   0.704  -7.124
   40   1HZ   LYS   4          HZ1       LYS   4  27.790  -1.157  -8.073
   41   2HZ   LYS   4          HZ2       LYS   4  28.287   0.352  -8.666
   42   3HZ   LYS   4          HZ3       LYS   4  26.718  -0.203  -8.977
   43    HA   PRO   5           HA       PRO   5  29.891  -2.238  -1.279
   44   1HB   PRO   5          HB2       PRO   5  27.093  -1.719  -0.716
   45   2HB   PRO   5          HB1       PRO   5  28.471  -1.639   0.383
   46   1HG   PRO   5          HG2       PRO   5  27.069   0.555  -0.422
   47   2HG   PRO   5          HG1       PRO   5  28.777   0.601   0.046
   48   1HD   PRO   5          HD2       PRO   5  27.560   0.565  -2.689
   49   2HD   PRO   5          HD1       PRO   5  28.953   1.489  -2.084
   50    H    GLU   6           HN       GLU   6  28.985  -4.315  -1.518
   51    HA   GLU   6           HA       GLU   6  28.072  -5.030  -4.055
   52   1HB   GLU   6          HB2       GLU   6  28.136  -6.424  -1.405
   53   2HB   GLU   6          HB1       GLU   6  27.331  -7.181  -2.773
   54   1HG   GLU   6          HG2       GLU   6  29.337  -8.049  -3.194
   55   2HG   GLU   6          HG1       GLU   6  29.695  -6.466  -3.884
   56    H    ALA   7           HN       ALA   7  26.315  -4.255  -1.126
   57    HA   ALA   7           HA       ALA   7  24.108  -4.141  -0.587
   58   1HB   ALA   7          HB1       ALA   7  23.912  -2.224  -1.843
   59   2HB   ALA   7          HB2       ALA   7  22.674  -3.242  -2.577
   60   3HB   ALA   7          HB3       ALA   7  24.243  -3.052  -3.364
   61    HA   PRO   8           HA       PRO   8  23.525  -8.307  -2.624
   62   1HB   PRO   8          HB2       PRO   8  23.137  -9.248   0.130
   63   2HB   PRO   8          HB1       PRO   8  24.257  -9.824  -1.106
   64   1HG   PRO   8          HG2       PRO   8  25.115  -8.463   1.037
   65   2HG   PRO   8          HG1       PRO   8  25.875  -8.276  -0.556
   66   1HD   PRO   8          HD2       PRO   8  23.882  -6.497   0.811
   67   2HD   PRO   8          HD1       PRO   8  25.352  -6.057  -0.087
   68    H    GLY   9           HN       GLY   9  21.638  -6.698  -0.114
   69   1HA   GLY   9          HA2       GLY   9  19.210  -6.780  -1.299
   70   2HA   GLY   9          HA1       GLY   9  19.329  -8.362  -0.539
   71    H    GLU  10           HN       GLU  10  17.895  -8.170   1.093
   72    HA   GLU  10           HA       GLU  10  18.231  -5.877   2.899
   73   1HB   GLU  10          HB2       GLU  10  15.970  -6.511   1.691
   74   2HB   GLU  10          HB1       GLU  10  15.839  -7.670   3.004
   75   1HG   GLU  10          HG2       GLU  10  16.355  -5.555   4.477
   76   2HG   GLU  10          HG1       GLU  10  15.720  -4.706   3.067
   77    H    ASP  11           HN       ASP  11  18.767  -9.178   2.575
   78    HA   ASP  11           HA       ASP  11  19.268  -9.416   5.458
   79   1HB   ASP  11          HB2       ASP  11  17.176 -10.549   5.177
   80   2HB   ASP  11          HB1       ASP  11  17.751 -11.380   3.735
   81    H    ALA  12           HN       ALA  12  19.540 -11.337   2.482
   82    HA   ALA  12           HA       ALA  12  21.268 -12.377   1.462
   83   1HB   ALA  12          HB1       ALA  12  23.175 -10.576   2.917
   84   2HB   ALA  12          HB2       ALA  12  22.136  -9.968   1.625
   85   3HB   ALA  12          HB3       ALA  12  23.303 -11.250   1.293
   86    H    SER  13           HN       SER  13  23.679 -11.748   3.771
   87    HA   SER  13           HA       SER  13  23.297 -14.010   5.457
   88   1HB   SER  13          HB2       SER  13  25.166 -15.370   4.571
   89   2HB   SER  13          HB1       SER  13  23.891 -15.191   3.363
   90    HG   SER  13           HG       SER  13  25.229 -14.143   2.114
   91    HA   PRO  14           HA       PRO  14  26.317 -11.880   7.945
   92   1HB   PRO  14          HB2       PRO  14  28.110 -14.005   8.427
   93   2HB   PRO  14          HB1       PRO  14  26.766 -13.500   9.452
   94   1HG   PRO  14          HG2       PRO  14  26.919 -15.713   7.482
   95   2HG   PRO  14          HG1       PRO  14  25.964 -15.592   8.971
   96   1HD   PRO  14          HD2       PRO  14  24.846 -15.355   6.534
   97   2HD   PRO  14          HD1       PRO  14  24.259 -14.430   7.932
   98    H    GLU  15           HN       GLU  15  27.724 -14.129   5.546
   99    HA   GLU  15           HA       GLU  15  30.226 -12.805   5.370
  100   1HB   GLU  15          HB2       GLU  15  28.907 -15.034   4.102
  101   2HB   GLU  15          HB1       GLU  15  29.724 -14.052   2.893
  102   1HG   GLU  15          HG2       GLU  15  31.451 -14.423   5.143
  103   2HG   GLU  15          HG1       GLU  15  30.835 -15.984   4.606
  104    H    GLU  16           HN       GLU  16  27.263 -12.555   3.466
  105    HA   GLU  16           HA       GLU  16  28.345 -10.776   1.520
  106   1HB   GLU  16          HB2       GLU  16  25.708 -11.985   2.116
  107   2HB   GLU  16          HB1       GLU  16  25.673 -10.447   1.266
  108   1HG   GLU  16          HG2       GLU  16  26.740 -11.303  -0.598
  109   2HG   GLU  16          HG1       GLU  16  27.418 -12.665   0.295
  110    H    LEU  17           HN       LEU  17  26.314 -10.439   4.395
  111    HA   LEU  17           HA       LEU  17  25.885  -7.655   4.141
  112   1HB   LEU  17          HB2       LEU  17  24.780  -9.453   5.723
  113   2HB   LEU  17          HB1       LEU  17  26.046  -8.946   6.829
  114    HG   LEU  17           HG       LEU  17  24.833  -6.592   5.825
  115   1HD1  LEU  17          HD11      LEU  17  22.574  -6.839   6.033
  116   2HD1  LEU  17          HD12      LEU  17  22.713  -8.212   7.134
  117   3HD1  LEU  17          HD13      LEU  17  22.986  -8.434   5.405
  118   1HD2  LEU  17          HD21      LEU  17  24.164  -6.364   8.225
  119   2HD2  LEU  17          HD22      LEU  17  25.875  -6.703   7.966
  120   3HD2  LEU  17          HD23      LEU  17  24.791  -7.990   8.493
  121    H    ASN  18           HN       ASN  18  28.350  -9.586   5.796
  122    HA   ASN  18           HA       ASN  18  29.803  -7.452   6.906
  123   1HB   ASN  18          HB2       ASN  18  30.793  -9.281   7.767
  124   2HB   ASN  18          HB1       ASN  18  30.201 -10.300   6.462
  125   1HD2  ASN  18          HD21      ASN  18  31.511 -10.697   4.686
  126   2HD2  ASN  18          HD22      ASN  18  33.201 -10.315   4.672
  127    H    ARG  19           HN       ARG  19  29.845  -8.915   3.684
  128    HA   ARG  19           HA       ARG  19  32.171  -7.536   2.805
  129   1HB   ARG  19          HB2       ARG  19  29.956  -8.995   1.436
  130   2HB   ARG  19          HB1       ARG  19  31.053  -8.006   0.475
  131   1HG   ARG  19          HG2       ARG  19  32.834  -9.354   1.951
  132   2HG   ARG  19          HG1       ARG  19  31.530 -10.539   1.892
  133   1HD   ARG  19          HD2       ARG  19  31.965  -9.391  -0.708
  134   2HD   ARG  19          HD1       ARG  19  33.473 -10.035  -0.059
  135    HE   ARG  19           HE       ARG  19  31.428 -11.545  -1.163
  136   1HH1  ARG  19          HH11      ARG  19  33.408 -11.574   1.747
  137   2HH1  ARG  19          HH12      ARG  19  33.153 -13.267   2.053
  138   1HH2  ARG  19          HH21      ARG  19  31.142 -13.777  -0.775
  139   2HH2  ARG  19          HH22      ARG  19  31.862 -14.507   0.635
  140    H    TYR  20           HN       TYR  20  28.720  -6.886   2.186
  141    HA   TYR  20           HA       TYR  20  29.166  -4.437   0.864
  142   1HB   TYR  20          HB2       TYR  20  26.982  -4.687   0.450
  143   2HB   TYR  20          HB1       TYR  20  26.947  -6.061   1.547
  144    HD1  TYR  20           HD1      TYR  20  26.263  -5.724   3.917
  145    HD2  TYR  20           HD2      TYR  20  26.005  -2.595   1.042
  146    HE1  TYR  20           HE1      TYR  20  24.736  -4.494   5.401
  147    HE2  TYR  20           HE2      TYR  20  24.476  -1.360   2.519
  148    HH   TYR  20           HH       TYR  20  23.179  -2.780   5.430
  149    H    TYR  21           HN       TYR  21  29.003  -5.333   4.182
  150    HA   TYR  21           HA       TYR  21  28.524  -2.882   5.432
  151   1HB   TYR  21          HB2       TYR  21  28.936  -5.424   6.269
  152   2HB   TYR  21          HB1       TYR  21  30.489  -4.709   6.680
  153    HD1  TYR  21           HD1      TYR  21  30.716  -3.245   8.501
  154    HD2  TYR  21           HD2      TYR  21  26.861  -4.518   7.269
  155    HE1  TYR  21           HE1      TYR  21  29.774  -2.347  10.567
  156    HE2  TYR  21           HE2      TYR  21  25.888  -3.622   9.330
  157    HH   TYR  21           HH       TYR  21  26.601  -3.054  11.610
  158    H    ALA  22           HN       ALA  22  31.636  -4.492   4.823
  159    HA   ALA  22           HA       ALA  22  33.088  -2.221   5.776
  160   1HB   ALA  22          HB1       ALA  22  33.962  -4.376   6.233
  161   2HB   ALA  22          HB2       ALA  22  35.079  -3.569   5.132
  162   3HB   ALA  22          HB3       ALA  22  33.978  -4.802   4.520
  163    H    SER  23           HN       SER  23  32.089  -3.366   2.616
  164    HA   SER  23           HA       SER  23  33.881  -1.735   1.129
  165   1HB   SER  23          HB2       SER  23  32.030  -1.969  -0.676
  166   2HB   SER  23          HB1       SER  23  32.882  -3.422  -0.153
  167    HG   SER  23           HG       SER  23  31.124  -4.144   0.783
  168    H    LEU  24           HN       LEU  24  30.554  -1.277   2.261
  169    HA   LEU  24           HA       LEU  24  30.221   1.354   1.332
  170   1HB   LEU  24          HB2       LEU  24  28.225   0.350   1.920
  171   2HB   LEU  24          HB1       LEU  24  28.899  -0.391   3.356
  172    HG   LEU  24           HG       LEU  24  29.005   2.320   3.922
  173   1HD1  LEU  24          HD11      LEU  24  27.146   2.009   1.845
  174   2HD1  LEU  24          HD12      LEU  24  27.403   3.426   2.870
  175   3HD1  LEU  24          HD13      LEU  24  26.210   2.205   3.326
  176   1HD2  LEU  24          HD21      LEU  24  28.072   1.523   5.769
  177   2HD2  LEU  24          HD22      LEU  24  27.893  -0.033   4.960
  178   3HD2  LEU  24          HD23      LEU  24  26.582   1.143   4.906
  179    H    ARG  25           HN       ARG  25  31.469  -0.027   4.324
  180    HA   ARG  25           HA       ARG  25  31.782   2.242   5.867
  181   1HB   ARG  25          HB2       ARG  25  32.667  -0.429   5.951
  182   2HB   ARG  25          HB1       ARG  25  34.116   0.556   6.100
  183   1HG   ARG  25          HG2       ARG  25  33.414   0.179   8.293
  184   2HG   ARG  25          HG1       ARG  25  32.878   1.819   7.927
  185   1HD   ARG  25          HD2       ARG  25  30.869  -0.107   7.180
  186   2HD   ARG  25          HD1       ARG  25  31.325  -0.306   8.872
  187    HE   ARG  25           HE       ARG  25  30.688   2.387   7.912
  188   1HH1  ARG  25          HH11      ARG  25  29.796  -0.409   9.821
  189   2HH1  ARG  25          HH12      ARG  25  28.531   0.417  10.682
  190   1HH2  ARG  25          HH21      ARG  25  29.051   3.485   9.063
  191   2HH2  ARG  25          HH22      ARG  25  28.135   2.642  10.273
  192    H    HIS  26           HN       HIS  26  34.103   0.873   3.541
  193    HA   HIS  26           HA       HIS  26  35.916   3.077   3.887
  194   1HB   HIS  26          HB2       HIS  26  36.225   0.494   3.048
  195   2HB   HIS  26          HB1       HIS  26  36.298   1.374   1.523
  196    HD1  HIS  26           HD1      HIS  26  37.625   3.746   3.717
  197    HD2  HIS  26           HD2      HIS  26  39.072   0.136   2.230
  198    HE1  HIS  26           HE1      HIS  26  40.127   3.860   3.964
  199    HE2  HIS  26           HE2      HIS  26  40.981   1.663   3.073
  200    H    TYR  27           HN       TYR  27  33.628   2.037   1.380
  201    HA   TYR  27           HA       TYR  27  34.329   3.979  -0.531
  202   1HB   TYR  27          HB2       TYR  27  33.001   2.136  -1.254
  203   2HB   TYR  27          HB1       TYR  27  31.767   2.461  -0.043
  204    HD1  TYR  27           HD1      TYR  27  29.803   2.990  -1.103
  205    HD2  TYR  27           HD2      TYR  27  33.422   4.650  -2.597
  206    HE1  TYR  27           HE1      TYR  27  28.523   4.287  -2.746
  207    HE2  TYR  27           HE2      TYR  27  32.149   5.956  -4.243
  208    HH   TYR  27           HH       TYR  27  28.649   6.083  -4.179
  209    H    LEU  28           HN       LEU  28  31.967   4.010   2.120
  210    HA   LEU  28           HA       LEU  28  31.026   6.630   1.614
  211   1HB   LEU  28          HB2       LEU  28  30.882   4.704   3.806
  212   2HB   LEU  28          HB1       LEU  28  30.901   6.367   4.357
  213    HG   LEU  28           HG       LEU  28  28.912   6.875   3.136
  214   1HD1  LEU  28          HD11      LEU  28  29.453   4.281   1.792
  215   2HD1  LEU  28          HD12      LEU  28  28.995   5.837   1.099
  216   3HD1  LEU  28          HD13      LEU  28  27.791   4.852   1.930
  217   1HD2  LEU  28          HD21      LEU  28  28.904   4.415   4.806
  218   2HD2  LEU  28          HD22      LEU  28  27.409   4.923   4.023
  219   3HD2  LEU  28          HD23      LEU  28  28.229   6.010   5.144
  220    H    ASN  29           HN       ASN  29  33.534   5.498   3.895
  221    HA   ASN  29           HA       ASN  29  34.078   8.155   4.783
  222   1HB   ASN  29          HB2       ASN  29  35.195   7.152   6.458
  223   2HB   ASN  29          HB1       ASN  29  34.474   5.677   5.835
  224   1HD2  ASN  29          HD21      ASN  29  37.292   7.210   6.681
  225   2HD2  ASN  29          HD22      ASN  29  38.424   6.113   5.951
  226    H    LEU  30           HN       LEU  30  35.009   6.601   1.980
  227    HA   LEU  30           HA       LEU  30  37.711   7.187   1.789
  228   1HB   LEU  30          HB2       LEU  30  37.486   6.024  -0.084
  229   2HB   LEU  30          HB1       LEU  30  35.751   6.056   0.141
  230    HG   LEU  30           HG       LEU  30  36.730   8.504  -1.094
  231   1HD1  LEU  30          HD11      LEU  30  36.864   6.291  -3.019
  232   2HD1  LEU  30          HD12      LEU  30  38.211   6.387  -1.886
  233   3HD1  LEU  30          HD13      LEU  30  37.821   7.767  -2.912
  234   1HD2  LEU  30          HD21      LEU  30  34.366   7.729  -0.959
  235   2HD2  LEU  30          HD22      LEU  30  34.781   6.420  -2.071
  236   3HD2  LEU  30          HD23      LEU  30  34.907   8.099  -2.601
  237    H    VAL  31           HN       VAL  31  34.991   9.153   0.642
  238    HA   VAL  31           HA       VAL  31  36.893  11.392   0.395
  239    HB   VAL  31           HB       VAL  31  35.008  12.499  -0.920
  240   1HG1  VAL  31          HG11      VAL  31  37.029  10.739  -1.712
  241   2HG1  VAL  31          HG12      VAL  31  36.208  11.944  -2.704
  242   3HG1  VAL  31          HG13      VAL  31  35.610  10.285  -2.656
  243   1HG2  VAL  31          HG21      VAL  31  33.898   9.923  -1.735
  244   2HG2  VAL  31          HG22      VAL  31  33.083  11.445  -1.369
  245   3HG2  VAL  31          HG23      VAL  31  33.529  10.346  -0.062
  246    H    THR  32           HN       THR  32  35.940  10.481   2.880
  247    HA   THR  32           HA       THR  32  34.682  10.884   4.724
  248    HB   THR  32           HB       THR  32  34.434  13.161   5.454
  249    HG1  THR  32           HG1      THR  32  34.663  13.767   2.703
  250   1HG2  THR  32          HG21      THR  32  36.945  12.711   3.860
  251   2HG2  THR  32          HG22      THR  32  36.683  12.429   5.582
  252   3HG2  THR  32          HG23      THR  32  36.726  14.077   4.957
  253    H    ARG  33           HN       ARG  33  33.368  10.211   2.217
  254    HA   ARG  33           HA       ARG  33  31.444  10.413   0.980
  255   1HB   ARG  33          HB2       ARG  33  30.919   9.185   3.236
  256   2HB   ARG  33          HB1       ARG  33  29.942  10.613   3.560
  257   1HG   ARG  33          HG2       ARG  33  29.431   9.603   0.912
  258   2HG   ARG  33          HG1       ARG  33  29.208   8.342   2.124
  259   1HD   ARG  33          HD2       ARG  33  27.436   9.389   3.086
  260   2HD   ARG  33          HD1       ARG  33  28.058  11.001   2.731
  261    HE   ARG  33           HE       ARG  33  26.480   9.296   0.948
  262   1HH1  ARG  33          HH11      ARG  33  28.181  12.317   1.475
  263   2HH1  ARG  33          HH12      ARG  33  27.415  13.122   0.139
  264   1HH2  ARG  33          HH21      ARG  33  25.471  10.349  -0.802
  265   2HH2  ARG  33          HH22      ARG  33  25.867  12.015  -1.153
  266    H    GLN  34           HN       GLN  34  32.483  12.748   0.790
  267    HA   GLN  34           HA       GLN  34  32.017  15.127   1.424
  268   1HB   GLN  34          HB2       GLN  34  32.292  14.062  -1.033
  269   2HB   GLN  34          HB1       GLN  34  30.700  14.789  -1.196
  270   1HG   GLN  34          HG2       GLN  34  31.513  16.879  -1.192
  271   2HG   GLN  34          HG1       GLN  34  32.724  16.515   0.037
  272   1HE2  GLN  34          HE21      GLN  34  32.159  17.081  -3.236
  273   2HE2  GLN  34          HE22      GLN  34  33.721  16.631  -3.843
  274    H    ARG  35           HN       ARG  35  30.535  15.821   2.842
  275    HA   ARG  35           HA       ARG  35  27.742  15.894   1.937
  276   1HB   ARG  35          HB2       ARG  35  27.166  15.430   4.424
  277   2HB   ARG  35          HB1       ARG  35  27.583  14.084   3.374
  278   1HG   ARG  35          HG2       ARG  35  29.522  13.651   4.461
  279   2HG   ARG  35          HG1       ARG  35  29.797  15.344   4.875
  280   1HD   ARG  35          HD2       ARG  35  27.452  14.543   6.216
  281   2HD   ARG  35          HD1       ARG  35  28.647  13.267   6.461
  282    HE   ARG  35           HE       ARG  35  30.083  14.834   7.501
  283   1HH1  ARG  35          HH11      ARG  35  26.918  16.125   6.713
  284   2HH1  ARG  35          HH12      ARG  35  27.098  17.524   7.725
  285   1HH2  ARG  35          HH21      ARG  35  30.296  16.653   8.884
  286   2HH2  ARG  35          HH22      ARG  35  29.012  17.831   8.962
  287    H    TYR  36           HN       TYR  36  26.443  17.238   3.664
  288    HA   TYR  36           HA       TYR  36  27.556  19.875   3.588
  289   1HB   TYR  36          HB2       TYR  36  24.968  18.652   4.413
  290   2HB   TYR  36          HB1       TYR  36  25.351  20.255   5.028
  291    HD1  TYR  36           HD1      TYR  36  25.962  22.058   3.284
  292    HD2  TYR  36           HD2      TYR  36  24.026  18.399   2.298
  293    HE1  TYR  36           HE1      TYR  36  25.149  23.057   1.187
  294    HE2  TYR  36           HE2      TYR  36  23.209  19.388   0.199
  295    HH   TYR  36           HH       TYR  36  24.248  21.556  -1.339
  296   1HN   NH2  37          H1        NH2  37  29.247  19.489   6.718
  297   2HN   NH2  37          H2        NH2  37  29.457  19.338   5.009
  Start of MODEL   13
    1   1H    TYR   1          HT1       TYR   1  33.513  -4.165  -5.423
    2   2H    TYR   1          HT2       TYR   1  34.761  -4.236  -6.572
    3   3H    TYR   1          HT3       TYR   1  33.146  -4.164  -7.079
    4    HA   TYR   1           HA       TYR   1  34.816  -2.051  -5.908
    5   1HB   TYR   1          HB2       TYR   1  33.700  -2.671  -8.489
    6   2HB   TYR   1          HB1       TYR   1  33.067  -1.129  -7.930
    7    HD1  TYR   1           HD1      TYR   1  35.183   0.221  -6.629
    8    HD2  TYR   1           HD2      TYR   1  35.411  -2.391  -9.978
    9    HE1  TYR   1           HE1      TYR   1  37.264   1.323  -7.339
   10    HE2  TYR   1           HE2      TYR   1  37.492  -1.300 -10.697
   11    HH   TYR   1           HH       TYR   1  38.649   1.623  -9.212
   12    HA   PRO   2           HA       PRO   2  31.157  -1.036  -3.473
   13   1HB   PRO   2          HB2       PRO   2  32.335   0.978  -2.081
   14   2HB   PRO   2          HB1       PRO   2  32.554  -0.726  -1.670
   15   1HG   PRO   2          HG2       PRO   2  34.362   1.105  -3.196
   16   2HG   PRO   2          HG1       PRO   2  34.774  -0.111  -1.973
   17   1HD   PRO   2          HD2       PRO   2  35.049  -0.545  -4.640
   18   2HD   PRO   2          HD1       PRO   2  34.695  -1.841  -3.485
   19    H    ILE   3           HN       ILE   3  30.023  -0.263  -5.278
   20    HA   ILE   3           HA       ILE   3  30.627   2.351  -6.371
   21    HB   ILE   3           HB       ILE   3  30.015   0.773  -7.997
   22   1HG1  ILE   3          HG12      ILE   3  27.546   1.551  -8.612
   23   2HG1  ILE   3          HG11      ILE   3  27.865   2.742  -7.354
   24   1HG2  ILE   3          HG21      ILE   3  27.372  -0.004  -7.146
   25   2HG2  ILE   3          HG22      ILE   3  28.586  -0.399  -5.923
   26   3HG2  ILE   3          HG23      ILE   3  28.759  -1.007  -7.575
   27   1HD1  ILE   3          HD11      ILE   3  28.563   3.874  -9.210
   28   2HD1  ILE   3          HD12      ILE   3  29.129   2.416 -10.022
   29   3HD1  ILE   3          HD13      ILE   3  30.074   3.117  -8.710
   30    H    LYS   4           HN       LYS   4  27.859   0.802  -4.785
   31    HA   LYS   4           HA       LYS   4  27.128   2.778  -3.034
   32   1HB   LYS   4          HB2       LYS   4  26.786   3.992  -5.339
   33   2HB   LYS   4          HB1       LYS   4  25.307   3.044  -5.407
   34   1HG   LYS   4          HG2       LYS   4  24.836   4.008  -3.064
   35   2HG   LYS   4          HG1       LYS   4  26.074   5.197  -3.476
   36   1HD   LYS   4          HD2       LYS   4  23.790   5.981  -3.999
   37   2HD   LYS   4          HD1       LYS   4  24.818   5.881  -5.429
   38   1HE   LYS   4          HE2       LYS   4  23.802   3.539  -5.734
   39   2HE   LYS   4          HE1       LYS   4  22.579   4.073  -4.585
   40   1HZ   LYS   4          HZ1       LYS   4  21.534   5.065  -6.237
   41   2HZ   LYS   4          HZ2       LYS   4  22.749   4.617  -7.336
   42   3HZ   LYS   4          HZ3       LYS   4  22.869   6.083  -6.493
   43    HA   PRO   5           HA       PRO   5  24.652  -1.156  -3.283
   44   1HB   PRO   5          HB2       PRO   5  25.927  -2.239  -0.991
   45   2HB   PRO   5          HB1       PRO   5  26.142  -2.734  -2.667
   46   1HG   PRO   5          HG2       PRO   5  28.080  -1.527  -1.075
   47   2HG   PRO   5          HG1       PRO   5  28.121  -1.635  -2.842
   48   1HD   PRO   5          HD2       PRO   5  27.311   0.643  -1.095
   49   2HD   PRO   5          HD1       PRO   5  28.152   0.664  -2.661
   50    H    GLU   6           HN       GLU   6  22.686  -0.862  -2.484
   51    HA   GLU   6           HA       GLU   6  22.191   0.575  -0.054
   52   1HB   GLU   6          HB2       GLU   6  20.090  -1.122  -1.351
   53   2HB   GLU   6          HB1       GLU   6  19.936   0.459  -0.602
   54   1HG   GLU   6          HG2       GLU   6  20.220   1.507  -2.535
   55   2HG   GLU   6          HG1       GLU   6  21.635   0.535  -2.942
   56    H    ALA   7           HN       ALA   7  21.243  -2.705  -1.030
   57    HA   ALA   7           HA       ALA   7  22.349  -3.961   1.272
   58   1HB   ALA   7          HB1       ALA   7  19.996  -2.751   1.873
   59   2HB   ALA   7          HB2       ALA   7  20.579  -4.217   2.660
   60   3HB   ALA   7          HB3       ALA   7  19.424  -4.331   1.335
   61    HA   PRO   8           HA       PRO   8  21.761  -7.224  -1.728
   62   1HB   PRO   8          HB2       PRO   8  22.928  -9.227  -0.350
   63   2HB   PRO   8          HB1       PRO   8  23.867  -7.932  -1.101
   64   1HG   PRO   8          HG2       PRO   8  23.099  -8.301   1.761
   65   2HG   PRO   8          HG1       PRO   8  24.616  -7.691   1.075
   66   1HD   PRO   8          HD2       PRO   8  22.606  -6.104   2.103
   67   2HD   PRO   8          HD1       PRO   8  23.822  -5.561   0.934
   68    H    GLY   9           HN       GLY   9  19.963  -8.352  -2.092
   69   1HA   GLY   9          HA2       GLY   9  18.482  -9.403   0.245
   70   2HA   GLY   9          HA1       GLY   9  17.718  -8.843  -1.239
   71    H    GLU  10           HN       GLU  10  20.028 -10.083  -2.709
   72    HA   GLU  10           HA       GLU  10  18.833 -12.633  -3.175
   73   1HB   GLU  10          HB2       GLU  10  21.524 -11.841  -4.236
   74   2HB   GLU  10          HB1       GLU  10  20.271 -12.800  -5.008
   75   1HG   GLU  10          HG2       GLU  10  20.016 -10.895  -6.192
   76   2HG   GLU  10          HG1       GLU  10  18.949 -10.504  -4.845
   77    H    ASP  11           HN       ASP  11  19.040 -13.635  -1.130
   78    HA   ASP  11           HA       ASP  11  19.925 -15.265   0.195
   79   1HB   ASP  11          HB2       ASP  11  21.208 -15.948  -1.888
   80   2HB   ASP  11          HB1       ASP  11  22.556 -15.008  -1.260
   81    H    ALA  12           HN       ALA  12  22.374 -12.790  -0.509
   82    HA   ALA  12           HA       ALA  12  23.578 -11.397   0.809
   83   1HB   ALA  12          HB1       ALA  12  21.597 -11.742   3.020
   84   2HB   ALA  12          HB2       ALA  12  21.154 -10.902   1.533
   85   3HB   ALA  12          HB3       ALA  12  22.482 -10.299   2.524
   86    H    SER  13           HN       SER  13  22.468 -12.763   3.778
   87    HA   SER  13           HA       SER  13  23.409 -14.050   5.381
   88   1HB   SER  13          HB2       SER  13  25.200 -15.049   3.156
   89   2HB   SER  13          HB1       SER  13  25.051 -15.782   4.757
   90    HG   SER  13           HG       SER  13  22.824 -15.381   3.042
   91    HA   PRO  14           HA       PRO  14  26.610 -11.698   7.139
   92   1HB   PRO  14          HB2       PRO  14  27.944 -13.421   8.745
   93   2HB   PRO  14          HB1       PRO  14  26.288 -12.893   9.069
   94   1HG   PRO  14          HG2       PRO  14  27.251 -15.425   7.787
   95   2HG   PRO  14          HG1       PRO  14  26.002 -15.208   9.029
   96   1HD   PRO  14          HD2       PRO  14  25.397 -15.548   6.419
   97   2HD   PRO  14          HD1       PRO  14  24.419 -14.527   7.494
   98    H    GLU  15           HN       GLU  15  27.414 -12.891   4.527
   99    HA   GLU  15           HA       GLU  15  30.293 -12.455   4.925
  100   1HB   GLU  15          HB2       GLU  15  29.279 -14.873   4.127
  101   2HB   GLU  15          HB1       GLU  15  29.597 -14.090   2.585
  102   1HG   GLU  15          HG2       GLU  15  31.620 -14.380   4.797
  103   2HG   GLU  15          HG1       GLU  15  31.475 -15.479   3.426
  104    H    GLU  16           HN       GLU  16  27.687 -12.536   2.522
  105    HA   GLU  16           HA       GLU  16  28.891 -10.601   0.822
  106   1HB   GLU  16          HB2       GLU  16  26.009 -11.509   1.023
  107   2HB   GLU  16          HB1       GLU  16  26.650 -10.479  -0.249
  108   1HG   GLU  16          HG2       GLU  16  27.427 -13.331   0.317
  109   2HG   GLU  16          HG1       GLU  16  26.458 -12.750  -1.035
  110    H    LEU  17           HN       LEU  17  26.370 -10.538   3.315
  111    HA   LEU  17           HA       LEU  17  25.955  -7.724   3.163
  112   1HB   LEU  17          HB2       LEU  17  24.699  -9.828   4.451
  113   2HB   LEU  17          HB1       LEU  17  25.425  -8.930   5.772
  114    HG   LEU  17           HG       LEU  17  24.004  -7.244   3.840
  115   1HD1  LEU  17          HD11      LEU  17  22.275  -8.678   3.612
  116   2HD1  LEU  17          HD12      LEU  17  21.832  -8.035   5.192
  117   3HD1  LEU  17          HD13      LEU  17  22.684  -9.576   5.076
  118   1HD2  LEU  17          HD21      LEU  17  24.582  -6.098   5.724
  119   2HD2  LEU  17          HD22      LEU  17  24.391  -7.503   6.771
  120   3HD2  LEU  17          HD23      LEU  17  22.967  -6.633   6.194
  121    H    ASN  18           HN       ASN  18  28.082  -9.828   4.975
  122    HA   ASN  18           HA       ASN  18  29.068  -7.866   6.774
  123   1HB   ASN  18          HB2       ASN  18  29.322 -10.279   7.182
  124   2HB   ASN  18          HB1       ASN  18  30.377 -10.410   5.779
  125   1HD2  ASN  18          HD21      ASN  18  32.278 -10.940   6.642
  126   2HD2  ASN  18          HD22      ASN  18  33.110 -10.033   7.856
  127    H    ARG  19           HN       ARG  19  30.246  -9.127   3.670
  128    HA   ARG  19           HA       ARG  19  32.601  -7.561   3.603
  129   1HB   ARG  19          HB2       ARG  19  31.321  -9.451   1.923
  130   2HB   ARG  19          HB1       ARG  19  31.667  -8.027   0.949
  131   1HG   ARG  19          HG2       ARG  19  33.973  -8.177   1.357
  132   2HG   ARG  19          HG1       ARG  19  33.746  -9.297   2.699
  133   1HD   ARG  19          HD2       ARG  19  34.609 -10.331   0.587
  134   2HD   ARG  19          HD1       ARG  19  33.141 -11.063   1.233
  135    HE   ARG  19           HE       ARG  19  33.189  -9.185  -1.051
  136   1HH1  ARG  19          HH11      ARG  19  31.936 -12.038   0.570
  137   2HH1  ARG  19          HH12      ARG  19  30.707 -12.327  -0.632
  138   1HH2  ARG  19          HH21      ARG  19  31.579  -9.580  -2.619
  139   2HH2  ARG  19          HH22      ARG  19  30.484 -10.917  -2.411
  140    H    TYR  20           HN       TYR  20  29.436  -7.080   2.051
  141    HA   TYR  20           HA       TYR  20  30.043  -4.577   0.921
  142   1HB   TYR  20          HB2       TYR  20  28.032  -4.915  -0.003
  143   2HB   TYR  20          HB1       TYR  20  27.787  -6.303   1.048
  144    HD1  TYR  20           HD1      TYR  20  26.555  -6.018   3.187
  145    HD2  TYR  20           HD2      TYR  20  26.895  -2.858   0.367
  146    HE1  TYR  20           HE1      TYR  20  24.700  -4.832   4.298
  147    HE2  TYR  20           HE2      TYR  20  25.046  -1.664   1.459
  148    HH   TYR  20           HH       TYR  20  23.206  -2.039   2.881
  149    H    TYR  21           HN       TYR  21  28.990  -5.540   4.092
  150    HA   TYR  21           HA       TYR  21  28.095  -3.156   5.191
  151   1HB   TYR  21          HB2       TYR  21  28.415  -5.652   6.112
  152   2HB   TYR  21          HB1       TYR  21  29.826  -4.906   6.854
  153    HD1  TYR  21           HD1      TYR  21  26.141  -4.644   6.573
  154    HD2  TYR  21           HD2      TYR  21  29.626  -3.624   8.788
  155    HE1  TYR  21           HE1      TYR  21  24.729  -3.822   8.398
  156    HE2  TYR  21           HE2      TYR  21  28.232  -2.797  10.619
  157    HH   TYR  21           HH       TYR  21  26.092  -2.124  11.154
  158    H    ALA  22           HN       ALA  22  31.346  -4.544   5.546
  159    HA   ALA  22           HA       ALA  22  32.410  -2.148   6.644
  160   1HB   ALA  22          HB1       ALA  22  33.786  -4.597   5.564
  161   2HB   ALA  22          HB2       ALA  22  33.372  -4.252   7.247
  162   3HB   ALA  22          HB3       ALA  22  34.599  -3.285   6.421
  163    H    SER  23           HN       SER  23  32.248  -3.449   3.384
  164    HA   SER  23           HA       SER  23  34.075  -1.651   2.193
  165   1HB   SER  23          HB2       SER  23  31.689  -3.065   0.978
  166   2HB   SER  23          HB1       SER  23  32.946  -2.236   0.061
  167    HG   SER  23           HG       SER  23  33.078  -4.627   1.533
  168    H    LEU  24           HN       LEU  24  30.604  -1.454   2.820
  169    HA   LEU  24           HA       LEU  24  30.126   0.961   1.451
  170   1HB   LEU  24          HB2       LEU  24  28.267  -0.434   1.975
  171   2HB   LEU  24          HB1       LEU  24  28.697  -0.487   3.674
  172    HG   LEU  24           HG       LEU  24  28.275   2.204   3.238
  173   1HD1  LEU  24          HD11      LEU  24  27.373   1.611   0.991
  174   2HD1  LEU  24          HD12      LEU  24  26.229   2.444   2.043
  175   3HD1  LEU  24          HD13      LEU  24  26.100   0.704   1.806
  176   1HD2  LEU  24          HD21      LEU  24  27.386   0.252   4.913
  177   2HD2  LEU  24          HD22      LEU  24  25.906   0.698   4.063
  178   3HD2  LEU  24          HD23      LEU  24  26.832   1.927   4.928
  179    H    ARG  25           HN       ARG  25  30.841   0.174   4.831
  180    HA   ARG  25           HA       ARG  25  30.716   2.762   5.864
  181   1HB   ARG  25          HB2       ARG  25  31.322   0.258   6.859
  182   2HB   ARG  25          HB1       ARG  25  32.847   1.121   7.028
  183   1HG   ARG  25          HG2       ARG  25  31.432   1.260   9.036
  184   2HG   ARG  25          HG1       ARG  25  31.790   2.838   8.335
  185   1HD   ARG  25          HD2       ARG  25  29.592   3.205   8.467
  186   2HD   ARG  25          HD1       ARG  25  29.467   2.142   7.064
  187    HE   ARG  25           HE       ARG  25  29.463   0.639   9.475
  188   1HH1  ARG  25          HH11      ARG  25  27.436   2.763   7.559
  189   2HH1  ARG  25          HH12      ARG  25  25.958   1.999   8.051
  190   1HH2  ARG  25          HH21      ARG  25  27.514  -0.356  10.127
  191   2HH2  ARG  25          HH22      ARG  25  25.997   0.216   9.493
  192    H    HIS  26           HN       HIS  26  33.525   0.977   4.601
  193    HA   HIS  26           HA       HIS  26  35.281   3.178   4.991
  194   1HB   HIS  26          HB2       HIS  26  35.631   0.488   4.477
  195   2HB   HIS  26          HB1       HIS  26  36.189   1.265   2.996
  196    HD1  HIS  26           HD1      HIS  26  37.631   0.013   5.879
  197    HD2  HIS  26           HD2      HIS  26  37.871   3.731   4.020
  198    HE1  HIS  26           HE1      HIS  26  39.741   1.071   6.744
  199    HE2  HIS  26           HE2      HIS  26  39.752   3.396   5.768
  200    H    TYR  27           HN       TYR  27  33.435   2.003   2.204
  201    HA   TYR  27           HA       TYR  27  34.597   3.784   0.332
  202   1HB   TYR  27          HB2       TYR  27  33.415   2.003  -0.644
  203   2HB   TYR  27          HB1       TYR  27  32.022   2.228   0.405
  204    HD1  TYR  27           HD1      TYR  27  30.237   2.465  -1.134
  205    HD2  TYR  27           HD2      TYR  27  33.781   4.773  -1.671
  206    HE1  TYR  27           HE1      TYR  27  29.116   3.794  -2.856
  207    HE2  TYR  27           HE2      TYR  27  32.660   6.096  -3.408
  208    HH   TYR  27           HH       TYR  27  29.713   5.182  -4.801
  209    H    LEU  28           HN       LEU  28  31.581   3.954   2.229
  210    HA   LEU  28           HA       LEU  28  30.803   6.506   1.324
  211   1HB   LEU  28          HB2       LEU  28  30.212   5.076   3.909
  212   2HB   LEU  28          HB1       LEU  28  29.494   6.616   3.483
  213    HG   LEU  28           HG       LEU  28  28.967   3.906   2.342
  214   1HD1  LEU  28          HD11      LEU  28  26.906   6.001   2.567
  215   2HD1  LEU  28          HD12      LEU  28  27.624   5.455   4.084
  216   3HD1  LEU  28          HD13      LEU  28  26.846   4.293   3.006
  217   1HD2  LEU  28          HD21      LEU  28  27.653   5.678   0.657
  218   2HD2  LEU  28          HD22      LEU  28  29.020   4.643   0.239
  219   3HD2  LEU  28          HD23      LEU  28  29.297   6.308   0.756
  220    H    ASN  29           HN       ASN  29  33.129   5.560   3.733
  221    HA   ASN  29           HA       ASN  29  33.380   8.240   4.805
  222   1HB   ASN  29          HB2       ASN  29  33.723   6.093   6.119
  223   2HB   ASN  29          HB1       ASN  29  35.238   5.906   5.245
  224   1HD2  ASN  29          HD21      ASN  29  35.985   5.911   7.526
  225   2HD2  ASN  29          HD22      ASN  29  36.412   7.445   8.220
  226    H    LEU  30           HN       LEU  30  35.215   6.120   2.624
  227    HA   LEU  30           HA       LEU  30  37.556   7.717   2.597
  228   1HB   LEU  30          HB2       LEU  30  36.682   5.251   1.436
  229   2HB   LEU  30          HB1       LEU  30  37.469   6.225   0.210
  230    HG   LEU  30           HG       LEU  30  38.665   5.378   2.849
  231   1HD1  LEU  30          HD11      LEU  30  39.769   3.730   1.759
  232   2HD1  LEU  30          HD12      LEU  30  39.847   4.628   0.242
  233   3HD1  LEU  30          HD13      LEU  30  38.352   3.814   0.711
  234   1HD2  LEU  30          HD21      LEU  30  39.787   7.330   2.543
  235   2HD2  LEU  30          HD22      LEU  30  39.523   7.343   0.799
  236   3HD2  LEU  30          HD23      LEU  30  40.758   6.294   1.497
  237    H    VAL  31           HN       VAL  31  34.577   8.078   0.931
  238    HA   VAL  31           HA       VAL  31  35.486   9.274  -1.439
  239    HB   VAL  31           HB       VAL  31  33.259  10.429  -1.513
  240   1HG1  VAL  31          HG11      VAL  31  33.175   8.459  -2.652
  241   2HG1  VAL  31          HG12      VAL  31  31.990   8.122  -1.387
  242   3HG1  VAL  31          HG13      VAL  31  33.633   7.496  -1.246
  243   1HG2  VAL  31          HG21      VAL  31  32.169  10.751   0.396
  244   2HG2  VAL  31          HG22      VAL  31  33.263   9.675   1.267
  245   3HG2  VAL  31          HG23      VAL  31  31.852   9.015   0.437
  246    H    THR  32           HN       THR  32  35.094  10.538   1.781
  247    HA   THR  32           HA       THR  32  35.929  13.196   0.866
  248    HB   THR  32           HB       THR  32  35.503  13.500   3.524
  249    HG1  THR  32           HG1      THR  32  33.279  11.963   3.098
  250   1HG2  THR  32          HG21      THR  32  33.880  14.864   2.804
  251   2HG2  THR  32          HG22      THR  32  32.967  13.534   2.094
  252   3HG2  THR  32          HG23      THR  32  34.270  14.297   1.181
  253    H    ARG  33           HN       ARG  33  37.677  10.909   0.903
  254    HA   ARG  33           HA       ARG  33  39.809  10.366   1.391
  255   1HB   ARG  33          HB2       ARG  33  39.888  13.045   1.406
  256   2HB   ARG  33          HB1       ARG  33  40.312  12.751   3.087
  257   1HG   ARG  33          HG2       ARG  33  41.856  10.980   1.531
  258   2HG   ARG  33          HG1       ARG  33  41.944  12.564   0.758
  259   1HD   ARG  33          HD2       ARG  33  42.974  13.539   2.553
  260   2HD   ARG  33          HD1       ARG  33  42.263  12.417   3.713
  261    HE   ARG  33           HE       ARG  33  43.858  10.732   2.797
  262   1HH1  ARG  33          HH11      ARG  33  44.516  14.158   2.508
  263   2HH1  ARG  33          HH12      ARG  33  46.238  13.965   2.423
  264   1HH2  ARG  33          HH21      ARG  33  46.115  10.446   2.657
  265   2HH2  ARG  33          HH22      ARG  33  47.157  11.831   2.473
  266    H    GLN  34           HN       GLN  34  37.561   9.714   3.159
  267    HA   GLN  34           HA       GLN  34  37.180   8.598   5.102
  268   1HB   GLN  34          HB2       GLN  34  39.699   7.804   4.270
  269   2HB   GLN  34          HB1       GLN  34  39.963   8.277   5.942
  270   1HG   GLN  34          HG2       GLN  34  37.704   6.798   6.162
  271   2HG   GLN  34          HG1       GLN  34  38.529   5.985   4.832
  272   1HE2  GLN  34          HE21      GLN  34  38.811   6.997   8.181
  273   2HE2  GLN  34          HE22      GLN  34  40.037   5.848   8.620
  274    H    ARG  35           HN       ARG  35  37.436  11.483   5.156
  275    HA   ARG  35           HA       ARG  35  38.336  11.843   7.935
  276   1HB   ARG  35          HB2       ARG  35  39.640  13.013   6.022
  277   2HB   ARG  35          HB1       ARG  35  38.253  14.090   5.946
  278   1HG   ARG  35          HG2       ARG  35  38.741  15.095   7.914
  279   2HG   ARG  35          HG1       ARG  35  39.463  13.642   8.606
  280   1HD   ARG  35          HD2       ARG  35  41.224  15.196   8.288
  281   2HD   ARG  35          HD1       ARG  35  41.390  13.978   7.025
  282    HE   ARG  35           HE       ARG  35  39.873  16.295   6.221
  283   1HH1  ARG  35          HH11      ARG  35  43.100  14.952   6.550
  284   2HH1  ARG  35          HH12      ARG  35  43.770  15.957   5.292
  285   1HH2  ARG  35          HH21      ARG  35  40.749  17.581   4.564
  286   2HH2  ARG  35          HH22      ARG  35  42.439  17.442   4.169
  287    H    TYR  36           HN       TYR  36  35.787  12.369   5.614
  288    HA   TYR  36           HA       TYR  36  34.130  13.499   7.760
  289   1HB   TYR  36          HB2       TYR  36  33.774  14.503   4.956
  290   2HB   TYR  36          HB1       TYR  36  33.314  15.264   6.474
  291    HD1  TYR  36           HD1      TYR  36  35.078  16.338   7.888
  292    HD2  TYR  36           HD2      TYR  36  35.887  14.920   3.959
  293    HE1  TYR  36           HE1      TYR  36  37.133  17.688   7.824
  294    HE2  TYR  36           HE2      TYR  36  37.940  16.264   3.890
  295    HH   TYR  36           HH       TYR  36  38.634  18.691   6.131
  296   1HN   NH2  37          H1        NH2  37  32.702  10.439   6.143
  297   2HN   NH2  37          H2        NH2  37  34.215  10.805   6.888
  Start of MODEL   14
    1   1H    TYR   1          HT1       TYR   1  35.094  -1.363  -6.520
    2   2H    TYR   1          HT2       TYR   1  34.451  -0.641  -5.131
    3   3H    TYR   1          HT3       TYR   1  36.130  -0.692  -5.361
    4    HA   TYR   1           HA       TYR   1  36.014   1.301  -6.253
    5   1HB   TYR   1          HB2       TYR   1  35.028  -0.562  -8.257
    6   2HB   TYR   1          HB1       TYR   1  34.389   1.058  -8.520
    7    HD1  TYR   1           HD1      TYR   1  35.632   1.153 -10.656
    8    HD2  TYR   1           HD2      TYR   1  37.646   0.724  -6.935
    9    HE1  TYR   1           HE1      TYR   1  37.747   1.810 -11.733
   10    HE2  TYR   1           HE2      TYR   1  39.761   1.382  -7.995
   11    HH   TYR   1           HH       TYR   1  40.060   1.752 -11.455
   12    HA   PRO   2           HA       PRO   2  32.323   3.594  -5.174
   13   1HB   PRO   2          HB2       PRO   2  32.580   5.197  -7.645
   14   2HB   PRO   2          HB1       PRO   2  32.599   5.720  -5.959
   15   1HG   PRO   2          HG2       PRO   2  34.834   5.705  -7.417
   16   2HG   PRO   2          HG1       PRO   2  34.855   5.243  -5.701
   17   1HD   PRO   2          HD2       PRO   2  34.884   3.495  -8.138
   18   2HD   PRO   2          HD1       PRO   2  35.829   3.348  -6.642
   19    H    ILE   3           HN       ILE   3  31.263   1.471  -5.897
   20    HA   ILE   3           HA       ILE   3  29.777   1.626  -8.382
   21    HB   ILE   3           HB       ILE   3  30.747  -0.510  -7.726
   22   1HG1  ILE   3          HG12      ILE   3  27.722  -0.474  -7.626
   23   2HG1  ILE   3          HG11      ILE   3  28.725  -0.616  -9.065
   24   1HG2  ILE   3          HG21      ILE   3  30.884  -0.721  -5.472
   25   2HG2  ILE   3          HG22      ILE   3  29.398  -1.639  -5.722
   26   3HG2  ILE   3          HG23      ILE   3  29.316   0.041  -5.190
   27   1HD1  ILE   3          HD11      ILE   3  29.540  -2.726  -7.481
   28   2HD1  ILE   3          HD12      ILE   3  28.454  -2.808  -8.867
   29   3HD1  ILE   3          HD13      ILE   3  27.794  -2.655  -7.238
   30    H    LYS   4           HN       LYS   4  29.331   2.470  -5.113
   31    HA   LYS   4           HA       LYS   4  27.577   3.074  -3.810
   32   1HB   LYS   4          HB2       LYS   4  26.054   3.204  -6.425
   33   2HB   LYS   4          HB1       LYS   4  25.479   3.829  -4.887
   34   1HG   LYS   4          HG2       LYS   4  26.955   5.605  -4.900
   35   2HG   LYS   4          HG1       LYS   4  28.072   4.802  -6.006
   36   1HD   LYS   4          HD2       LYS   4  26.995   6.519  -7.245
   37   2HD   LYS   4          HD1       LYS   4  26.292   4.989  -7.774
   38   1HE   LYS   4          HE2       LYS   4  24.544   5.519  -5.881
   39   2HE   LYS   4          HE1       LYS   4  25.090   7.175  -6.146
   40   1HZ   LYS   4          HZ1       LYS   4  24.446   7.056  -8.416
   41   2HZ   LYS   4          HZ2       LYS   4  23.133   6.506  -7.491
   42   3HZ   LYS   4          HZ3       LYS   4  24.114   5.394  -8.312
   43    HA   PRO   5           HA       PRO   5  26.404  -1.400  -3.915
   44   1HB   PRO   5          HB2       PRO   5  26.546  -1.668  -1.180
   45   2HB   PRO   5          HB1       PRO   5  27.909  -1.922  -2.281
   46   1HG   PRO   5          HG2       PRO   5  27.208   0.483  -0.643
   47   2HG   PRO   5          HG1       PRO   5  28.797  -0.246  -0.939
   48   1HD   PRO   5          HD2       PRO   5  27.998   1.961  -2.240
   49   2HD   PRO   5          HD1       PRO   5  28.997   0.726  -3.034
   50    H    GLU   6           HN       GLU   6  24.381  -2.094  -3.872
   51    HA   GLU   6           HA       GLU   6  22.373  -0.569  -2.387
   52   1HB   GLU   6          HB2       GLU   6  22.371  -1.628  -4.954
   53   2HB   GLU   6          HB1       GLU   6  21.407  -2.779  -4.042
   54   1HG   GLU   6          HG2       GLU   6  20.853   0.156  -3.843
   55   2HG   GLU   6          HG1       GLU   6  20.231  -0.792  -5.193
   56    H    ALA   7           HN       ALA   7  20.624  -1.910  -1.327
   57    HA   ALA   7           HA       ALA   7  21.815  -3.727   0.512
   58   1HB   ALA   7          HB1       ALA   7  19.536  -4.000   1.385
   59   2HB   ALA   7          HB2       ALA   7  18.905  -3.117  -0.005
   60   3HB   ALA   7          HB3       ALA   7  19.951  -2.301   1.160
   61    HA   PRO   8           HA       PRO   8  21.303  -7.331  -2.097
   62   1HB   PRO   8          HB2       PRO   8  22.576  -9.074  -0.507
   63   2HB   PRO   8          HB1       PRO   8  23.458  -7.817  -1.387
   64   1HG   PRO   8          HG2       PRO   8  22.592  -7.868   1.484
   65   2HG   PRO   8          HG1       PRO   8  24.148  -7.368   0.794
   66   1HD   PRO   8          HD2       PRO   8  22.179  -5.611   1.512
   67   2HD   PRO   8          HD1       PRO   8  23.373  -5.281   0.241
   68    H    GLY   9           HN       GLY   9  20.694  -9.788  -1.434
   69   1HA   GLY   9          HA2       GLY   9  18.806  -9.933   0.735
   70   2HA   GLY   9          HA1       GLY   9  18.059  -9.893  -0.857
   71    H    GLU  10           HN       GLU  10  19.567 -11.450  -2.408
   72    HA   GLU  10           HA       GLU  10  18.800 -14.011  -1.433
   73   1HB   GLU  10          HB2       GLU  10  20.328 -13.319  -3.937
   74   2HB   GLU  10          HB1       GLU  10  19.536 -14.851  -3.596
   75   1HG   GLU  10          HG2       GLU  10  17.807 -14.013  -4.710
   76   2HG   GLU  10          HG1       GLU  10  17.500 -13.059  -3.260
   77    H    ASP  11           HN       ASP  11  19.958 -14.929   0.106
   78    HA   ASP  11           HA       ASP  11  21.660 -15.928   1.220
   79   1HB   ASP  11          HB2       ASP  11  21.662 -17.072  -1.120
   80   2HB   ASP  11          HB1       ASP  11  23.172 -16.197  -1.359
   81    H    ALA  12           HN       ALA  12  21.831 -13.340   1.573
   82    HA   ALA  12           HA       ALA  12  24.666 -12.645   1.117
   83   1HB   ALA  12          HB1       ALA  12  22.200 -11.134   0.701
   84   2HB   ALA  12          HB2       ALA  12  23.809 -10.889   0.023
   85   3HB   ALA  12          HB3       ALA  12  23.422 -10.261   1.626
   86    H    SER  13           HN       SER  13  22.829 -13.864   3.369
   87    HA   SER  13           HA       SER  13  22.474 -12.275   5.504
   88   1HB   SER  13          HB2       SER  13  23.562 -14.835   6.360
   89   2HB   SER  13          HB1       SER  13  21.929 -14.188   6.532
   90    HG   SER  13           HG       SER  13  23.030 -15.798   4.526
   91    HA   PRO  14           HA       PRO  14  26.852 -12.282   7.056
   92   1HB   PRO  14          HB2       PRO  14  28.606 -14.272   6.421
   93   2HB   PRO  14          HB1       PRO  14  27.363 -14.425   7.664
   94   1HG   PRO  14          HG2       PRO  14  27.538 -15.783   5.116
   95   2HG   PRO  14          HG1       PRO  14  26.371 -16.036   6.420
   96   1HD   PRO  14          HD2       PRO  14  26.103 -14.445   3.949
   97   2HD   PRO  14          HD1       PRO  14  24.839 -15.126   4.997
   98    H    GLU  15           HN       GLU  15  27.652 -13.712   3.865
   99    HA   GLU  15           HA       GLU  15  30.108 -12.406   3.633
  100   1HB   GLU  15          HB2       GLU  15  28.281 -13.810   1.739
  101   2HB   GLU  15          HB1       GLU  15  29.627 -12.888   1.081
  102   1HG   GLU  15          HG2       GLU  15  29.895 -15.057   3.145
  103   2HG   GLU  15          HG1       GLU  15  30.102 -15.296   1.411
  104    H    GLU  16           HN       GLU  16  27.248 -11.749   1.666
  105    HA   GLU  16           HA       GLU  16  28.349  -9.386   0.583
  106   1HB   GLU  16          HB2       GLU  16  25.699 -10.763   0.422
  107   2HB   GLU  16          HB1       GLU  16  25.879  -9.137  -0.229
  108   1HG   GLU  16          HG2       GLU  16  27.748 -11.340  -1.011
  109   2HG   GLU  16          HG1       GLU  16  26.186 -11.137  -1.803
  110    H    LEU  17           HN       LEU  17  26.298 -10.054   3.343
  111    HA   LEU  17           HA       LEU  17  25.337  -7.397   3.661
  112   1HB   LEU  17          HB2       LEU  17  24.384  -9.418   4.802
  113   2HB   LEU  17          HB1       LEU  17  25.807  -9.447   5.829
  114    HG   LEU  17           HG       LEU  17  24.852  -6.852   6.088
  115   1HD1  LEU  17          HD11      LEU  17  22.760  -8.207   5.011
  116   2HD1  LEU  17          HD12      LEU  17  22.617  -6.796   6.059
  117   3HD1  LEU  17          HD13      LEU  17  22.469  -8.417   6.740
  118   1HD2  LEU  17          HD21      LEU  17  24.000  -8.938   8.026
  119   2HD2  LEU  17          HD22      LEU  17  24.770  -7.376   8.308
  120   3HD2  LEU  17          HD23      LEU  17  25.728  -8.737   7.725
  121    H    ASN  18           HN       ASN  18  28.005  -9.209   5.169
  122    HA   ASN  18           HA       ASN  18  29.080  -6.956   6.499
  123   1HB   ASN  18          HB2       ASN  18  30.111  -8.655   7.522
  124   2HB   ASN  18          HB1       ASN  18  29.714  -9.761   6.218
  125   1HD2  ASN  18          HD21      ASN  18  31.265 -10.327   4.778
  126   2HD2  ASN  18          HD22      ASN  18  32.906  -9.795   4.868
  127    H    ARG  19           HN       ARG  19  29.501  -8.297   3.294
  128    HA   ARG  19           HA       ARG  19  31.855  -6.935   2.572
  129   1HB   ARG  19          HB2       ARG  19  29.777  -8.445   1.227
  130   2HB   ARG  19          HB1       ARG  19  30.302  -7.077   0.255
  131   1HG   ARG  19          HG2       ARG  19  32.109  -8.187  -0.359
  132   2HG   ARG  19          HG1       ARG  19  32.606  -8.347   1.325
  133   1HD   ARG  19          HD2       ARG  19  32.464 -10.548   0.619
  134   2HD   ARG  19          HD1       ARG  19  30.912 -10.286   1.412
  135    HE   ARG  19           HE       ARG  19  30.243  -9.722  -1.083
  136   1HH1  ARG  19          HH11      ARG  19  32.086 -12.398   0.231
  137   2HH1  ARG  19          HH12      ARG  19  31.805 -13.430  -1.144
  138   1HH2  ARG  19          HH21      ARG  19  29.817 -11.065  -2.832
  139   2HH2  ARG  19          HH22      ARG  19  30.496 -12.668  -2.899
  140    H    TYR  20           HN       TYR  20  28.486  -6.076   1.751
  141    HA   TYR  20           HA       TYR  20  29.184  -3.505   0.780
  142   1HB   TYR  20          HB2       TYR  20  27.083  -3.566   0.007
  143   2HB   TYR  20          HB1       TYR  20  26.900  -5.129   0.785
  144    HD1  TYR  20           HD1      TYR  20  25.944  -1.638   0.804
  145    HD2  TYR  20           HD2      TYR  20  25.827  -5.256   3.047
  146    HE1  TYR  20           HE1      TYR  20  24.142  -0.715   2.195
  147    HE2  TYR  20           HE2      TYR  20  24.031  -4.333   4.447
  148    HH   TYR  20           HH       TYR  20  22.479  -1.297   3.690
  149    H    TYR  21           HN       TYR  21  28.382  -4.751   3.904
  150    HA   TYR  21           HA       TYR  21  27.720  -2.478   5.356
  151   1HB   TYR  21          HB2       TYR  21  28.265  -5.138   5.888
  152   2HB   TYR  21          HB1       TYR  21  29.529  -4.283   6.763
  153    HD1  TYR  21           HD1      TYR  21  29.102  -3.414   8.837
  154    HD2  TYR  21           HD2      TYR  21  25.849  -4.357   6.275
  155    HE1  TYR  21           HE1      TYR  21  27.555  -2.984  10.671
  156    HE2  TYR  21           HE2      TYR  21  24.269  -3.932   8.102
  157    HH   TYR  21           HH       TYR  21  24.494  -4.035  10.781
  158    H    ALA  22           HN       ALA  22  30.918  -4.003   5.253
  159    HA   ALA  22           HA       ALA  22  32.102  -1.728   6.517
  160   1HB   ALA  22          HB1       ALA  22  32.835  -3.951   7.064
  161   2HB   ALA  22          HB2       ALA  22  34.176  -3.026   6.379
  162   3HB   ALA  22          HB3       ALA  22  33.339  -4.228   5.394
  163    H    SER  23           HN       SER  23  31.614  -2.752   3.253
  164    HA   SER  23           HA       SER  23  33.521  -1.067   2.024
  165   1HB   SER  23          HB2       SER  23  30.806  -2.014   1.063
  166   2HB   SER  23          HB1       SER  23  31.955  -1.132   0.055
  167    HG   SER  23           HG       SER  23  32.236  -3.705   1.211
  168    H    LEU  24           HN       LEU  24  30.130  -0.572   2.933
  169    HA   LEU  24           HA       LEU  24  29.773   2.084   2.320
  170   1HB   LEU  24          HB2       LEU  24  28.485   0.141   3.923
  171   2HB   LEU  24          HB1       LEU  24  28.720   1.543   4.945
  172    HG   LEU  24           HG       LEU  24  27.429   2.928   3.473
  173   1HD1  LEU  24          HD11      LEU  24  26.793   2.419   1.341
  174   2HD1  LEU  24          HD12      LEU  24  26.783   0.681   1.640
  175   3HD1  LEU  24          HD13      LEU  24  28.313   1.528   1.420
  176   1HD2  LEU  24          HD21      LEU  24  25.714   2.110   4.631
  177   2HD2  LEU  24          HD22      LEU  24  26.406   0.486   4.638
  178   3HD2  LEU  24          HD23      LEU  24  25.419   1.019   3.277
  179    H    ARG  25           HN       ARG  25  31.004   0.712   5.346
  180    HA   ARG  25           HA       ARG  25  31.618   3.094   6.649
  181   1HB   ARG  25          HB2       ARG  25  32.113   0.288   7.022
  182   2HB   ARG  25          HB1       ARG  25  33.555   1.203   7.432
  183   1HG   ARG  25          HG2       ARG  25  32.644   2.039   9.295
  184   2HG   ARG  25          HG1       ARG  25  31.083   2.317   8.524
  185   1HD   ARG  25          HD2       ARG  25  30.775   0.683  10.245
  186   2HD   ARG  25          HD1       ARG  25  30.638  -0.130   8.684
  187    HE   ARG  25           HE       ARG  25  32.517  -1.349   9.183
  188   1HH1  ARG  25          HH11      ARG  25  32.148   1.215  11.535
  189   2HH1  ARG  25          HH12      ARG  25  33.477   0.677  12.513
  190   1HH2  ARG  25          HH21      ARG  25  34.237  -2.083  10.478
  191   2HH2  ARG  25          HH22      ARG  25  34.685  -1.196  11.909
  192    H    HIS  26           HN       HIS  26  33.925   0.974   4.902
  193    HA   HIS  26           HA       HIS  26  36.067   2.804   5.357
  194   1HB   HIS  26          HB2       HIS  26  35.983   0.162   4.865
  195   2HB   HIS  26          HB1       HIS  26  36.369   0.746   3.248
  196    HD1  HIS  26           HD1      HIS  26  38.802   0.096   3.109
  197    HD2  HIS  26           HD2      HIS  26  37.890   2.238   6.558
  198    HE1  HIS  26           HE1      HIS  26  41.006   0.599   4.202
  199    HE2  HIS  26           HE2      HIS  26  40.442   2.080   6.159
  200    H    TYR  27           HN       TYR  27  34.077   2.041   2.523
  201    HA   TYR  27           HA       TYR  27  35.677   3.578   0.736
  202   1HB   TYR  27          HB2       TYR  27  34.512   2.019  -0.472
  203   2HB   TYR  27          HB1       TYR  27  33.095   2.115   0.561
  204    HD1  TYR  27           HD1      TYR  27  34.945   4.316  -1.855
  205    HD2  TYR  27           HD2      TYR  27  31.188   2.941  -0.402
  206    HE1  TYR  27           HE1      TYR  27  33.794   5.662  -3.562
  207    HE2  TYR  27           HE2      TYR  27  30.033   4.289  -2.096
  208    HH   TYR  27           HH       TYR  27  31.394   6.737  -3.745
  209    H    LEU  28           HN       LEU  28  32.542   4.200   2.376
  210    HA   LEU  28           HA       LEU  28  32.266   6.811   1.295
  211   1HB   LEU  28          HB2       LEU  28  31.123   5.464   3.721
  212   2HB   LEU  28          HB1       LEU  28  30.814   7.159   3.405
  213    HG   LEU  28           HG       LEU  28  30.084   4.872   1.572
  214   1HD1  LEU  28          HD11      LEU  28  28.009   6.612   2.707
  215   2HD1  LEU  28          HD12      LEU  28  28.825   5.562   3.866
  216   3HD1  LEU  28          HD13      LEU  28  28.022   4.866   2.458
  217   1HD2  LEU  28          HD21      LEU  28  30.631   6.885   0.323
  218   2HD2  LEU  28          HD22      LEU  28  29.548   7.830   1.344
  219   3HD2  LEU  28          HD23      LEU  28  28.894   6.583   0.285
  220    H    ASN  29           HN       ASN  29  33.942   5.556   4.109
  221    HA   ASN  29           HA       ASN  29  34.578   7.989   5.362
  222   1HB   ASN  29          HB2       ASN  29  35.347   5.232   5.606
  223   2HB   ASN  29          HB1       ASN  29  36.787   6.237   5.664
  224   1HD2  ASN  29          HD21      ASN  29  33.900   5.286   7.247
  225   2HD2  ASN  29          HD22      ASN  29  34.177   6.125   8.733
  226    H    LEU  30           HN       LEU  30  36.571   6.036   3.139
  227    HA   LEU  30           HA       LEU  30  38.655   7.974   3.125
  228   1HB   LEU  30          HB2       LEU  30  39.513   5.885   2.826
  229   2HB   LEU  30          HB1       LEU  30  38.141   5.337   1.883
  230    HG   LEU  30           HG       LEU  30  39.100   6.912   0.050
  231   1HD1  LEU  30          HD11      LEU  30  41.469   6.506   1.857
  232   2HD1  LEU  30          HD12      LEU  30  40.785   8.036   1.304
  233   3HD1  LEU  30          HD13      LEU  30  41.605   6.970   0.160
  234   1HD2  LEU  30          HD21      LEU  30  40.878   4.939  -0.351
  235   2HD2  LEU  30          HD22      LEU  30  39.148   4.768  -0.655
  236   3HD2  LEU  30          HD23      LEU  30  39.842   4.176   0.856
  237    H    VAL  31           HN       VAL  31  35.835   7.447   1.147
  238    HA   VAL  31           HA       VAL  31  36.847   8.741  -1.158
  239    HB   VAL  31           HB       VAL  31  34.758   7.197  -0.956
  240   1HG1  VAL  31          HG11      VAL  31  32.628   8.474  -0.945
  241   2HG1  VAL  31          HG12      VAL  31  33.534   9.901  -0.438
  242   3HG1  VAL  31          HG13      VAL  31  33.465   8.483   0.609
  243   1HG2  VAL  31          HG21      VAL  31  35.023   7.670  -3.124
  244   2HG2  VAL  31          HG22      VAL  31  35.433   9.354  -2.796
  245   3HG2  VAL  31          HG23      VAL  31  33.743   8.858  -2.876
  246    H    THR  32           HN       THR  32  35.371   9.897   1.749
  247    HA   THR  32           HA       THR  32  35.269  12.625   0.744
  248    HB   THR  32           HB       THR  32  34.929  12.015   3.642
  249    HG1  THR  32           HG1      THR  32  33.646  10.386   2.984
  250   1HG2  THR  32          HG21      THR  32  34.294  14.119   1.818
  251   2HG2  THR  32          HG22      THR  32  34.074  14.074   3.569
  252   3HG2  THR  32          HG23      THR  32  32.794  13.492   2.505
  253    H    ARG  33           HN       ARG  33  37.742  10.926   1.068
  254    HA   ARG  33           HA       ARG  33  39.923  11.135   1.635
  255   1HB   ARG  33          HB2       ARG  33  38.946  13.852   1.403
  256   2HB   ARG  33          HB1       ARG  33  40.248  13.740   2.577
  257   1HG   ARG  33          HG2       ARG  33  40.977  12.228   0.284
  258   2HG   ARG  33          HG1       ARG  33  40.423  13.820  -0.240
  259   1HD   ARG  33          HD2       ARG  33  42.474  14.530   0.264
  260   2HD   ARG  33          HD1       ARG  33  41.972  14.400   1.949
  261    HE   ARG  33           HE       ARG  33  43.320  12.181   0.529
  262   1HH1  ARG  33          HH11      ARG  33  42.909  14.238   3.335
  263   2HH1  ARG  33          HH12      ARG  33  44.213  13.501   4.226
  264   1HH2  ARG  33          HH21      ARG  33  45.013  11.182   1.718
  265   2HH2  ARG  33          HH22      ARG  33  45.401  11.772   3.310
  266    H    GLN  34           HN       GLN  34  37.759  10.595   3.623
  267    HA   GLN  34           HA       GLN  34  37.471  10.197   5.837
  268   1HB   GLN  34          HB2       GLN  34  40.338   9.986   5.388
  269   2HB   GLN  34          HB1       GLN  34  39.957  10.440   7.044
  270   1HG   GLN  34          HG2       GLN  34  38.175   8.393   6.404
  271   2HG   GLN  34          HG1       GLN  34  39.735   7.896   5.746
  272   1HE2  GLN  34          HE21      GLN  34  37.848   7.582   8.336
  273   2HE2  GLN  34          HE22      GLN  34  39.046   7.384   9.572
  274    H    ARG  35           HN       ARG  35  37.942  13.112   4.732
  275    HA   ARG  35           HA       ARG  35  37.446  14.400   7.270
  276   1HB   ARG  35          HB2       ARG  35  40.028  14.651   5.851
  277   2HB   ARG  35          HB1       ARG  35  39.297  16.171   6.344
  278   1HG   ARG  35          HG2       ARG  35  39.080  14.512   8.573
  279   2HG   ARG  35          HG1       ARG  35  40.693  14.210   7.917
  280   1HD   ARG  35          HD2       ARG  35  39.711  17.016   8.214
  281   2HD   ARG  35          HD1       ARG  35  40.294  16.142   9.629
  282    HE   ARG  35           HE       ARG  35  42.339  15.757   8.037
  283   1HH1  ARG  35          HH11      ARG  35  40.444  18.669   8.460
  284   2HH1  ARG  35          HH12      ARG  35  41.764  19.742   8.086
  285   1HH2  ARG  35          HH21      ARG  35  44.076  17.143   7.537
  286   2HH2  ARG  35          HH22      ARG  35  43.832  18.870   7.545
  287    H    TYR  36           HN       TYR  36  38.662  15.670   4.191
  288    HA   TYR  36           HA       TYR  36  36.049  16.356   3.232
  289   1HB   TYR  36          HB2       TYR  36  36.925  18.185   4.970
  290   2HB   TYR  36          HB1       TYR  36  37.791  18.751   3.546
  291    HD1  TYR  36           HD1      TYR  36  36.730  20.637   2.733
  292    HD2  TYR  36           HD2      TYR  36  34.362  17.335   3.986
  293    HE1  TYR  36           HE1      TYR  36  34.706  21.796   1.947
  294    HE2  TYR  36           HE2      TYR  36  32.332  18.483   3.205
  295    HH   TYR  36           HH       TYR  36  31.475  20.407   2.470
  296   1HN   NH2  37          H1        NH2  37  37.563  16.827   0.085
  297   2HN   NH2  37          H2        NH2  37  36.112  16.955   1.014
  Start of MODEL   15
    1   1H    TYR   1          HT1       TYR   1  38.044   7.678  -8.480
    2   2H    TYR   1          HT2       TYR   1  38.040   6.487  -7.275
    3   3H    TYR   1          HT3       TYR   1  38.181   8.126  -6.852
    4    HA   TYR   1           HA       TYR   1  36.025   8.380  -6.746
    5   1HB   TYR   1          HB2       TYR   1  36.300   7.435  -9.552
    6   2HB   TYR   1          HB1       TYR   1  34.686   7.377  -8.852
    7    HD1  TYR   1           HD1      TYR   1  36.033   9.156 -11.130
    8    HD2  TYR   1           HD2      TYR   1  34.889   9.808  -7.085
    9    HE1  TYR   1           HE1      TYR   1  35.748  11.554 -11.605
   10    HE2  TYR   1           HE2      TYR   1  34.598  12.204  -7.543
   11    HH   TYR   1           HH       TYR   1  35.613  13.871  -9.300
   12    HA   PRO   2           HA       PRO   2  34.616   4.487  -5.112
   13   1HB   PRO   2          HB2       PRO   2  32.273   5.283  -4.083
   14   2HB   PRO   2          HB1       PRO   2  33.808   5.813  -3.385
   15   1HG   PRO   2          HG2       PRO   2  31.960   7.276  -5.228
   16   2HG   PRO   2          HG1       PRO   2  32.828   7.877  -3.805
   17   1HD   PRO   2          HD2       PRO   2  33.672   8.249  -6.392
   18   2HD   PRO   2          HD1       PRO   2  34.750   8.243  -4.982
   19    H    ILE   3           HN       ILE   3  31.898   3.793  -4.977
   20    HA   ILE   3           HA       ILE   3  30.830   3.944  -7.655
   21    HB   ILE   3           HB       ILE   3  32.324   2.058  -7.853
   22   1HG1  ILE   3          HG12      ILE   3  30.336   0.216  -8.074
   23   2HG1  ILE   3          HG11      ILE   3  29.407   1.712  -8.043
   24   1HG2  ILE   3          HG21      ILE   3  31.118   0.083  -6.212
   25   2HG2  ILE   3          HG22      ILE   3  31.561   1.463  -5.208
   26   3HG2  ILE   3          HG23      ILE   3  32.781   0.671  -6.207
   27   1HD1  ILE   3          HD11      ILE   3  29.827   1.916 -10.209
   28   2HD1  ILE   3          HD12      ILE   3  30.953   0.560 -10.169
   29   3HD1  ILE   3          HD13      ILE   3  31.519   2.187  -9.799
   30    H    LYS   4           HN       LYS   4  29.533   1.272  -6.028
   31    HA   LYS   4           HA       LYS   4  27.692   2.733  -4.377
   32   1HB   LYS   4          HB2       LYS   4  27.056   2.284  -7.121
   33   2HB   LYS   4          HB1       LYS   4  26.005   1.269  -6.144
   34   1HG   LYS   4          HG2       LYS   4  24.733   3.013  -5.648
   35   2HG   LYS   4          HG1       LYS   4  26.122   3.870  -4.979
   36   1HD   LYS   4          HD2       LYS   4  25.918   5.318  -6.662
   37   2HD   LYS   4          HD1       LYS   4  26.462   4.025  -7.735
   38   1HE   LYS   4          HE2       LYS   4  24.505   4.219  -8.770
   39   2HE   LYS   4          HE1       LYS   4  23.776   3.487  -7.343
   40   1HZ   LYS   4          HZ1       LYS   4  22.779   5.651  -8.091
   41   2HZ   LYS   4          HZ2       LYS   4  24.218   6.410  -7.606
   42   3HZ   LYS   4          HZ3       LYS   4  23.261   5.601  -6.463
   43    HA   PRO   5           HA       PRO   5  27.927  -1.428  -2.737
   44   1HB   PRO   5          HB2       PRO   5  27.123  -0.816  -0.244
   45   2HB   PRO   5          HB1       PRO   5  28.746  -0.431  -0.827
   46   1HG   PRO   5          HG2       PRO   5  26.395   1.346  -0.439
   47   2HG   PRO   5          HG1       PRO   5  28.118   1.701  -0.242
   48   1HD   PRO   5          HD2       PRO   5  26.539   2.370  -2.453
   49   2HD   PRO   5          HD1       PRO   5  28.311   2.379  -2.398
   50    H    GLU   6           HN       GLU   6  26.124  -1.985  -4.188
   51    HA   GLU   6           HA       GLU   6  23.420  -1.613  -3.377
   52   1HB   GLU   6          HB2       GLU   6  24.632  -2.412  -5.688
   53   2HB   GLU   6          HB1       GLU   6  24.021  -3.944  -5.080
   54   1HG   GLU   6          HG2       GLU   6  21.788  -3.174  -5.103
   55   2HG   GLU   6          HG1       GLU   6  22.291  -1.503  -5.353
   56    H    ALA   7           HN       ALA   7  21.943  -3.301  -2.699
   57    HA   ALA   7           HA       ALA   7  22.860  -4.716  -0.453
   58   1HB   ALA   7          HB1       ALA   7  20.687  -4.704  -0.047
   59   2HB   ALA   7          HB2       ALA   7  20.442  -5.885  -1.331
   60   3HB   ALA   7          HB3       ALA   7  20.362  -4.161  -1.693
   61    HA   PRO   8           HA       PRO   8  24.402  -8.324  -2.511
   62   1HB   PRO   8          HB2       PRO   8  25.286  -9.636  -0.365
   63   2HB   PRO   8          HB1       PRO   8  26.038  -8.120  -0.883
   64   1HG   PRO   8          HG2       PRO   8  24.083  -8.607   1.328
   65   2HG   PRO   8          HG1       PRO   8  25.501  -7.545   1.303
   66   1HD   PRO   8          HD2       PRO   8  22.882  -6.721   0.899
   67   2HD   PRO   8          HD1       PRO   8  24.325  -5.823   0.386
   68    H    GLY   9           HN       GLY   9  21.652  -8.384  -2.447
   69   1HA   GLY   9          HA2       GLY   9  20.634 -10.632  -2.993
   70   2HA   GLY   9          HA1       GLY   9  21.025 -11.030  -1.319
   71    H    GLU  10           HN       GLU  10  18.894 -11.289  -0.645
   72    HA   GLU  10           HA       GLU  10  17.358  -8.788  -0.672
   73   1HB   GLU  10          HB2       GLU  10  16.580 -11.540  -1.134
   74   2HB   GLU  10          HB1       GLU  10  15.652 -10.847   0.190
   75   1HG   GLU  10          HG2       GLU  10  15.911  -9.691  -2.576
   76   2HG   GLU  10          HG1       GLU  10  14.514 -10.557  -1.935
   77    H    ASP  11           HN       ASP  11  18.200 -11.586   1.315
   78    HA   ASP  11           HA       ASP  11  17.921  -9.871   3.689
   79   1HB   ASP  11          HB2       ASP  11  17.184 -11.646   4.927
   80   2HB   ASP  11          HB1       ASP  11  16.625 -12.185   3.350
   81    H    ALA  12           HN       ALA  12  19.952 -12.092   1.925
   82    HA   ALA  12           HA       ALA  12  22.193 -12.186   1.662
   83   1HB   ALA  12          HB1       ALA  12  22.685  -9.995   1.530
   84   2HB   ALA  12          HB2       ALA  12  23.493 -10.322   3.063
   85   3HB   ALA  12          HB3       ALA  12  21.881  -9.605   3.051
   86    H    SER  13           HN       SER  13  23.715 -13.466   2.492
   87    HA   SER  13           HA       SER  13  23.474 -14.553   5.110
   88   1HB   SER  13          HB2       SER  13  26.047 -15.108   4.048
   89   2HB   SER  13          HB1       SER  13  24.630 -16.163   4.045
   90    HG   SER  13           HG       SER  13  25.702 -15.472   1.930
   91    HA   PRO  14           HA       PRO  14  25.940 -11.969   7.727
   92   1HB   PRO  14          HB2       PRO  14  28.059 -13.707   8.383
   93   2HB   PRO  14          HB1       PRO  14  26.559 -13.483   9.283
   94   1HG   PRO  14          HG2       PRO  14  27.293 -15.590   7.311
   95   2HG   PRO  14          HG1       PRO  14  26.273 -15.707   8.756
   96   1HD   PRO  14          HD2       PRO  14  25.196 -15.664   6.316
   97   2HD   PRO  14          HD1       PRO  14  24.418 -14.818   7.672
   98    H    GLU  15           HN       GLU  15  28.046 -13.982   5.681
   99    HA   GLU  15           HA       GLU  15  30.188 -12.117   5.555
  100   1HB   GLU  15          HB2       GLU  15  30.025 -13.877   3.250
  101   2HB   GLU  15          HB1       GLU  15  31.245 -13.803   4.517
  102   1HG   GLU  15          HG2       GLU  15  29.699 -15.127   5.962
  103   2HG   GLU  15          HG1       GLU  15  28.651 -15.321   4.561
  104    H    GLU  16           HN       GLU  16  27.360 -12.668   3.585
  105    HA   GLU  16           HA       GLU  16  28.093 -11.044   1.399
  106   1HB   GLU  16          HB2       GLU  16  25.644 -12.374   2.371
  107   2HB   GLU  16          HB1       GLU  16  25.360 -10.922   1.423
  108   1HG   GLU  16          HG2       GLU  16  25.709 -13.447   0.432
  109   2HG   GLU  16          HG1       GLU  16  25.853 -11.948  -0.485
  110    H    LEU  17           HN       LEU  17  26.053 -10.479   4.250
  111    HA   LEU  17           HA       LEU  17  25.590  -7.750   3.652
  112   1HB   LEU  17          HB2       LEU  17  24.132  -7.917   5.327
  113   2HB   LEU  17          HB1       LEU  17  24.639  -9.584   5.520
  114    HG   LEU  17           HG       LEU  17  26.521  -8.086   6.955
  115   1HD1  LEU  17          HD11      LEU  17  23.856  -6.819   6.960
  116   2HD1  LEU  17          HD12      LEU  17  25.443  -6.132   7.310
  117   3HD1  LEU  17          HD13      LEU  17  24.599  -7.073   8.539
  118   1HD2  LEU  17          HD21      LEU  17  24.242  -9.217   8.440
  119   2HD2  LEU  17          HD22      LEU  17  25.973  -9.533   8.597
  120   3HD2  LEU  17          HD23      LEU  17  25.044 -10.316   7.318
  121    H    ASN  18           HN       ASN  18  27.999  -9.432   5.623
  122    HA   ASN  18           HA       ASN  18  29.130  -7.080   6.737
  123   1HB   ASN  18          HB2       ASN  18  29.386  -9.515   7.534
  124   2HB   ASN  18          HB1       ASN  18  30.663  -9.637   6.327
  125   1HD2  ASN  18          HD21      ASN  18  32.524  -9.590   7.359
  126   2HD2  ASN  18          HD22      ASN  18  32.962  -8.461   8.599
  127    H    ARG  19           HN       ARG  19  29.833  -8.968   3.830
  128    HA   ARG  19           HA       ARG  19  32.251  -7.617   3.217
  129   1HB   ARG  19          HB2       ARG  19  30.496  -9.530   1.915
  130   2HB   ARG  19          HB1       ARG  19  31.172  -8.375   0.771
  131   1HG   ARG  19          HG2       ARG  19  32.825  -9.927   0.720
  132   2HG   ARG  19          HG1       ARG  19  33.407  -8.962   2.074
  133   1HD   ARG  19          HD2       ARG  19  33.349 -10.762   3.362
  134   2HD   ARG  19          HD1       ARG  19  31.606 -10.857   3.128
  135    HE   ARG  19           HE       ARG  19  33.601 -12.549   1.961
  136   1HH1  ARG  19          HH11      ARG  19  30.414 -11.203   1.470
  137   2HH1  ARG  19          HH12      ARG  19  29.899 -12.449   0.377
  138   1HH2  ARG  19          HH21      ARG  19  32.946 -14.213   0.563
  139   2HH2  ARG  19          HH22      ARG  19  31.351 -14.190  -0.128
  140    H    TYR  20           HN       TYR  20  28.920  -7.096   2.030
  141    HA   TYR  20           HA       TYR  20  29.581  -4.769   0.539
  142   1HB   TYR  20          HB2       TYR  20  27.501  -5.074  -0.219
  143   2HB   TYR  20          HB1       TYR  20  27.295  -6.377   0.938
  144    HD1  TYR  20           HD1      TYR  20  26.254  -3.097  -0.057
  145    HD2  TYR  20           HD2      TYR  20  26.327  -5.802   3.227
  146    HE1  TYR  20           HE1      TYR  20  24.432  -1.840   1.013
  147    HE2  TYR  20           HE2      TYR  20  24.513  -4.540   4.314
  148    HH   TYR  20           HH       TYR  20  22.891  -1.869   2.653
  149    H    TYR  21           HN       TYR  21  28.762  -5.367   3.839
  150    HA   TYR  21           HA       TYR  21  28.099  -2.815   4.744
  151   1HB   TYR  21          HB2       TYR  21  28.275  -5.228   5.903
  152   2HB   TYR  21          HB1       TYR  21  29.782  -4.534   6.486
  153    HD1  TYR  21           HD1      TYR  21  26.124  -4.115   6.440
  154    HD2  TYR  21           HD2      TYR  21  29.800  -2.916   8.191
  155    HE1  TYR  21           HE1      TYR  21  24.885  -2.969   8.214
  156    HE2  TYR  21           HE2      TYR  21  28.590  -1.769   9.976
  157    HH   TYR  21           HH       TYR  21  25.095  -2.070  10.325
  158    H    ALA  22           HN       ALA  22  31.254  -4.439   4.936
  159    HA   ALA  22           HA       ALA  22  32.579  -2.077   5.812
  160   1HB   ALA  22          HB1       ALA  22  33.602  -4.740   4.877
  161   2HB   ALA  22          HB2       ALA  22  33.432  -4.158   6.534
  162   3HB   ALA  22          HB3       ALA  22  34.646  -3.448   5.467
  163    H    SER  23           HN       SER  23  31.883  -3.428   2.676
  164    HA   SER  23           HA       SER  23  33.691  -1.815   1.201
  165   1HB   SER  23          HB2       SER  23  30.996  -2.946   0.406
  166   2HB   SER  23          HB1       SER  23  32.142  -2.210  -0.713
  167    HG   SER  23           HG       SER  23  32.409  -4.602   0.778
  168    H    LEU  24           HN       LEU  24  30.496  -1.266   2.524
  169    HA   LEU  24           HA       LEU  24  30.080   1.328   1.430
  170   1HB   LEU  24          HB2       LEU  24  28.159   0.104   2.164
  171   2HB   LEU  24          HB1       LEU  24  28.872  -0.196   3.739
  172    HG   LEU  24           HG       LEU  24  28.788   2.474   3.825
  173   1HD1  LEU  24          HD11      LEU  24  27.253   1.847   1.527
  174   2HD1  LEU  24          HD12      LEU  24  27.505   3.419   2.289
  175   3HD1  LEU  24          HD13      LEU  24  26.149   2.404   2.784
  176   1HD2  LEU  24          HD21      LEU  24  27.839   1.435   5.614
  177   2HD2  LEU  24          HD22      LEU  24  26.884   0.339   4.613
  178   3HD2  LEU  24          HD23      LEU  24  26.380   2.017   4.814
  179    H    ARG  25           HN       ARG  25  31.529  -0.020   4.310
  180    HA   ARG  25           HA       ARG  25  31.939   2.378   5.725
  181   1HB   ARG  25          HB2       ARG  25  33.458  -0.235   5.737
  182   2HB   ARG  25          HB1       ARG  25  33.770   1.078   6.866
  183   1HG   ARG  25          HG2       ARG  25  31.171  -0.404   6.566
  184   2HG   ARG  25          HG1       ARG  25  32.353  -0.631   7.856
  185   1HD   ARG  25          HD2       ARG  25  31.042   2.014   7.280
  186   2HD   ARG  25          HD1       ARG  25  30.369   0.835   8.405
  187    HE   ARG  25           HE       ARG  25  32.990   2.153   8.726
  188   1HH1  ARG  25          HH11      ARG  25  30.113   0.693  10.084
  189   2HH1  ARG  25          HH12      ARG  25  30.661   0.835  11.728
  190   1HH2  ARG  25          HH21      ARG  25  33.696   2.395  10.863
  191   2HH2  ARG  25          HH22      ARG  25  32.705   1.818  12.177
  192    H    HIS  26           HN       HIS  26  33.971   0.616   3.400
  193    HA   HIS  26           HA       HIS  26  36.085   2.531   3.444
  194   1HB   HIS  26          HB2       HIS  26  35.959   0.014   2.550
  195   2HB   HIS  26          HB1       HIS  26  35.645   0.845   1.030
  196    HD1  HIS  26           HD1      HIS  26  38.145  -0.686   0.995
  197    HD2  HIS  26           HD2      HIS  26  38.000   3.167   2.556
  198    HE1  HIS  26           HE1      HIS  26  40.502   0.180   0.893
  199    HE2  HIS  26           HE2      HIS  26  40.424   2.416   2.054
  200    H    TYR  27           HN       TYR  27  33.380   1.919   1.251
  201    HA   TYR  27           HA       TYR  27  33.887   3.912  -0.630
  202   1HB   TYR  27          HB2       TYR  27  32.244   2.548  -1.412
  203   2HB   TYR  27          HB1       TYR  27  31.593   2.241   0.190
  204    HD1  TYR  27           HD1      TYR  27  31.294   4.208  -2.847
  205    HD2  TYR  27           HD2      TYR  27  29.926   3.810   1.164
  206    HE1  TYR  27           HE1      TYR  27  29.343   5.608  -3.377
  207    HE2  TYR  27           HE2      TYR  27  27.980   5.218   0.649
  208    HH   TYR  27           HH       TYR  27  27.130   6.711  -0.875
  209    H    LEU  28           HN       LEU  28  32.095   4.013   2.427
  210    HA   LEU  28           HA       LEU  28  31.430   6.795   2.171
  211   1HB   LEU  28          HB2       LEU  28  31.007   4.675   4.095
  212   2HB   LEU  28          HB1       LEU  28  31.411   6.186   4.887
  213    HG   LEU  28           HG       LEU  28  29.391   6.456   2.784
  214   1HD1  LEU  28          HD11      LEU  28  28.812   4.826   5.248
  215   2HD1  LEU  28          HD12      LEU  28  28.732   4.274   3.571
  216   3HD1  LEU  28          HD13      LEU  28  27.594   5.491   4.159
  217   1HD2  LEU  28          HD21      LEU  28  30.280   7.937   4.887
  218   2HD2  LEU  28          HD22      LEU  28  28.811   7.227   5.552
  219   3HD2  LEU  28          HD23      LEU  28  28.736   8.179   4.068
  220    H    ASN  29           HN       ASN  29  34.113   5.025   3.534
  221    HA   ASN  29           HA       ASN  29  35.160   6.993   5.228
  222   1HB   ASN  29          HB2       ASN  29  36.184   5.005   5.665
  223   2HB   ASN  29          HB1       ASN  29  36.173   4.504   3.980
  224   1HD2  ASN  29          HD21      ASN  29  37.870   6.346   6.412
  225   2HD2  ASN  29          HD22      ASN  29  39.375   6.442   5.564
  226    H    LEU  30           HN       LEU  30  35.875   6.326   1.802
  227    HA   LEU  30           HA       LEU  30  37.735   8.545   1.708
  228   1HB   LEU  30          HB2       LEU  30  37.802   8.019  -0.751
  229   2HB   LEU  30          HB1       LEU  30  38.312   6.729   0.319
  230    HG   LEU  30           HG       LEU  30  35.664   6.133  -0.025
  231   1HD1  LEU  30          HD11      LEU  30  36.520   6.738  -2.802
  232   2HD1  LEU  30          HD12      LEU  30  35.886   8.068  -1.830
  233   3HD1  LEU  30          HD13      LEU  30  34.899   6.633  -2.113
  234   1HD2  LEU  30          HD21      LEU  30  38.065   5.249  -1.622
  235   2HD2  LEU  30          HD22      LEU  30  36.509   4.421  -1.621
  236   3HD2  LEU  30          HD23      LEU  30  37.449   4.527  -0.132
  237    H    VAL  31           HN       VAL  31  34.390   8.140   1.412
  238    HA   VAL  31           HA       VAL  31  33.935  10.281  -0.456
  239    HB   VAL  31           HB       VAL  31  32.375   8.177   0.702
  240   1HG1  VAL  31          HG11      VAL  31  31.159  10.916   0.994
  241   2HG1  VAL  31          HG12      VAL  31  31.374   9.689   2.242
  242   3HG1  VAL  31          HG13      VAL  31  30.218   9.424   0.938
  243   1HG2  VAL  31          HG21      VAL  31  32.566   9.729  -1.688
  244   2HG2  VAL  31          HG22      VAL  31  30.873   9.575  -1.219
  245   3HG2  VAL  31          HG23      VAL  31  31.859   8.130  -1.450
  246    H    THR  32           HN       THR  32  34.246   9.958   2.988
  247    HA   THR  32           HA       THR  32  32.930  12.433   3.620
  248    HB   THR  32           HB       THR  32  34.646  11.768   5.752
  249    HG1  THR  32           HG1      THR  32  33.389   9.450   4.650
  250   1HG2  THR  32          HG21      THR  32  31.741  11.045   5.347
  251   2HG2  THR  32          HG22      THR  32  32.329  12.617   5.890
  252   3HG2  THR  32          HG23      THR  32  32.578  11.187   6.892
  253    H    ARG  33           HN       ARG  33  35.972  11.629   2.382
  254    HA   ARG  33           HA       ARG  33  37.256  13.999   3.492
  255   1HB   ARG  33          HB2       ARG  33  38.461  11.792   3.329
  256   2HB   ARG  33          HB1       ARG  33  38.459  12.002   1.584
  257   1HG   ARG  33          HG2       ARG  33  40.331  13.164   1.750
  258   2HG   ARG  33          HG1       ARG  33  39.466  14.386   2.681
  259   1HD   ARG  33          HD2       ARG  33  40.137  13.481   4.721
  260   2HD   ARG  33          HD1       ARG  33  40.522  11.914   4.007
  261    HE   ARG  33           HE       ARG  33  42.481  12.934   3.006
  262   1HH1  ARG  33          HH11      ARG  33  40.927  14.723   5.604
  263   2HH1  ARG  33          HH12      ARG  33  42.324  15.707   5.913
  264   1HH2  ARG  33          HH21      ARG  33  44.293  14.267   3.414
  265   2HH2  ARG  33          HH22      ARG  33  44.220  15.461   4.677
  266    H    GLN  34           HN       GLN  34  35.038  14.398   1.746
  267    HA   GLN  34           HA       GLN  34  36.156  15.510  -0.673
  268   1HB   GLN  34          HB2       GLN  34  33.644  14.797  -0.061
  269   2HB   GLN  34          HB1       GLN  34  33.555  16.488   0.410
  270   1HG   GLN  34          HG2       GLN  34  34.394  17.083  -1.871
  271   2HG   GLN  34          HG1       GLN  34  34.224  15.383  -2.303
  272   1HE2  GLN  34          HE21      GLN  34  32.651  18.377  -1.964
  273   2HE2  GLN  34          HE22      GLN  34  31.040  17.828  -2.291
  274    H    ARG  35           HN       ARG  35  37.821  16.369   1.010
  275    HA   ARG  35           HA       ARG  35  36.913  18.835   2.305
  276   1HB   ARG  35          HB2       ARG  35  38.434  16.619   3.194
  277   2HB   ARG  35          HB1       ARG  35  39.536  17.994   3.120
  278   1HG   ARG  35          HG2       ARG  35  38.674  18.878   4.962
  279   2HG   ARG  35          HG1       ARG  35  37.032  18.754   4.326
  280   1HD   ARG  35          HD2       ARG  35  37.907  16.140   4.996
  281   2HD   ARG  35          HD1       ARG  35  38.287  17.197   6.355
  282    HE   ARG  35           HE       ARG  35  35.703  16.309   5.542
  283   1HH1  ARG  35          HH11      ARG  35  37.389  19.010   7.010
  284   2HH1  ARG  35          HH12      ARG  35  35.992  19.583   7.871
  285   1HH2  ARG  35          HH21      ARG  35  33.859  17.058   6.678
  286   2HH2  ARG  35          HH22      ARG  35  33.991  18.482   7.677
  287    H    TYR  36           HN       TYR  36  37.682  20.736   1.684
  288    HA   TYR  36           HA       TYR  36  39.866  20.759  -0.292
  289   1HB   TYR  36          HB2       TYR  36  38.100  23.135   0.101
  290   2HB   TYR  36          HB1       TYR  36  38.887  22.556  -1.358
  291    HD1  TYR  36           HD1      TYR  36  35.827  22.777   0.403
  292    HD2  TYR  36           HD2      TYR  36  37.941  20.353  -2.379
  293    HE1  TYR  36           HE1      TYR  36  33.705  21.789  -0.343
  294    HE2  TYR  36           HE2      TYR  36  35.821  19.358  -3.130
  295    HH   TYR  36           HH       TYR  36  32.918  20.666  -2.623
  296   1HN   NH2  37          H1        NH2  37  41.962  22.687   1.705
  297   2HN   NH2  37          H2        NH2  37  41.753  21.625   0.356
  Start of MODEL   16
    1   1H    TYR   1          HT1       TYR   1  30.258  -1.950  -9.609
    2   2H    TYR   1          HT2       TYR   1  31.412  -1.610  -8.422
    3   3H    TYR   1          HT3       TYR   1  30.254  -0.449  -8.834
    4    HA   TYR   1           HA       TYR   1  28.502  -1.964  -8.073
    5   1HB   TYR   1          HB2       TYR   1  30.912  -3.578  -7.257
    6   2HB   TYR   1          HB1       TYR   1  29.362  -3.764  -6.443
    7    HD1  TYR   1           HD1      TYR   1  27.407  -3.659  -8.555
    8    HD2  TYR   1           HD2      TYR   1  31.274  -5.428  -8.585
    9    HE1  TYR   1           HE1      TYR   1  26.676  -5.212 -10.315
   10    HE2  TYR   1           HE2      TYR   1  30.556  -6.987 -10.347
   11    HH   TYR   1           HH       TYR   1  27.261  -7.374 -11.235
   12    HA   PRO   2           HA       PRO   2  30.031  -0.427  -3.827
   13   1HB   PRO   2          HB2       PRO   2  32.570   0.375  -3.452
   14   2HB   PRO   2          HB1       PRO   2  32.095  -1.323  -3.310
   15   1HG   PRO   2          HG2       PRO   2  33.415   0.095  -5.587
   16   2HG   PRO   2          HG1       PRO   2  33.767  -1.504  -4.907
   17   1HD   PRO   2          HD2       PRO   2  32.284  -1.123  -7.171
   18   2HD   PRO   2          HD1       PRO   2  32.088  -2.518  -6.092
   19    H    ILE   3           HN       ILE   3  28.705   1.207  -5.038
   20    HA   ILE   3           HA       ILE   3  30.172   3.755  -5.098
   21    HB   ILE   3           HB       ILE   3  29.387   3.183  -7.335
   22   1HG1  ILE   3          HG12      ILE   3  27.502   5.255  -7.176
   23   2HG1  ILE   3          HG11      ILE   3  28.650   5.562  -5.878
   24   1HG2  ILE   3          HG21      ILE   3  27.254   2.049  -6.105
   25   2HG2  ILE   3          HG22      ILE   3  27.359   2.387  -7.836
   26   3HG2  ILE   3          HG23      ILE   3  26.545   3.525  -6.758
   27   1HD1  ILE   3          HD11      ILE   3  30.477   5.360  -7.556
   28   2HD1  ILE   3          HD12      ILE   3  29.388   6.724  -7.813
   29   3HD1  ILE   3          HD13      ILE   3  29.239   5.272  -8.807
   30    H    LYS   4           HN       LYS   4  27.091   2.201  -4.314
   31    HA   LYS   4           HA       LYS   4  26.861   3.454  -1.831
   32   1HB   LYS   4          HB2       LYS   4  26.274   5.329  -3.625
   33   2HB   LYS   4          HB1       LYS   4  24.706   4.532  -3.595
   34   1HG   LYS   4          HG2       LYS   4  25.816   5.090  -0.946
   35   2HG   LYS   4          HG1       LYS   4  25.480   6.525  -1.916
   36   1HD   LYS   4          HD2       LYS   4  23.293   6.312  -1.584
   37   2HD   LYS   4          HD1       LYS   4  23.321   4.637  -2.133
   38   1HE   LYS   4          HE2       LYS   4  24.492   4.721   0.448
   39   2HE   LYS   4          HE1       LYS   4  22.997   5.652   0.510
   40   1HZ   LYS   4          HZ1       LYS   4  23.371   2.804  -0.162
   41   2HZ   LYS   4          HZ2       LYS   4  21.988   3.632  -0.680
   42   3HZ   LYS   4          HZ3       LYS   4  22.328   3.494   0.980
   43    HA   PRO   5           HA       PRO   5  24.165  -0.241  -2.798
   44   1HB   PRO   5          HB2       PRO   5  25.010  -1.744  -0.686
   45   2HB   PRO   5          HB1       PRO   5  25.793  -1.768  -2.267
   46   1HG   PRO   5          HG2       PRO   5  26.589  -0.324   0.224
   47   2HG   PRO   5          HG1       PRO   5  27.608  -1.163  -0.960
   48   1HD   PRO   5          HD2       PRO   5  27.325   1.539  -0.904
   49   2HD   PRO   5          HD1       PRO   5  27.638   0.635  -2.396
   50    H    GLU   6           HN       GLU   6  22.223  -0.657  -1.833
   51    HA   GLU   6           HA       GLU   6  21.538   0.970   0.502
   52   1HB   GLU   6          HB2       GLU   6  19.555  -0.593  -1.123
   53   2HB   GLU   6          HB1       GLU   6  19.308   0.881  -0.198
   54   1HG   GLU   6          HG2       GLU   6  21.199   1.092  -2.438
   55   2HG   GLU   6          HG1       GLU   6  19.517   0.791  -2.877
   56    H    ALA   7           HN       ALA   7  21.666  -2.325  -0.633
   57    HA   ALA   7           HA       ALA   7  21.384  -3.354   2.053
   58   1HB   ALA   7          HB1       ALA   7  19.167  -3.695   1.809
   59   2HB   ALA   7          HB2       ALA   7  19.643  -5.028   0.759
   60   3HB   ALA   7          HB3       ALA   7  19.229  -3.462   0.062
   61    HA   PRO   8           HA       PRO   8  23.995  -6.623   0.421
   62   1HB   PRO   8          HB2       PRO   8  22.100  -8.756   1.191
   63   2HB   PRO   8          HB1       PRO   8  23.763  -8.481   1.723
   64   1HG   PRO   8          HG2       PRO   8  21.693  -8.018   3.351
   65   2HG   PRO   8          HG1       PRO   8  23.131  -6.978   3.364
   66   1HD   PRO   8          HD2       PRO   8  20.459  -6.504   2.099
   67   2HD   PRO   8          HD1       PRO   8  21.490  -5.377   3.003
   68    H    GLY   9           HN       GLY   9  23.013  -9.261  -0.462
   69   1HA   GLY   9          HA2       GLY   9  22.367  -8.395  -3.174
   70   2HA   GLY   9          HA1       GLY   9  22.997  -9.972  -2.707
   71    H    GLU  10           HN       GLU  10  21.355 -10.904  -0.880
   72    HA   GLU  10           HA       GLU  10  18.603 -10.426  -1.289
   73   1HB   GLU  10          HB2       GLU  10  19.880 -12.366  -3.072
   74   2HB   GLU  10          HB1       GLU  10  18.540 -13.053  -2.166
   75   1HG   GLU  10          HG2       GLU  10  18.537 -10.874  -4.199
   76   2HG   GLU  10          HG1       GLU  10  17.530 -12.315  -4.099
   77    H    ASP  11           HN       ASP  11  21.163 -12.566  -0.263
   78    HA   ASP  11           HA       ASP  11  19.419 -14.049   1.518
   79   1HB   ASP  11          HB2       ASP  11  21.250 -15.149   0.215
   80   2HB   ASP  11          HB1       ASP  11  22.415 -14.258   1.187
   81    H    ALA  12           HN       ALA  12  22.149 -11.821   1.733
   82    HA   ALA  12           HA       ALA  12  22.947 -10.502   3.390
   83   1HB   ALA  12          HB1       ALA  12  20.651 -11.087   5.196
   84   2HB   ALA  12          HB2       ALA  12  20.386 -10.137   3.734
   85   3HB   ALA  12          HB3       ALA  12  21.538  -9.583   4.951
   86    H    SER  13           HN       SER  13  23.473 -13.366   3.252
   87    HA   SER  13           HA       SER  13  23.851 -14.499   5.784
   88   1HB   SER  13          HB2       SER  13  25.060 -14.836   3.082
   89   2HB   SER  13          HB1       SER  13  25.955 -15.499   4.449
   90    HG   SER  13           HG       SER  13  23.205 -16.024   3.919
   91    HA   PRO  14           HA       PRO  14  27.112 -12.519   8.018
   92   1HB   PRO  14          HB2       PRO  14  29.205 -14.424   7.503
   93   2HB   PRO  14          HB1       PRO  14  28.270 -14.186   8.980
   94   1HG   PRO  14          HG2       PRO  14  27.909 -16.165   6.833
   95   2HG   PRO  14          HG1       PRO  14  27.348 -16.211   8.512
   96   1HD   PRO  14          HD2       PRO  14  25.663 -15.850   6.433
   97   2HD   PRO  14          HD1       PRO  14  25.389 -15.093   8.016
   98    H    GLU  15           HN       GLU  15  28.499 -14.020   5.066
   99    HA   GLU  15           HA       GLU  15  30.416 -11.854   4.851
  100   1HB   GLU  15          HB2       GLU  15  31.167 -13.067   2.787
  101   2HB   GLU  15          HB1       GLU  15  31.263 -14.007   4.268
  102   1HG   GLU  15          HG2       GLU  15  28.812 -14.235   2.610
  103   2HG   GLU  15          HG1       GLU  15  30.288 -15.025   2.055
  104    H    GLU  16           HN       GLU  16  27.325 -12.614   3.643
  105    HA   GLU  16           HA       GLU  16  27.413 -11.072   1.248
  106   1HB   GLU  16          HB2       GLU  16  25.560 -12.783   2.561
  107   2HB   GLU  16          HB1       GLU  16  24.765 -11.233   2.322
  108   1HG   GLU  16          HG2       GLU  16  26.217 -12.285  -0.007
  109   2HG   GLU  16          HG1       GLU  16  24.803 -13.207   0.502
  110    H    LEU  17           HN       LEU  17  26.027 -10.552   4.481
  111    HA   LEU  17           HA       LEU  17  25.381  -7.834   4.004
  112   1HB   LEU  17          HB2       LEU  17  24.761  -7.678   6.232
  113   2HB   LEU  17          HB1       LEU  17  24.479  -9.367   5.862
  114    HG   LEU  17           HG       LEU  17  27.088  -9.304   6.855
  115   1HD1  LEU  17          HD11      LEU  17  26.288  -6.929   7.607
  116   2HD1  LEU  17          HD12      LEU  17  27.181  -7.968   8.718
  117   3HD1  LEU  17          HD13      LEU  17  25.427  -7.836   8.852
  118   1HD2  LEU  17          HD21      LEU  17  25.068 -10.896   7.182
  119   2HD2  LEU  17          HD22      LEU  17  24.715  -9.885   8.586
  120   3HD2  LEU  17          HD23      LEU  17  26.257 -10.734   8.474
  121    H    ASN  18           HN       ASN  18  28.178  -9.468   5.427
  122    HA   ASN  18           HA       ASN  18  29.648  -7.200   6.142
  123   1HB   ASN  18          HB2       ASN  18  30.690  -9.059   6.958
  124   2HB   ASN  18          HB1       ASN  18  30.246 -10.046   5.573
  125   1HD2  ASN  18          HD21      ASN  18  31.772 -10.499   4.119
  126   2HD2  ASN  18          HD22      ASN  18  33.336  -9.766   4.043
  127    H    ARG  19           HN       ARG  19  29.373  -8.904   3.050
  128    HA   ARG  19           HA       ARG  19  31.322  -7.513   1.618
  129   1HB   ARG  19          HB2       ARG  19  29.146  -9.266   1.009
  130   2HB   ARG  19          HB1       ARG  19  29.108  -7.913  -0.111
  131   1HG   ARG  19          HG2       ARG  19  30.940 -10.170   0.042
  132   2HG   ARG  19          HG1       ARG  19  30.544  -9.119  -1.315
  133   1HD   ARG  19          HD2       ARG  19  32.371  -8.286   0.925
  134   2HD   ARG  19          HD1       ARG  19  32.950  -9.105  -0.521
  135    HE   ARG  19           HE       ARG  19  32.332  -6.359  -0.272
  136   1HH1  ARG  19          HH11      ARG  19  32.064  -9.005  -2.555
  137   2HH1  ARG  19          HH12      ARG  19  32.076  -7.974  -3.953
  138   1HH2  ARG  19          HH21      ARG  19  32.387  -5.005  -2.093
  139   2HH2  ARG  19          HH22      ARG  19  32.301  -5.697  -3.684
  140    H    TYR  20           HN       TYR  20  27.816  -6.843   1.600
  141    HA   TYR  20           HA       TYR  20  28.081  -4.393   0.226
  142   1HB   TYR  20          HB2       TYR  20  25.861  -4.591   0.104
  143   2HB   TYR  20          HB1       TYR  20  25.967  -6.013   1.126
  144    HD1  TYR  20           HD1      TYR  20  25.497  -5.824   3.552
  145    HD2  TYR  20           HD2      TYR  20  25.007  -2.508   0.938
  146    HE1  TYR  20           HE1      TYR  20  24.127  -4.692   5.255
  147    HE2  TYR  20           HE2      TYR  20  23.639  -1.367   2.633
  148    HH   TYR  20           HH       TYR  20  22.630  -1.543   4.604
  149    H    TYR  21           HN       TYR  21  28.052  -5.186   3.633
  150    HA   TYR  21           HA       TYR  21  27.702  -2.596   4.663
  151   1HB   TYR  21          HB2       TYR  21  27.668  -4.996   5.778
  152   2HB   TYR  21          HB1       TYR  21  29.345  -4.600   6.140
  153    HD1  TYR  21           HD1      TYR  21  25.864  -3.862   6.846
  154    HD2  TYR  21           HD2      TYR  21  29.884  -2.759   7.627
  155    HE1  TYR  21           HE1      TYR  21  25.115  -2.550   8.773
  156    HE2  TYR  21           HE2      TYR  21  29.165  -1.444   9.562
  157    HH   TYR  21           HH       TYR  21  26.320  -1.750  11.044
  158    H    ALA  22           HN       ALA  22  30.692  -4.523   4.414
  159    HA   ALA  22           HA       ALA  22  32.311  -2.402   5.356
  160   1HB   ALA  22          HB1       ALA  22  32.967  -5.011   4.024
  161   2HB   ALA  22          HB2       ALA  22  33.105  -4.581   5.731
  162   3HB   ALA  22          HB3       ALA  22  34.203  -3.866   4.547
  163    H    SER  23           HN       SER  23  31.351  -3.446   2.133
  164    HA   SER  23           HA       SER  23  33.224  -1.870   0.724
  165   1HB   SER  23          HB2       SER  23  30.453  -2.670  -0.197
  166   2HB   SER  23          HB1       SER  23  31.793  -2.159  -1.222
  167    HG   SER  23           HG       SER  23  31.525  -4.530   0.295
  168    H    LEU  24           HN       LEU  24  29.961  -1.182   1.916
  169    HA   LEU  24           HA       LEU  24  29.856   1.426   0.769
  170   1HB   LEU  24          HB2       LEU  24  27.735   0.649   1.054
  171   2HB   LEU  24          HB1       LEU  24  28.138  -0.256   2.498
  172    HG   LEU  24           HG       LEU  24  28.362   2.426   3.256
  173   1HD1  LEU  24          HD11      LEU  24  26.351   2.070   1.148
  174   2HD1  LEU  24          HD12      LEU  24  27.155   3.532   1.723
  175   3HD1  LEU  24          HD13      LEU  24  25.778   2.873   2.610
  176   1HD2  LEU  24          HD21      LEU  24  25.918   0.753   3.691
  177   2HD2  LEU  24          HD22      LEU  24  26.692   1.894   4.790
  178   3HD2  LEU  24          HD23      LEU  24  27.463   0.348   4.438
  179    H    ARG  25           HN       ARG  25  30.532   0.091   3.979
  180    HA   ARG  25           HA       ARG  25  30.727   2.579   5.295
  181   1HB   ARG  25          HB2       ARG  25  30.988  -0.150   5.994
  182   2HB   ARG  25          HB1       ARG  25  32.463   0.653   6.513
  183   1HG   ARG  25          HG2       ARG  25  30.576   0.531   8.195
  184   2HG   ARG  25          HG1       ARG  25  31.300   2.116   7.932
  185   1HD   ARG  25          HD2       ARG  25  29.348   2.973   7.296
  186   2HD   ARG  25          HD1       ARG  25  29.121   1.694   6.102
  187    HE   ARG  25           HE       ARG  25  28.504   0.546   8.519
  188   1HH1  ARG  25          HH11      ARG  25  27.350   3.334   6.747
  189   2HH1  ARG  25          HH12      ARG  25  25.720   3.198   7.344
  190   1HH2  ARG  25          HH21      ARG  25  26.358   0.386   9.335
  191   2HH2  ARG  25          HH22      ARG  25  25.171   1.550   8.829
  192    H    HIS  26           HN       HIS  26  33.176   0.511   3.763
  193    HA   HIS  26           HA       HIS  26  35.352   2.227   4.446
  194   1HB   HIS  26          HB2       HIS  26  35.041  -0.313   3.216
  195   2HB   HIS  26          HB1       HIS  26  35.942   0.704   2.097
  196    HD1  HIS  26           HD1      HIS  26  36.122  -0.677   5.606
  197    HD2  HIS  26           HD2      HIS  26  38.561   1.179   2.790
  198    HE1  HIS  26           HE1      HIS  26  38.458  -0.826   6.526
  199    HE2  HIS  26           HE2      HIS  26  39.893   0.422   4.877
  200    H    TYR  27           HN       TYR  27  33.394   1.754   1.519
  201    HA   TYR  27           HA       TYR  27  34.684   3.629  -0.110
  202   1HB   TYR  27          HB2       TYR  27  32.882   1.948  -0.782
  203   2HB   TYR  27          HB1       TYR  27  31.708   3.097  -0.154
  204    HD1  TYR  27           HD1      TYR  27  34.742   3.306  -2.336
  205    HD2  TYR  27           HD2      TYR  27  30.625   4.261  -1.821
  206    HE1  TYR  27           HE1      TYR  27  34.745   4.467  -4.500
  207    HE2  TYR  27           HE2      TYR  27  30.613   5.424  -3.971
  208    HH   TYR  27           HH       TYR  27  32.161   6.488  -5.508
  209    H    LEU  28           HN       LEU  28  31.828   4.012   1.994
  210    HA   LEU  28           HA       LEU  28  31.457   6.754   1.482
  211   1HB   LEU  28          HB2       LEU  28  30.686   4.982   3.772
  212   2HB   LEU  28          HB1       LEU  28  30.363   6.703   3.836
  213    HG   LEU  28           HG       LEU  28  28.964   4.585   2.390
  214   1HD1  LEU  28          HD11      LEU  28  28.422   6.940   3.916
  215   2HD1  LEU  28          HD12      LEU  28  27.339   5.617   3.472
  216   3HD1  LEU  28          HD13      LEU  28  27.536   6.997   2.390
  217   1HD2  LEU  28          HD21      LEU  28  30.188   6.725   0.842
  218   2HD2  LEU  28          HD22      LEU  28  28.434   6.692   0.689
  219   3HD2  LEU  28          HD23      LEU  28  29.380   5.254   0.299
  220    H    ASN  29           HN       ASN  29  33.387   5.133   3.968
  221    HA   ASN  29           HA       ASN  29  34.135   7.473   5.368
  222   1HB   ASN  29          HB2       ASN  29  34.323   5.083   6.189
  223   2HB   ASN  29          HB1       ASN  29  35.760   4.937   5.183
  224   1HD2  ASN  29          HD21      ASN  29  34.344   6.821   7.814
  225   2HD2  ASN  29          HD22      ASN  29  35.846   7.202   8.587
  226    H    LEU  30           HN       LEU  30  35.613   5.723   2.681
  227    HA   LEU  30           HA       LEU  30  37.956   7.304   2.514
  228   1HB   LEU  30          HB2       LEU  30  36.538   5.393   0.732
  229   2HB   LEU  30          HB1       LEU  30  37.681   6.488  -0.021
  230    HG   LEU  30           HG       LEU  30  38.543   4.897   2.358
  231   1HD1  LEU  30          HD11      LEU  30  38.198   3.874  -0.447
  232   2HD1  LEU  30          HD12      LEU  30  37.618   3.163   1.060
  233   3HD1  LEU  30          HD13      LEU  30  39.342   3.163   0.691
  234   1HD2  LEU  30          HD21      LEU  30  40.652   5.387   1.660
  235   2HD2  LEU  30          HD22      LEU  30  39.810   6.780   0.980
  236   3HD2  LEU  30          HD23      LEU  30  40.206   5.401  -0.046
  237    H    VAL  31           HN       VAL  31  34.723   7.603   1.207
  238    HA   VAL  31           HA       VAL  31  35.232   9.729  -0.591
  239    HB   VAL  31           HB       VAL  31  32.732   8.657   0.700
  240   1HG1  VAL  31          HG11      VAL  31  31.349  10.213  -0.244
  241   2HG1  VAL  31          HG12      VAL  31  32.521  10.664  -1.483
  242   3HG1  VAL  31          HG13      VAL  31  32.727  11.231   0.174
  243   1HG2  VAL  31          HG21      VAL  31  32.723   7.297  -1.045
  244   2HG2  VAL  31          HG22      VAL  31  34.230   8.017  -1.610
  245   3HG2  VAL  31          HG23      VAL  31  32.685   8.681  -2.140
  246    H    THR  32           HN       THR  32  34.660   9.599   2.847
  247    HA   THR  32           HA       THR  32  34.025  12.359   3.185
  248    HB   THR  32           HB       THR  32  35.365  11.045   5.454
  249    HG1  THR  32           HG1      THR  32  33.299   9.787   4.044
  250   1HG2  THR  32          HG21      THR  32  34.038  12.448   6.562
  251   2HG2  THR  32          HG22      THR  32  32.599  11.749   5.818
  252   3HG2  THR  32          HG23      THR  32  33.467  13.053   5.008
  253    H    ARG  33           HN       ARG  33  36.898  10.717   2.455
  254    HA   ARG  33           HA       ARG  33  38.517  13.022   3.303
  255   1HB   ARG  33          HB2       ARG  33  39.061  10.509   3.927
  256   2HB   ARG  33          HB1       ARG  33  39.751  10.489   2.312
  257   1HG   ARG  33          HG2       ARG  33  41.219  12.334   2.898
  258   2HG   ARG  33          HG1       ARG  33  40.511  12.392   4.516
  259   1HD   ARG  33          HD2       ARG  33  41.774  10.697   5.229
  260   2HD   ARG  33          HD1       ARG  33  41.407   9.727   3.802
  261    HE   ARG  33           HE       ARG  33  43.181  11.279   2.722
  262   1HH1  ARG  33          HH11      ARG  33  43.224  10.027   5.989
  263   2HH1  ARG  33          HH12      ARG  33  44.957  10.073   6.119
  264   1HH2  ARG  33          HH21      ARG  33  45.456  11.341   2.882
  265   2HH2  ARG  33          HH22      ARG  33  46.234  10.813   4.345
  266    H    GLN  34           HN       GLN  34  38.716  10.594   0.727
  267    HA   GLN  34           HA       GLN  34  39.110  10.694  -1.489
  268   1HB   GLN  34          HB2       GLN  34  37.737  13.312  -1.052
  269   2HB   GLN  34          HB1       GLN  34  38.456  12.969  -2.620
  270   1HG   GLN  34          HG2       GLN  34  37.135  10.846  -2.659
  271   2HG   GLN  34          HG1       GLN  34  36.304  11.416  -1.214
  272   1HE2  GLN  34          HE21      GLN  34  34.716  12.891  -1.401
  273   2HE2  GLN  34          HE22      GLN  34  34.160  13.537  -2.910
  274    H    ARG  35           HN       ARG  35  40.745  12.590   0.670
  275    HA   ARG  35           HA       ARG  35  42.667  13.618  -1.249
  276   1HB   ARG  35          HB2       ARG  35  42.456  13.836   1.755
  277   2HB   ARG  35          HB1       ARG  35  43.811  14.475   0.838
  278   1HG   ARG  35          HG2       ARG  35  40.948  15.362   0.796
  279   2HG   ARG  35          HG1       ARG  35  42.380  16.296   1.222
  280   1HD   ARG  35          HD2       ARG  35  41.857  15.197  -1.537
  281   2HD   ARG  35          HD1       ARG  35  41.393  16.818  -1.027
  282    HE   ARG  35           HE       ARG  35  44.173  16.228  -0.597
  283   1HH1  ARG  35          HH11      ARG  35  41.802  17.404  -2.890
  284   2HH1  ARG  35          HH12      ARG  35  42.968  18.280  -3.841
  285   1HH2  ARG  35          HH21      ARG  35  45.712  17.371  -1.835
  286   2HH2  ARG  35          HH22      ARG  35  45.198  18.239  -3.251
  287    H    TYR  36           HN       TYR  36  43.617  11.809  -2.082
  288    HA   TYR  36           HA       TYR  36  45.512  10.440  -0.353
  289   1HB   TYR  36          HB2       TYR  36  43.130   9.170  -1.543
  290   2HB   TYR  36          HB1       TYR  36  44.638   8.313  -1.836
  291    HD1  TYR  36           HD1      TYR  36  46.099   7.809   0.246
  292    HD2  TYR  36           HD2      TYR  36  41.979   8.853   0.448
  293    HE1  TYR  36           HE1      TYR  36  45.964   6.803   2.487
  294    HE2  TYR  36           HE2      TYR  36  41.830   7.855   2.689
  295    HH   TYR  36           HH       TYR  36  44.527   7.063   4.542
  296   1HN   NH2  37          H1        NH2  37  47.476   9.814  -3.267
  297   2HN   NH2  37          H2        NH2  37  47.155   9.258  -1.664
  Start of MODEL   17
    1   1H    TYR   1          HT1       TYR   1  37.126  -3.810  -5.489
    2   2H    TYR   1          HT2       TYR   1  35.745  -4.764  -5.706
    3   3H    TYR   1          HT3       TYR   1  36.881  -5.181  -4.525
    4    HA   TYR   1           HA       TYR   1  35.394  -4.194  -3.182
    5   1HB   TYR   1          HB2       TYR   1  35.923  -1.527  -3.373
    6   2HB   TYR   1          HB1       TYR   1  36.945  -2.679  -2.526
    7    HD1  TYR   1           HD1      TYR   1  39.195  -2.721  -3.030
    8    HD2  TYR   1           HD2      TYR   1  36.476  -1.249  -5.960
    9    HE1  TYR   1           HE1      TYR   1  41.086  -2.120  -4.481
   10    HE2  TYR   1           HE2      TYR   1  38.365  -0.646  -7.415
   11    HH   TYR   1           HH       TYR   1  41.378  -1.822  -7.081
   12    HA   PRO   2           HA       PRO   2  31.662  -2.742  -5.041
   13   1HB   PRO   2          HB2       PRO   2  30.648  -1.095  -3.116
   14   2HB   PRO   2          HB1       PRO   2  30.621  -2.859  -2.994
   15   1HG   PRO   2          HG2       PRO   2  32.532  -0.902  -1.777
   16   2HG   PRO   2          HG1       PRO   2  31.767  -2.324  -1.042
   17   1HD   PRO   2          HD2       PRO   2  34.306  -2.382  -1.935
   18   2HD   PRO   2          HD1       PRO   2  33.239  -3.797  -2.054
   19    H    ILE   3           HN       ILE   3  31.171  -1.220  -6.484
   20    HA   ILE   3           HA       ILE   3  32.562   1.376  -6.327
   21    HB   ILE   3           HB       ILE   3  31.034   0.795  -8.758
   22   1HG1  ILE   3          HG12      ILE   3  33.364  -0.954  -7.968
   23   2HG1  ILE   3          HG11      ILE   3  31.752  -1.453  -8.476
   24   1HG2  ILE   3          HG21      ILE   3  33.363   2.227  -7.871
   25   2HG2  ILE   3          HG22      ILE   3  32.326   2.494  -9.270
   26   3HG2  ILE   3          HG23      ILE   3  33.668   1.354  -9.373
   27   1HD1  ILE   3          HD11      ILE   3  32.216  -0.614 -10.727
   28   2HD1  ILE   3          HD12      ILE   3  33.369  -1.851 -10.232
   29   3HD1  ILE   3          HD13      ILE   3  33.838  -0.153 -10.213
   30    H    LYS   4           HN       LYS   4  29.507  -0.108  -7.114
   31    HA   LYS   4           HA       LYS   4  28.129   2.263  -6.057
   32   1HB   LYS   4          HB2       LYS   4  28.079   1.190  -8.726
   33   2HB   LYS   4          HB1       LYS   4  26.470   1.100  -8.016
   34   1HG   LYS   4          HG2       LYS   4  28.147   3.600  -8.126
   35   2HG   LYS   4          HG1       LYS   4  26.895   3.182  -9.298
   36   1HD   LYS   4          HD2       LYS   4  25.825   2.940  -6.657
   37   2HD   LYS   4          HD1       LYS   4  26.600   4.517  -6.824
   38   1HE   LYS   4          HE2       LYS   4  24.456   4.943  -7.573
   39   2HE   LYS   4          HE1       LYS   4  25.328   4.632  -9.074
   40   1HZ   LYS   4          HZ1       LYS   4  23.163   3.493  -8.935
   41   2HZ   LYS   4          HZ2       LYS   4  23.725   2.598  -7.613
   42   3HZ   LYS   4          HZ3       LYS   4  24.456   2.420  -9.137
   43    HA   PRO   5           HA       PRO   5  26.676  -1.527  -3.892
   44   1HB   PRO   5          HB2       PRO   5  26.620   0.117  -1.507
   45   2HB   PRO   5          HB1       PRO   5  27.617  -1.295  -1.850
   46   1HG   PRO   5          HG2       PRO   5  28.615   1.236  -1.637
   47   2HG   PRO   5          HG1       PRO   5  29.365  -0.035  -2.618
   48   1HD   PRO   5          HD2       PRO   5  27.614   2.237  -3.466
   49   2HD   PRO   5          HD1       PRO   5  29.062   1.573  -4.255
   50    H    GLU   6           HN       GLU   6  24.581  -1.800  -4.384
   51    HA   GLU   6           HA       GLU   6  22.655   0.209  -3.425
   52   1HB   GLU   6          HB2       GLU   6  22.963  -0.949  -5.982
   53   2HB   GLU   6          HB1       GLU   6  21.504  -1.653  -5.295
   54   1HG   GLU   6          HG2       GLU   6  20.460   0.160  -6.025
   55   2HG   GLU   6          HG1       GLU   6  21.238   1.008  -4.689
   56    H    ALA   7           HN       ALA   7  23.880  -2.029  -1.958
   57    HA   ALA   7           HA       ALA   7  23.318  -3.549  -0.373
   58   1HB   ALA   7          HB1       ALA   7  21.551  -2.265   0.444
   59   2HB   ALA   7          HB2       ALA   7  20.824  -3.841   0.137
   60   3HB   ALA   7          HB3       ALA   7  20.574  -2.518  -1.000
   61    HA   PRO   8           HA       PRO   8  22.854  -7.044  -3.088
   62   1HB   PRO   8          HB2       PRO   8  23.919  -8.752  -1.073
   63   2HB   PRO   8          HB1       PRO   8  24.785  -8.025  -2.423
   64   1HG   PRO   8          HG2       PRO   8  25.165  -7.428   0.273
   65   2HG   PRO   8          HG1       PRO   8  25.726  -6.454  -1.095
   66   1HD   PRO   8          HD2       PRO   8  23.354  -6.074   0.660
   67   2HD   PRO   8          HD1       PRO   8  24.381  -4.864  -0.136
   68    H    GLY   9           HN       GLY   9  20.444  -6.630  -2.530
   69   1HA   GLY   9          HA2       GLY   9  18.462  -7.799  -2.202
   70   2HA   GLY   9          HA1       GLY   9  19.379  -9.090  -1.436
   71    H    GLU  10           HN       GLU  10  20.034  -5.942  -0.363
   72    HA   GLU  10           HA       GLU  10  19.631  -4.740   1.492
   73   1HB   GLU  10          HB2       GLU  10  17.084  -5.931   0.876
   74   2HB   GLU  10          HB1       GLU  10  17.283  -5.779   2.618
   75   1HG   GLU  10          HG2       GLU  10  17.911  -3.471   0.837
   76   2HG   GLU  10          HG1       GLU  10  16.238  -3.837   1.262
   77    H    ASP  11           HN       ASP  11  18.019  -7.656   2.689
   78    HA   ASP  11           HA       ASP  11  19.479  -7.672   5.112
   79   1HB   ASP  11          HB2       ASP  11  17.216  -8.692   4.814
   80   2HB   ASP  11          HB1       ASP  11  17.953  -9.966   3.848
   81    H    ALA  12           HN       ALA  12  19.749  -9.526   2.133
   82    HA   ALA  12           HA       ALA  12  21.442 -10.655   1.153
   83   1HB   ALA  12          HB1       ALA  12  23.790  -9.969   2.360
   84   2HB   ALA  12          HB2       ALA  12  22.765  -8.586   2.742
   85   3HB   ALA  12          HB3       ALA  12  23.007  -9.066   1.062
   86    H    SER  13           HN       SER  13  23.886 -11.594   2.285
   87    HA   SER  13           HA       SER  13  22.875 -13.591   4.205
   88   1HB   SER  13          HB2       SER  13  25.125 -14.562   2.682
   89   2HB   SER  13          HB1       SER  13  23.496 -15.229   2.795
   90    HG   SER  13           HG       SER  13  24.238 -13.061   1.093
   91    HA   PRO  14           HA       PRO  14  26.124 -12.453   7.013
   92   1HB   PRO  14          HB2       PRO  14  26.589 -15.386   7.284
   93   2HB   PRO  14          HB1       PRO  14  26.302 -14.171   8.537
   94   1HG   PRO  14          HG2       PRO  14  24.369 -15.852   7.852
   95   2HG   PRO  14          HG1       PRO  14  24.001 -14.146   8.164
   96   1HD   PRO  14          HD2       PRO  14  24.258 -15.579   5.552
   97   2HD   PRO  14          HD1       PRO  14  23.096 -14.330   6.043
   98    H    GLU  15           HN       GLU  15  28.256 -12.101   6.945
   99    HA   GLU  15           HA       GLU  15  30.434 -12.096   6.336
  100   1HB   GLU  15          HB2       GLU  15  29.856 -14.780   6.108
  101   2HB   GLU  15          HB1       GLU  15  30.430 -14.375   4.494
  102   1HG   GLU  15          HG2       GLU  15  32.047 -15.103   6.499
  103   2HG   GLU  15          HG1       GLU  15  32.542 -14.052   5.173
  104    H    GLU  16           HN       GLU  16  28.213 -12.992   3.755
  105    HA   GLU  16           HA       GLU  16  29.578 -11.660   1.665
  106   1HB   GLU  16          HB2       GLU  16  27.882 -13.344   1.219
  107   2HB   GLU  16          HB1       GLU  16  26.664 -12.372   2.033
  108   1HG   GLU  16          HG2       GLU  16  27.564 -10.645   0.127
  109   2HG   GLU  16          HG1       GLU  16  27.702 -12.197  -0.696
  110    H    LEU  17           HN       LEU  17  26.682 -10.773   3.522
  111    HA   LEU  17           HA       LEU  17  26.678  -8.062   2.717
  112   1HB   LEU  17          HB2       LEU  17  24.710  -8.038   3.767
  113   2HB   LEU  17          HB1       LEU  17  24.971  -9.727   4.144
  114    HG   LEU  17           HG       LEU  17  26.320  -8.163   6.110
  115   1HD1  LEU  17          HD11      LEU  17  23.401  -7.458   5.873
  116   2HD1  LEU  17          HD12      LEU  17  24.710  -6.394   5.357
  117   3HD1  LEU  17          HD13      LEU  17  24.568  -6.858   7.052
  118   1HD2  LEU  17          HD21      LEU  17  23.911  -9.359   7.075
  119   2HD2  LEU  17          HD22      LEU  17  25.578  -9.885   7.300
  120   3HD2  LEU  17          HD23      LEU  17  24.660 -10.437   5.899
  121    H    ASN  18           HN       ASN  18  28.294  -9.809   5.271
  122    HA   ASN  18           HA       ASN  18  29.012  -7.550   6.847
  123   1HB   ASN  18          HB2       ASN  18  29.084  -9.742   7.856
  124   2HB   ASN  18          HB1       ASN  18  30.227 -10.316   6.646
  125   1HD2  ASN  18          HD21      ASN  18  32.194 -10.526   7.420
  126   2HD2  ASN  18          HD22      ASN  18  32.939  -9.487   8.591
  127    H    ARG  19           HN       ARG  19  30.649  -9.383   4.293
  128    HA   ARG  19           HA       ARG  19  33.085  -7.970   4.341
  129   1HB   ARG  19          HB2       ARG  19  31.750  -9.881   2.599
  130   2HB   ARG  19          HB1       ARG  19  32.678  -8.696   1.688
  131   1HG   ARG  19          HG2       ARG  19  34.512  -9.865   2.103
  132   2HG   ARG  19          HG1       ARG  19  34.320  -9.508   3.820
  133   1HD   ARG  19          HD2       ARG  19  33.277 -11.527   4.255
  134   2HD   ARG  19          HD1       ARG  19  32.772 -11.743   2.579
  135    HE   ARG  19           HE       ARG  19  35.054 -12.336   2.039
  136   1HH1  ARG  19          HH11      ARG  19  34.225 -12.271   5.454
  137   2HH1  ARG  19          HH12      ARG  19  35.553 -13.300   5.919
  138   1HH2  ARG  19          HH21      ARG  19  36.782 -13.674   2.650
  139   2HH2  ARG  19          HH22      ARG  19  37.021 -14.079   4.326
  140    H    TYR  20           HN       TYR  20  30.248  -7.583   2.245
  141    HA   TYR  20           HA       TYR  20  31.160  -5.274   0.928
  142   1HB   TYR  20          HB2       TYR  20  29.386  -5.847  -0.312
  143   2HB   TYR  20          HB1       TYR  20  28.797  -6.914   0.954
  144    HD1  TYR  20           HD1      TYR  20  28.390  -3.734  -0.719
  145    HD2  TYR  20           HD2      TYR  20  27.216  -6.041   2.656
  146    HE1  TYR  20           HE1      TYR  20  26.468  -2.240  -0.379
  147    HE2  TYR  20           HE2      TYR  20  25.288  -4.548   3.013
  148    HH   TYR  20           HH       TYR  20  24.456  -2.439   2.459
  149    H    TYR  21           HN       TYR  21  29.579  -5.781   3.966
  150    HA   TYR  21           HA       TYR  21  28.522  -3.257   4.502
  151   1HB   TYR  21          HB2       TYR  21  28.540  -5.587   5.824
  152   2HB   TYR  21          HB1       TYR  21  29.792  -4.752   6.735
  153    HD1  TYR  21           HD1      TYR  21  26.280  -4.386   5.559
  154    HD2  TYR  21           HD2      TYR  21  29.223  -3.287   8.426
  155    HE1  TYR  21           HE1      TYR  21  24.554  -3.241   6.882
  156    HE2  TYR  21           HE2      TYR  21  27.520  -2.137   9.753
  157    HH   TYR  21           HH       TYR  21  24.083  -2.234   8.806
  158    H    ALA  22           HN       ALA  22  31.598  -4.587   5.691
  159    HA   ALA  22           HA       ALA  22  32.453  -2.065   6.681
  160   1HB   ALA  22          HB1       ALA  22  33.249  -4.032   7.738
  161   2HB   ALA  22          HB2       ALA  22  34.637  -3.223   7.005
  162   3HB   ALA  22          HB3       ALA  22  33.931  -4.641   6.229
  163    H    SER  23           HN       SER  23  32.866  -3.736   3.633
  164    HA   SER  23           HA       SER  23  34.889  -2.063   2.580
  165   1HB   SER  23          HB2       SER  23  32.705  -3.570   1.118
  166   2HB   SER  23          HB1       SER  23  34.170  -2.912   0.388
  167    HG   SER  23           HG       SER  23  33.922  -5.041   2.244
  168    H    LEU  24           HN       LEU  24  31.378  -1.811   2.687
  169    HA   LEU  24           HA       LEU  24  31.186   0.516   1.071
  170   1HB   LEU  24          HB2       LEU  24  29.205  -0.722   1.189
  171   2HB   LEU  24          HB1       LEU  24  29.341  -0.961   2.919
  172    HG   LEU  24           HG       LEU  24  29.028   1.848   2.309
  173   1HD1  LEU  24          HD11      LEU  24  27.782   1.481   0.423
  174   2HD1  LEU  24          HD12      LEU  24  26.531   1.416   1.666
  175   3HD1  LEU  24          HD13      LEU  24  27.180  -0.079   0.988
  176   1HD2  LEU  24          HD21      LEU  24  27.887   1.761   4.225
  177   2HD2  LEU  24          HD22      LEU  24  28.409   0.081   4.326
  178   3HD2  LEU  24          HD23      LEU  24  26.832   0.473   3.640
  179    H    ARG  25           HN       ARG  25  31.525  -0.166   4.503
  180    HA   ARG  25           HA       ARG  25  31.185   2.435   5.484
  181   1HB   ARG  25          HB2       ARG  25  32.257  -0.077   6.452
  182   2HB   ARG  25          HB1       ARG  25  33.209   1.281   7.030
  183   1HG   ARG  25          HG2       ARG  25  31.706   1.490   8.648
  184   2HG   ARG  25          HG1       ARG  25  30.599   2.095   7.416
  185   1HD   ARG  25          HD2       ARG  25  29.296   0.312   7.639
  186   2HD   ARG  25          HD1       ARG  25  30.658  -0.763   7.321
  187    HE   ARG  25           HE       ARG  25  31.048  -0.927   9.647
  188   1HH1  ARG  25          HH11      ARG  25  28.200   0.967   8.853
  189   2HH1  ARG  25          HH12      ARG  25  27.526   0.862  10.459
  190   1HH2  ARG  25          HH21      ARG  25  30.135  -1.115  11.732
  191   2HH2  ARG  25          HH22      ARG  25  28.616  -0.345  12.088
  192    H    HIS  26           HN       HIS  26  34.077   0.763   4.300
  193    HA   HIS  26           HA       HIS  26  35.807   2.996   4.674
  194   1HB   HIS  26          HB2       HIS  26  36.327   0.420   4.339
  195   2HB   HIS  26          HB1       HIS  26  36.415   0.891   2.645
  196    HD1  HIS  26           HD1      HIS  26  38.068   1.590   5.966
  197    HD2  HIS  26           HD2      HIS  26  38.718   2.181   1.898
  198    HE1  HIS  26           HE1      HIS  26  40.433   2.447   5.770
  199    HE2  HIS  26           HE2      HIS  26  40.849   2.668   3.288
  200    H    TYR  27           HN       TYR  27  34.169   1.616   1.830
  201    HA   TYR  27           HA       TYR  27  35.185   3.420  -0.056
  202   1HB   TYR  27          HB2       TYR  27  34.007   1.321  -0.645
  203   2HB   TYR  27          HB1       TYR  27  32.495   2.034  -0.097
  204    HD1  TYR  27           HD1      TYR  27  35.248   3.442  -2.202
  205    HD2  TYR  27           HD2      TYR  27  31.153   2.307  -1.968
  206    HE1  TYR  27           HE1      TYR  27  34.868   4.375  -4.443
  207    HE2  TYR  27           HE2      TYR  27  30.758   3.228  -4.204
  208    HH   TYR  27           HH       TYR  27  31.762   3.982  -6.087
  209    H    LEU  28           HN       LEU  28  32.173   3.527   1.836
  210    HA   LEU  28           HA       LEU  28  31.294   6.013   0.817
  211   1HB   LEU  28          HB2       LEU  28  30.560   4.224   2.991
  212   2HB   LEU  28          HB1       LEU  28  30.352   5.909   3.426
  213    HG   LEU  28           HG       LEU  28  28.305   4.817   2.494
  214   1HD1  LEU  28          HD11      LEU  28  29.510   7.330   1.673
  215   2HD1  LEU  28          HD12      LEU  28  27.863   6.982   2.201
  216   3HD1  LEU  28          HD13      LEU  28  28.320   6.735   0.516
  217   1HD2  LEU  28          HD21      LEU  28  28.449   3.591   0.653
  218   2HD2  LEU  28          HD22      LEU  28  30.139   4.053   0.440
  219   3HD2  LEU  28          HD23      LEU  28  28.857   5.042  -0.259
  220    H    ASN  29           HN       ASN  29  33.361   5.192   3.569
  221    HA   ASN  29           HA       ASN  29  33.597   7.764   4.656
  222   1HB   ASN  29          HB2       ASN  29  34.625   6.454   6.158
  223   2HB   ASN  29          HB1       ASN  29  34.900   5.191   4.964
  224   1HD2  ASN  29          HD21      ASN  29  36.234   7.922   6.618
  225   2HD2  ASN  29          HD22      ASN  29  37.865   7.711   6.075
  226    H    LEU  30           HN       LEU  30  35.186   6.242   1.946
  227    HA   LEU  30           HA       LEU  30  37.297   8.086   1.614
  228   1HB   LEU  30          HB2       LEU  30  35.907   6.278  -0.358
  229   2HB   LEU  30          HB1       LEU  30  37.344   7.208  -0.740
  230    HG   LEU  30           HG       LEU  30  37.218   5.135   1.450
  231   1HD1  LEU  30          HD11      LEU  30  37.082   3.683  -0.260
  232   2HD1  LEU  30          HD12      LEU  30  38.800   4.041  -0.450
  233   3HD1  LEU  30          HD13      LEU  30  37.607   4.872  -1.453
  234   1HD2  LEU  30          HD21      LEU  30  39.099   7.147   0.836
  235   2HD2  LEU  30          HD22      LEU  30  39.815   5.610   0.358
  236   3HD2  LEU  30          HD23      LEU  30  39.245   5.840   2.012
  237    H    VAL  31           HN       VAL  31  33.927   8.172   0.650
  238    HA   VAL  31           HA       VAL  31  34.439  10.471  -1.070
  239    HB   VAL  31           HB       VAL  31  32.155  10.353  -1.794
  240   1HG1  VAL  31          HG11      VAL  31  33.961   8.112  -1.947
  241   2HG1  VAL  31          HG12      VAL  31  32.932   8.815  -3.194
  242   3HG1  VAL  31          HG13      VAL  31  32.285   7.589  -2.104
  243   1HG2  VAL  31          HG21      VAL  31  31.211   7.980  -0.541
  244   2HG2  VAL  31          HG22      VAL  31  30.512   9.600  -0.517
  245   3HG2  VAL  31          HG23      VAL  31  31.691   9.129   0.708
  246    H    THR  32           HN       THR  32  33.264   9.756   2.114
  247    HA   THR  32           HA       THR  32  31.920  12.203   2.622
  248    HB   THR  32           HB       THR  32  33.386  10.703   4.773
  249    HG1  THR  32           HG1      THR  32  31.286   9.804   3.146
  250   1HG2  THR  32          HG21      THR  32  30.803  12.236   4.589
  251   2HG2  THR  32          HG22      THR  32  32.211  12.584   5.593
  252   3HG2  THR  32          HG23      THR  32  31.189  11.193   5.957
  253    H    ARG  33           HN       ARG  33  35.153  11.502   2.087
  254    HA   ARG  33           HA       ARG  33  36.616  13.290   3.589
  255   1HB   ARG  33          HB2       ARG  33  37.224  11.645   1.596
  256   2HB   ARG  33          HB1       ARG  33  37.115  13.120   0.646
  257   1HG   ARG  33          HG2       ARG  33  38.776  14.150   2.192
  258   2HG   ARG  33          HG1       ARG  33  38.961  12.568   2.955
  259   1HD   ARG  33          HD2       ARG  33  39.166  12.163   0.176
  260   2HD   ARG  33          HD1       ARG  33  40.163  13.565   0.555
  261    HE   ARG  33           HE       ARG  33  40.537  11.280   2.294
  262   1HH1  ARG  33          HH11      ARG  33  41.576  12.912  -0.624
  263   2HH1  ARG  33          HH12      ARG  33  43.176  12.224  -0.593
  264   1HH2  ARG  33          HH21      ARG  33  42.610  10.357   2.335
  265   2HH2  ARG  33          HH22      ARG  33  43.771  10.764   1.094
  266    H    GLN  34           HN       GLN  34  34.966  13.865   0.523
  267    HA   GLN  34           HA       GLN  34  33.796  16.266   0.920
  268   1HB   GLN  34          HB2       GLN  34  35.359  17.922  -0.137
  269   2HB   GLN  34          HB1       GLN  34  35.861  17.378   1.455
  270   1HG   GLN  34          HG2       GLN  34  37.852  17.258   0.390
  271   2HG   GLN  34          HG1       GLN  34  37.253  15.644   0.016
  272   1HE2  GLN  34          HE21      GLN  34  36.467  18.816  -1.361
  273   2HE2  GLN  34          HE22      GLN  34  36.909  18.407  -2.982
  274    H    ARG  35           HN       ARG  35  35.419  14.049  -1.088
  275    HA   ARG  35           HA       ARG  35  34.661  15.213  -3.602
  276   1HB   ARG  35          HB2       ARG  35  35.686  13.165  -4.563
  277   2HB   ARG  35          HB1       ARG  35  36.757  14.031  -3.472
  278   1HG   ARG  35          HG2       ARG  35  36.086  12.393  -1.683
  279   2HG   ARG  35          HG1       ARG  35  35.281  11.462  -2.948
  280   1HD   ARG  35          HD2       ARG  35  37.689  11.827  -4.096
  281   2HD   ARG  35          HD1       ARG  35  38.160  11.831  -2.398
  282    HE   ARG  35           HE       ARG  35  37.664   9.592  -2.270
  283   1HH1  ARG  35          HH11      ARG  35  36.476  10.871  -5.313
  284   2HH1  ARG  35          HH12      ARG  35  36.149   9.305  -5.983
  285   1HH2  ARG  35          HH21      ARG  35  37.237   7.543  -3.160
  286   2HH2  ARG  35          HH22      ARG  35  36.573   7.417  -4.766
  287    H    TYR  36           HN       TYR  36  32.371  15.002  -2.320
  288    HA   TYR  36           HA       TYR  36  30.960  12.889  -3.790
  289   1HB   TYR  36          HB2       TYR  36  31.350  12.459  -1.206
  290   2HB   TYR  36          HB1       TYR  36  30.000  13.576  -1.042
  291    HD1  TYR  36           HD1      TYR  36  28.333  12.128  -0.220
  292    HD2  TYR  36           HD2      TYR  36  30.468  11.058  -3.739
  293    HE1  TYR  36           HE1      TYR  36  26.764  10.273  -0.600
  294    HE2  TYR  36           HE2      TYR  36  28.902   9.202  -4.131
  295    HH   TYR  36           HH       TYR  36  26.297   8.787  -3.360
  296   1HN   NH2  37          H1        NH2  37  29.379  16.547  -2.847
  297   2HN   NH2  37          H2        NH2  37  30.689  15.907  -1.922
  Start of MODEL   18
    1   1H    TYR   1          HT1       TYR   1  36.860  -0.520  -9.456
    2   2H    TYR   1          HT2       TYR   1  37.764  -0.826  -8.056
    3   3H    TYR   1          HT3       TYR   1  38.488  -0.049  -9.375
    4    HA   TYR   1           HA       TYR   1  37.917   1.461  -7.523
    5   1HB   TYR   1          HB2       TYR   1  37.590   1.808 -10.281
    6   2HB   TYR   1          HB1       TYR   1  36.131   2.494  -9.576
    7    HD1  TYR   1           HD1      TYR   1  37.031   4.622 -10.635
    8    HD2  TYR   1           HD2      TYR   1  38.983   2.663  -7.402
    9    HE1  TYR   1           HE1      TYR   1  38.255   6.692 -10.129
   10    HE2  TYR   1           HE2      TYR   1  40.208   4.732  -6.880
   11    HH   TYR   1           HH       TYR   1  40.724   6.802  -7.572
   12    HA   PRO   2           HA       PRO   2  34.009   0.587  -5.551
   13   1HB   PRO   2          HB2       PRO   2  34.004   2.806  -3.941
   14   2HB   PRO   2          HB1       PRO   2  34.870   1.311  -3.569
   15   1HG   PRO   2          HG2       PRO   2  35.897   3.859  -4.743
   16   2HG   PRO   2          HG1       PRO   2  36.651   2.792  -3.545
   17   1HD   PRO   2          HD2       PRO   2  37.395   2.791  -6.135
   18   2HD   PRO   2          HD1       PRO   2  37.406   1.315  -5.152
   19    H    ILE   3           HN       ILE   3  33.925   3.978  -5.201
   20    HA   ILE   3           HA       ILE   3  32.555   5.622  -5.806
   21    HB   ILE   3           HB       ILE   3  32.339   6.155  -7.965
   22   1HG1  ILE   3          HG12      ILE   3  32.039   3.379  -9.050
   23   2HG1  ILE   3          HG11      ILE   3  30.660   4.170  -8.292
   24   1HG2  ILE   3          HG21      ILE   3  34.078   5.047  -9.376
   25   2HG2  ILE   3          HG22      ILE   3  34.304   3.895  -8.058
   26   3HG2  ILE   3          HG23      ILE   3  34.628   5.609  -7.796
   27   1HD1  ILE   3          HD11      ILE   3  30.446   4.601 -10.576
   28   2HD1  ILE   3          HD12      ILE   3  32.155   4.989 -10.753
   29   3HD1  ILE   3          HD13      ILE   3  31.083   6.094  -9.892
   30    H    LYS   4           HN       LYS   4  31.244   2.443  -6.519
   31    HA   LYS   4           HA       LYS   4  29.028   2.935  -4.808
   32   1HB   LYS   4          HB2       LYS   4  28.348   3.997  -7.058
   33   2HB   LYS   4          HB1       LYS   4  28.259   2.347  -7.662
   34   1HG   LYS   4          HG2       LYS   4  26.225   2.138  -6.835
   35   2HG   LYS   4          HG1       LYS   4  26.836   2.466  -5.211
   36   1HD   LYS   4          HD2       LYS   4  25.747   4.400  -5.215
   37   2HD   LYS   4          HD1       LYS   4  26.732   4.933  -6.581
   38   1HE   LYS   4          HE2       LYS   4  24.672   5.115  -7.533
   39   2HE   LYS   4          HE1       LYS   4  25.011   3.428  -7.922
   40   1HZ   LYS   4          HZ1       LYS   4  23.814   2.893  -5.776
   41   2HZ   LYS   4          HZ2       LYS   4  22.853   3.464  -7.047
   42   3HZ   LYS   4          HZ3       LYS   4  23.277   4.502  -5.772
   43    HA   PRO   5           HA       PRO   5  30.421  -1.382  -4.791
   44   1HB   PRO   5          HB2       PRO   5  28.800  -1.430  -2.324
   45   2HB   PRO   5          HB1       PRO   5  30.499  -1.853  -2.556
   46   1HG   PRO   5          HG2       PRO   5  29.765   0.385  -1.275
   47   2HG   PRO   5          HG1       PRO   5  31.217   0.321  -2.292
   48   1HD   PRO   5          HD2       PRO   5  28.530   1.493  -2.893
   49   2HD   PRO   5          HD1       PRO   5  30.146   2.096  -3.316
   50    H    GLU   6           HN       GLU   6  29.399  -3.172  -5.506
   51    HA   GLU   6           HA       GLU   6  26.700  -3.085  -6.330
   52   1HB   GLU   6          HB2       GLU   6  27.058  -5.614  -6.643
   53   2HB   GLU   6          HB1       GLU   6  28.065  -4.525  -7.583
   54   1HG   GLU   6          HG2       GLU   6  29.161  -5.396  -4.985
   55   2HG   GLU   6          HG1       GLU   6  29.007  -6.635  -6.229
   56    H    ALA   7           HN       ALA   7  25.237  -2.756  -4.760
   57    HA   ALA   7           HA       ALA   7  25.458  -4.126  -2.221
   58   1HB   ALA   7          HB1       ALA   7  23.365  -2.776  -1.712
   59   2HB   ALA   7          HB2       ALA   7  23.610  -2.006  -3.279
   60   3HB   ALA   7          HB3       ALA   7  24.842  -1.863  -2.023
   61    HA   PRO   8           HA       PRO   8  22.586  -7.309  -3.608
   62   1HB   PRO   8          HB2       PRO   8  22.875  -8.867  -1.412
   63   2HB   PRO   8          HB1       PRO   8  24.065  -8.848  -2.717
   64   1HG   PRO   8          HG2       PRO   8  24.136  -7.468  -0.068
   65   2HG   PRO   8          HG1       PRO   8  25.436  -8.307  -0.933
   66   1HD   PRO   8          HD2       PRO   8  25.159  -5.594  -0.919
   67   2HD   PRO   8          HD1       PRO   8  25.899  -6.494  -2.258
   68    H    GLY   9           HN       GLY   9  22.706  -5.415  -0.716
   69   1HA   GLY   9          HA2       GLY   9  20.315  -4.432  -0.390
   70   2HA   GLY   9          HA1       GLY   9  19.974  -6.109   0.043
   71    H    GLU  10           HN       GLU  10  19.411  -4.867   2.118
   72    HA   GLU  10           HA       GLU  10  21.863  -4.713   3.745
   73   1HB   GLU  10          HB2       GLU  10  19.997  -3.532   5.338
   74   2HB   GLU  10          HB1       GLU  10  21.075  -2.662   4.257
   75   1HG   GLU  10          HG2       GLU  10  19.191  -1.737   3.498
   76   2HG   GLU  10          HG1       GLU  10  19.032  -3.231   2.579
   77    H    ASP  11           HN       ASP  11  19.280  -6.583   3.012
   78    HA   ASP  11           HA       ASP  11  19.313  -7.947   5.615
   79   1HB   ASP  11          HB2       ASP  11  17.071  -7.356   4.776
   80   2HB   ASP  11          HB1       ASP  11  17.382  -8.254   3.296
   81    H    ALA  12           HN       ALA  12  21.433  -8.768   5.130
   82    HA   ALA  12           HA       ALA  12  21.350 -11.041   3.265
   83   1HB   ALA  12          HB1       ALA  12  22.638  -8.930   2.476
   84   2HB   ALA  12          HB2       ALA  12  23.389 -10.516   2.295
   85   3HB   ALA  12          HB3       ALA  12  23.866  -9.461   3.628
   86    H    SER  13           HN       SER  13  22.993 -12.688   3.724
   87    HA   SER  13           HA       SER  13  23.082 -13.372   6.469
   88   1HB   SER  13          HB2       SER  13  24.986 -14.797   4.786
   89   2HB   SER  13          HB1       SER  13  23.562 -15.404   5.636
   90    HG   SER  13           HG       SER  13  23.862 -14.926   3.023
   91    HA   PRO  14           HA       PRO  14  26.606 -11.772   8.482
   92   1HB   PRO  14          HB2       PRO  14  27.878 -14.463   8.114
   93   2HB   PRO  14          HB1       PRO  14  27.849 -13.424   9.546
   94   1HG   PRO  14          HG2       PRO  14  26.172 -15.487   9.301
   95   2HG   PRO  14          HG1       PRO  14  25.666 -13.969  10.063
   96   1HD   PRO  14          HD2       PRO  14  24.884 -15.113   7.461
   97   2HD   PRO  14          HD1       PRO  14  24.057 -13.903   8.459
   98    H    GLU  15           HN       GLU  15  27.942 -14.052   6.045
   99    HA   GLU  15           HA       GLU  15  30.317 -12.537   5.737
  100   1HB   GLU  15          HB2       GLU  15  29.283 -15.016   4.778
  101   2HB   GLU  15          HB1       GLU  15  29.874 -14.098   3.400
  102   1HG   GLU  15          HG2       GLU  15  31.640 -14.189   5.762
  103   2HG   GLU  15          HG1       GLU  15  31.414 -15.703   4.891
  104    H    GLU  16           HN       GLU  16  27.436 -12.828   3.710
  105    HA   GLU  16           HA       GLU  16  28.330 -11.187   1.619
  106   1HB   GLU  16          HB2       GLU  16  25.500 -11.819   2.471
  107   2HB   GLU  16          HB1       GLU  16  25.969 -11.131   0.922
  108   1HG   GLU  16          HG2       GLU  16  25.878 -13.264   0.247
  109   2HG   GLU  16          HG1       GLU  16  27.500 -13.338   0.932
  110    H    LEU  17           HN       LEU  17  26.338 -10.494   4.485
  111    HA   LEU  17           HA       LEU  17  25.947  -7.765   3.837
  112   1HB   LEU  17          HB2       LEU  17  24.775  -7.622   5.755
  113   2HB   LEU  17          HB1       LEU  17  24.898  -9.371   5.741
  114    HG   LEU  17           HG       LEU  17  27.175  -8.649   7.096
  115   1HD1  LEU  17          HD11      LEU  17  25.060  -6.928   8.308
  116   2HD1  LEU  17          HD12      LEU  17  26.078  -6.279   7.022
  117   3HD1  LEU  17          HD13      LEU  17  26.811  -6.870   8.515
  118   1HD2  LEU  17          HD21      LEU  17  24.584  -9.035   8.538
  119   2HD2  LEU  17          HD22      LEU  17  26.181  -9.679   8.917
  120   3HD2  LEU  17          HD23      LEU  17  25.264 -10.334   7.561
  121    H    ASN  18           HN       ASN  18  28.397  -9.507   5.688
  122    HA   ASN  18           HA       ASN  18  29.894  -7.297   6.548
  123   1HB   ASN  18          HB2       ASN  18  30.497  -9.300   7.567
  124   2HB   ASN  18          HB1       ASN  18  30.509 -10.191   6.052
  125   1HD2  ASN  18          HD21      ASN  18  32.408 -10.611   5.165
  126   2HD2  ASN  18          HD22      ASN  18  33.906  -9.846   5.583
  127    H    ARG  19           HN       ARG  19  29.994  -9.175   3.534
  128    HA   ARG  19           HA       ARG  19  32.222  -7.986   2.327
  129   1HB   ARG  19          HB2       ARG  19  29.639  -8.797   0.975
  130   2HB   ARG  19          HB1       ARG  19  31.175  -8.525   0.166
  131   1HG   ARG  19          HG2       ARG  19  30.793 -10.621   2.281
  132   2HG   ARG  19          HG1       ARG  19  30.523 -10.923   0.566
  133   1HD   ARG  19          HD2       ARG  19  32.852 -10.262   0.106
  134   2HD   ARG  19          HD1       ARG  19  33.110 -10.028   1.838
  135    HE   ARG  19           HE       ARG  19  32.802 -12.392   2.160
  136   1HH1  ARG  19          HH11      ARG  19  33.248 -11.343  -1.163
  137   2HH1  ARG  19          HH12      ARG  19  33.593 -12.938  -1.755
  138   1HH2  ARG  19          HH21      ARG  19  33.218 -14.493   1.373
  139   2HH2  ARG  19          HH22      ARG  19  33.569 -14.726  -0.321
  140    H    TYR  20           HN       TYR  20  28.835  -7.129   1.743
  141    HA   TYR  20           HA       TYR  20  29.372  -4.789   0.302
  142   1HB   TYR  20          HB2       TYR  20  27.235  -5.454  -0.109
  143   2HB   TYR  20          HB1       TYR  20  27.025  -6.115   1.506
  144    HD1  TYR  20           HD1      TYR  20  26.023  -4.823   3.250
  145    HD2  TYR  20           HD2      TYR  20  26.826  -3.069  -0.538
  146    HE1  TYR  20           HE1      TYR  20  24.612  -2.894   3.860
  147    HE2  TYR  20           HE2      TYR  20  25.424  -1.136   0.047
  148    HH   TYR  20           HH       TYR  20  23.224  -1.102   2.376
  149    H    TYR  21           HN       TYR  21  28.804  -5.356   3.723
  150    HA   TYR  21           HA       TYR  21  28.406  -2.719   4.554
  151   1HB   TYR  21          HB2       TYR  21  28.247  -5.075   5.790
  152   2HB   TYR  21          HB1       TYR  21  29.836  -4.587   6.369
  153    HD1  TYR  21           HD1      TYR  21  26.270  -3.667   6.280
  154    HD2  TYR  21           HD2      TYR  21  30.076  -2.919   8.008
  155    HE1  TYR  21           HE1      TYR  21  25.205  -2.277   7.990
  156    HE2  TYR  21           HE2      TYR  21  29.042  -1.525   9.726
  157    HH   TYR  21           HH       TYR  21  26.301  -1.553  10.728
  158    H    ALA  22           HN       ALA  22  31.393  -4.661   4.714
  159    HA   ALA  22           HA       ALA  22  32.874  -2.464   5.760
  160   1HB   ALA  22          HB1       ALA  22  34.834  -3.986   5.418
  161   2HB   ALA  22          HB2       ALA  22  33.706  -5.164   4.743
  162   3HB   ALA  22          HB3       ALA  22  33.526  -4.631   6.418
  163    H    SER  23           HN       SER  23  32.344  -3.735   2.527
  164    HA   SER  23           HA       SER  23  34.329  -2.149   1.255
  165   1HB   SER  23          HB2       SER  23  31.713  -3.097   0.064
  166   2HB   SER  23          HB1       SER  23  33.190  -2.675  -0.806
  167    HG   SER  23           HG       SER  23  32.561  -4.963   0.665
  168    H    LEU  24           HN       LEU  24  30.989  -1.600   2.179
  169    HA   LEU  24           HA       LEU  24  30.807   1.004   1.017
  170   1HB   LEU  24          HB2       LEU  24  28.870  -0.568   1.495
  171   2HB   LEU  24          HB1       LEU  24  29.071  -0.175   3.190
  172    HG   LEU  24           HG       LEU  24  28.883   2.311   2.030
  173   1HD1  LEU  24          HD11      LEU  24  27.331   0.327   0.433
  174   2HD1  LEU  24          HD12      LEU  24  28.194   1.773  -0.095
  175   3HD1  LEU  24          HD13      LEU  24  26.644   1.924   0.734
  176   1HD2  LEU  24          HD21      LEU  24  27.302   0.563   3.708
  177   2HD2  LEU  24          HD22      LEU  24  26.293   1.650   2.756
  178   3HD2  LEU  24          HD23      LEU  24  27.547   2.306   3.809
  179    H    ARG  25           HN       ARG  25  31.995  -0.366   3.934
  180    HA   ARG  25           HA       ARG  25  31.977   2.019   5.490
  181   1HB   ARG  25          HB2       ARG  25  32.755  -0.690   5.857
  182   2HB   ARG  25          HB1       ARG  25  34.145   0.317   6.242
  183   1HG   ARG  25          HG2       ARG  25  32.956  -0.012   8.257
  184   2HG   ARG  25          HG1       ARG  25  32.633   1.645   7.744
  185   1HD   ARG  25          HD2       ARG  25  30.548   0.591   6.591
  186   2HD   ARG  25          HD1       ARG  25  30.826  -0.736   7.720
  187    HE   ARG  25           HE       ARG  25  30.758   1.132   9.474
  188   1HH1  ARG  25          HH11      ARG  25  28.855   1.089   6.526
  189   2HH1  ARG  25          HH12      ARG  25  27.586   2.074   7.184
  190   1HH2  ARG  25          HH21      ARG  25  29.087   2.444  10.329
  191   2HH2  ARG  25          HH22      ARG  25  27.704   2.825   9.334
  192    H    HIS  26           HN       HIS  26  34.406   0.375   3.492
  193    HA   HIS  26           HA       HIS  26  36.427   2.330   3.748
  194   1HB   HIS  26          HB2       HIS  26  36.134  -0.121   2.422
  195   2HB   HIS  26          HB1       HIS  26  36.401   1.047   1.134
  196    HD1  HIS  26           HD1      HIS  26  38.764   0.581   0.509
  197    HD2  HIS  26           HD2      HIS  26  38.259   1.031   4.616
  198    HE1  HIS  26           HE1      HIS  26  41.085   0.569   1.489
  199    HE2  HIS  26           HE2      HIS  26  40.745   0.686   3.982
  200    H    TYR  27           HN       TYR  27  33.898   1.800   1.334
  201    HA   TYR  27           HA       TYR  27  34.408   4.004  -0.290
  202   1HB   TYR  27          HB2       TYR  27  32.907   2.299  -1.053
  203   2HB   TYR  27          HB1       TYR  27  31.838   2.541   0.324
  204    HD1  TYR  27           HD1      TYR  27  33.340   4.702  -2.345
  205    HD2  TYR  27           HD2      TYR  27  29.845   3.551  -0.206
  206    HE1  TYR  27           HE1      TYR  27  32.011   6.293  -3.667
  207    HE2  TYR  27           HE2      TYR  27  28.509   5.138  -1.524
  208    HH   TYR  27           HH       TYR  27  29.355   6.371  -4.318
  209    H    LEU  28           HN       LEU  28  32.188   3.695   2.482
  210    HA   LEU  28           HA       LEU  28  31.273   6.358   2.400
  211   1HB   LEU  28          HB2       LEU  28  31.030   4.104   4.187
  212   2HB   LEU  28          HB1       LEU  28  31.223   5.592   5.092
  213    HG   LEU  28           HG       LEU  28  28.847   4.884   4.637
  214   1HD1  LEU  28          HD11      LEU  28  29.779   7.276   5.076
  215   2HD1  LEU  28          HD12      LEU  28  28.107   7.064   4.556
  216   3HD1  LEU  28          HD13      LEU  28  29.336   7.550   3.391
  217   1HD2  LEU  28          HD21      LEU  28  28.886   4.077   2.435
  218   2HD2  LEU  28          HD22      LEU  28  29.724   5.512   1.835
  219   3HD2  LEU  28          HD23      LEU  28  28.034   5.622   2.332
  220    H    ASN  29           HN       ASN  29  34.092   4.933   3.982
  221    HA   ASN  29           HA       ASN  29  34.746   7.216   5.529
  222   1HB   ASN  29          HB2       ASN  29  35.688   4.698   5.504
  223   2HB   ASN  29          HB1       ASN  29  36.965   5.490   4.584
  224   1HD2  ASN  29          HD21      ASN  29  36.653   8.034   5.972
  225   2HD2  ASN  29          HD22      ASN  29  37.321   7.808   7.556
  226    H    LEU  30           HN       LEU  30  35.414   6.301   2.223
  227    HA   LEU  30           HA       LEU  30  37.201   8.561   1.846
  228   1HB   LEU  30          HB2       LEU  30  36.532   6.151   0.399
  229   2HB   LEU  30          HB1       LEU  30  36.476   7.546  -0.660
  230    HG   LEU  30           HG       LEU  30  38.843   6.778   1.046
  231   1HD1  LEU  30          HD11      LEU  30  38.166   5.267  -0.934
  232   2HD1  LEU  30          HD12      LEU  30  39.839   5.813  -0.803
  233   3HD1  LEU  30          HD13      LEU  30  38.740   6.600  -1.937
  234   1HD2  LEU  30          HD21      LEU  30  38.356   8.984  -0.930
  235   2HD2  LEU  30          HD22      LEU  30  39.981   8.409  -0.561
  236   3HD2  LEU  30          HD23      LEU  30  38.975   9.090   0.718
  237    H    VAL  31           HN       VAL  31  33.844   7.848   1.520
  238    HA   VAL  31           HA       VAL  31  33.370   9.998  -0.364
  239    HB   VAL  31           HB       VAL  31  32.152   7.621  -0.095
  240   1HG1  VAL  31          HG11      VAL  31  29.932   9.249   0.938
  241   2HG1  VAL  31          HG12      VAL  31  31.155   8.776   2.117
  242   3HG1  VAL  31          HG13      VAL  31  30.305   7.545   1.182
  243   1HG2  VAL  31          HG21      VAL  31  31.799   8.784  -2.051
  244   2HG2  VAL  31          HG22      VAL  31  31.198  10.216  -1.215
  245   3HG2  VAL  31          HG23      VAL  31  30.189   8.774  -1.335
  246    H    THR  32           HN       THR  32  33.535   9.668   3.006
  247    HA   THR  32           HA       THR  32  31.515  11.504   3.789
  248    HB   THR  32           HB       THR  32  33.425  11.641   5.783
  249    HG1  THR  32           HG1      THR  32  33.399   8.966   4.800
  250   1HG2  THR  32          HG21      THR  32  31.871  10.514   7.037
  251   2HG2  THR  32          HG22      THR  32  31.526   9.350   5.760
  252   3HG2  THR  32          HG23      THR  32  30.868  10.981   5.661
  253    H    ARG  33           HN       ARG  33  34.323  11.977   2.114
  254    HA   ARG  33           HA       ARG  33  35.516  14.281   2.999
  255   1HB   ARG  33          HB2       ARG  33  36.183  12.980   0.988
  256   2HB   ARG  33          HB1       ARG  33  34.788  13.625   0.131
  257   1HG   ARG  33          HG2       ARG  33  36.279  15.795   1.210
  258   2HG   ARG  33          HG1       ARG  33  37.381  14.718   0.350
  259   1HD   ARG  33          HD2       ARG  33  34.925  15.097  -1.119
  260   2HD   ARG  33          HD1       ARG  33  35.693  16.643  -0.758
  261    HE   ARG  33           HE       ARG  33  36.602  14.642  -2.600
  262   1HH1  ARG  33          HH11      ARG  33  37.657  17.220  -0.480
  263   2HH1  ARG  33          HH12      ARG  33  39.114  17.535  -1.365
  264   1HH2  ARG  33          HH21      ARG  33  38.489  15.105  -3.822
  265   2HH2  ARG  33          HH22      ARG  33  39.576  16.354  -3.278
  266    H    GLN  34           HN       GLN  34  32.651  14.014   0.944
  267    HA   GLN  34           HA       GLN  34  31.383  16.270   2.116
  268   1HB   GLN  34          HB2       GLN  34  33.196  17.120   0.363
  269   2HB   GLN  34          HB1       GLN  34  31.914  16.744  -0.778
  270   1HG   GLN  34          HG2       GLN  34  31.630  19.008  -0.271
  271   2HG   GLN  34          HG1       GLN  34  30.403  18.171   0.682
  272   1HE2  GLN  34          HE21      GLN  34  30.332  18.536   2.801
  273   2HE2  GLN  34          HE22      GLN  34  31.545  19.370   3.718
  274    H    ARG  35           HN       ARG  35  31.599  13.738  -0.199
  275    HA   ARG  35           HA       ARG  35  28.962  14.086  -1.291
  276   1HB   ARG  35          HB2       ARG  35  31.048  13.099  -2.443
  277   2HB   ARG  35          HB1       ARG  35  30.683  11.630  -1.553
  278   1HG   ARG  35          HG2       ARG  35  29.843  11.769  -3.937
  279   2HG   ARG  35          HG1       ARG  35  28.668  11.295  -2.712
  280   1HD   ARG  35          HD2       ARG  35  27.596  13.369  -2.770
  281   2HD   ARG  35          HD1       ARG  35  28.965  14.156  -3.555
  282    HE   ARG  35           HE       ARG  35  28.352  13.087  -5.604
  283   1HH1  ARG  35          HH11      ARG  35  26.020  12.696  -3.011
  284   2HH1  ARG  35          HH12      ARG  35  24.698  12.342  -4.084
  285   1HH2  ARG  35          HH21      ARG  35  26.624  12.629  -7.016
  286   2HH2  ARG  35          HH22      ARG  35  25.038  12.332  -6.369
  287    H    TYR  36           HN       TYR  36  28.724  13.955   1.422
  288    HA   TYR  36           HA       TYR  36  27.542  12.988   3.092
  289   1HB   TYR  36          HB2       TYR  36  25.971  12.819   0.985
  290   2HB   TYR  36          HB1       TYR  36  26.258  11.094   1.168
  291    HD1  TYR  36           HD1      TYR  36  23.915  10.654   1.619
  292    HD2  TYR  36           HD2      TYR  36  26.149  13.283   4.110
  293    HE1  TYR  36           HE1      TYR  36  22.145  10.534   3.323
  294    HE2  TYR  36           HE2      TYR  36  24.384  13.173   5.818
  295    HH   TYR  36           HH       TYR  36  22.023  10.845   5.867
  296   1HN   NH2  37          H1        NH2  37  28.218   9.058   2.619
  297   2HN   NH2  37          H2        NH2  37  26.998   9.904   1.736
  Start of MODEL   19
    1   1H    TYR   1          HT1       TYR   1  24.869   0.897  -9.216
    2   2H    TYR   1          HT2       TYR   1  24.838   0.326 -10.812
    3   3H    TYR   1          HT3       TYR   1  25.520   1.835 -10.473
    4    HA   TYR   1           HA       TYR   1  26.674  -0.317  -8.972
    5   1HB   TYR   1          HB2       TYR   1  28.105  -0.733 -11.224
    6   2HB   TYR   1          HB1       TYR   1  26.764  -1.757 -10.733
    7    HD1  TYR   1           HD1      TYR   1  27.454   1.314 -12.766
    8    HD2  TYR   1           HD2      TYR   1  25.068  -2.173 -12.252
    9    HE1  TYR   1           HE1      TYR   1  26.321   1.783 -14.898
   10    HE2  TYR   1           HE2      TYR   1  23.929  -1.709 -14.379
   11    HH   TYR   1           HH       TYR   1  23.933   1.157 -15.889
   12    HA   PRO   2           HA       PRO   2  29.451   3.226  -9.001
   13   1HB   PRO   2          HB2       PRO   2  30.468   2.364  -6.485
   14   2HB   PRO   2          HB1       PRO   2  29.312   3.663  -6.775
   15   1HG   PRO   2          HG2       PRO   2  28.766   1.266  -5.459
   16   2HG   PRO   2          HG1       PRO   2  27.561   2.383  -6.120
   17   1HD   PRO   2          HD2       PRO   2  28.627  -0.157  -7.269
   18   2HD   PRO   2          HD1       PRO   2  26.994   0.535  -7.374
   19    H    ILE   3           HN       ILE   3  31.894   2.771  -7.552
   20    HA   ILE   3           HA       ILE   3  33.223   0.969  -9.430
   21    HB   ILE   3           HB       ILE   3  34.127   3.265  -9.051
   22   1HG1  ILE   3          HG12      ILE   3  36.525   2.493  -8.602
   23   2HG1  ILE   3          HG11      ILE   3  35.846   0.879  -8.390
   24   1HG2  ILE   3          HG21      ILE   3  34.296   4.072  -7.004
   25   2HG2  ILE   3          HG22      ILE   3  35.580   2.907  -6.676
   26   3HG2  ILE   3          HG23      ILE   3  33.903   2.497  -6.311
   27   1HD1  ILE   3          HD11      ILE   3  36.709   1.159 -10.633
   28   2HD1  ILE   3          HD12      ILE   3  35.679   2.572 -10.878
   29   3HD1  ILE   3          HD13      ILE   3  34.954   0.976 -10.673
   30    H    LYS   4           HN       LYS   4  31.575   0.415  -6.852
   31    HA   LYS   4           HA       LYS   4  33.147  -1.805  -5.943
   32   1HB   LYS   4          HB2       LYS   4  33.274   0.681  -4.579
   33   2HB   LYS   4          HB1       LYS   4  32.362  -0.430  -3.561
   34   1HG   LYS   4          HG2       LYS   4  34.321  -1.182  -2.827
   35   2HG   LYS   4          HG1       LYS   4  34.551  -1.911  -4.418
   36   1HD   LYS   4          HD2       LYS   4  35.267   0.728  -4.809
   37   2HD   LYS   4          HD1       LYS   4  35.883   0.375  -3.193
   38   1HE   LYS   4          HE2       LYS   4  36.798  -1.790  -4.307
   39   2HE   LYS   4          HE1       LYS   4  36.575  -0.899  -5.811
   40   1HZ   LYS   4          HZ1       LYS   4  38.366   0.328  -5.415
   41   2HZ   LYS   4          HZ2       LYS   4  38.756  -0.785  -4.191
   42   3HZ   LYS   4          HZ3       LYS   4  37.924   0.639  -3.807
   43    HA   PRO   5           HA       PRO   5  29.296  -3.786  -5.166
   44   1HB   PRO   5          HB2       PRO   5  28.931  -4.084  -2.435
   45   2HB   PRO   5          HB1       PRO   5  29.894  -5.163  -3.452
   46   1HG   PRO   5          HG2       PRO   5  30.779  -2.881  -1.730
   47   2HG   PRO   5          HG1       PRO   5  31.519  -4.481  -1.944
   48   1HD   PRO   5          HD2       PRO   5  32.542  -2.359  -3.182
   49   2HD   PRO   5          HD1       PRO   5  32.435  -3.922  -4.021
   50    H    GLU   6           HN       GLU   6  27.161  -3.314  -5.037
   51    HA   GLU   6           HA       GLU   6  26.399  -0.668  -4.161
   52   1HB   GLU   6          HB2       GLU   6  25.588  -2.228  -6.230
   53   2HB   GLU   6          HB1       GLU   6  24.314  -2.563  -5.064
   54   1HG   GLU   6          HG2       GLU   6  23.344  -0.615  -5.461
   55   2HG   GLU   6          HG1       GLU   6  24.852   0.257  -5.193
   56    H    ALA   7           HN       ALA   7  23.637  -2.218  -3.699
   57    HA   ALA   7           HA       ALA   7  24.186  -2.734  -0.849
   58   1HB   ALA   7          HB1       ALA   7  21.463  -1.947  -1.286
   59   2HB   ALA   7          HB2       ALA   7  22.561  -0.739  -1.953
   60   3HB   ALA   7          HB3       ALA   7  22.692  -1.206  -0.259
   61    HA   PRO   8           HA       PRO   8  22.144  -6.617  -2.199
   62   1HB   PRO   8          HB2       PRO   8  24.086  -7.897  -0.447
   63   2HB   PRO   8          HB1       PRO   8  23.849  -8.120  -2.182
   64   1HG   PRO   8          HG2       PRO   8  26.049  -6.927  -1.130
   65   2HG   PRO   8          HG1       PRO   8  25.402  -6.521  -2.730
   66   1HD   PRO   8          HD2       PRO   8  25.056  -5.078  -0.122
   67   2HD   PRO   8          HD1       PRO   8  25.382  -4.419  -1.743
   68    H    GLY   9           HN       GLY   9  20.444  -5.650  -0.841
   69   1HA   GLY   9          HA2       GLY   9  20.576  -6.528   1.973
   70   2HA   GLY   9          HA1       GLY   9  19.671  -5.124   1.424
   71    H    GLU  10           HN       GLU  10  19.173  -7.153  -0.984
   72    HA   GLU  10           HA       GLU  10  16.544  -7.845  -0.247
   73   1HB   GLU  10          HB2       GLU  10  16.458  -9.086  -2.330
   74   2HB   GLU  10          HB1       GLU  10  17.280  -7.556  -2.591
   75   1HG   GLU  10          HG2       GLU  10  18.748 -10.130  -2.117
   76   2HG   GLU  10          HG1       GLU  10  18.265  -9.586  -3.719
   77    H    ASP  11           HN       ASP  11  19.592  -9.554  -0.137
   78    HA   ASP  11           HA       ASP  11  18.856 -11.035   2.113
   79   1HB   ASP  11          HB2       ASP  11  17.550 -12.349   0.380
   80   2HB   ASP  11          HB1       ASP  11  19.098 -12.799  -0.333
   81    H    ALA  12           HN       ALA  12  20.789 -10.307   2.847
   82    HA   ALA  12           HA       ALA  12  23.216 -11.040   1.393
   83   1HB   ALA  12          HB1       ALA  12  23.011  -9.461   3.952
   84   2HB   ALA  12          HB2       ALA  12  22.877  -8.737   2.346
   85   3HB   ALA  12          HB3       ALA  12  24.373  -9.539   2.834
   86    H    SER  13           HN       SER  13  24.475 -12.682   1.945
   87    HA   SER  13           HA       SER  13  23.553 -14.432   4.061
   88   1HB   SER  13          HB2       SER  13  25.966 -15.112   2.455
   89   2HB   SER  13          HB1       SER  13  24.590 -16.119   2.909
   90    HG   SER  13           HG       SER  13  24.683 -14.124   0.875
   91    HA   PRO  14           HA       PRO  14  26.511 -13.586   7.246
   92   1HB   PRO  14          HB2       PRO  14  27.539 -16.162   7.627
   93   2HB   PRO  14          HB1       PRO  14  26.134 -15.471   8.441
   94   1HG   PRO  14          HG2       PRO  14  26.260 -17.280   6.081
   95   2HG   PRO  14          HG1       PRO  14  25.076 -17.231   7.401
   96   1HD   PRO  14          HD2       PRO  14  24.499 -16.268   4.973
   97   2HD   PRO  14          HD1       PRO  14  23.910 -15.468   6.447
   98    H    GLU  15           HN       GLU  15  28.583 -12.981   7.370
   99    HA   GLU  15           HA       GLU  15  30.792 -12.688   6.928
  100   1HB   GLU  15          HB2       GLU  15  30.528 -15.345   6.337
  101   2HB   GLU  15          HB1       GLU  15  31.071 -14.697   4.793
  102   1HG   GLU  15          HG2       GLU  15  33.149 -14.656   5.536
  103   2HG   GLU  15          HG1       GLU  15  32.676 -13.551   6.830
  104    H    GLU  16           HN       GLU  16  28.778 -13.391   4.149
  105    HA   GLU  16           HA       GLU  16  30.178 -11.804   2.269
  106   1HB   GLU  16          HB2       GLU  16  28.765 -13.497   1.414
  107   2HB   GLU  16          HB1       GLU  16  27.417 -12.987   2.417
  108   1HG   GLU  16          HG2       GLU  16  27.348 -10.872   1.059
  109   2HG   GLU  16          HG1       GLU  16  28.506 -11.632  -0.033
  110    H    LEU  17           HN       LEU  17  27.169 -11.299   4.101
  111    HA   LEU  17           HA       LEU  17  26.748  -8.627   3.447
  112   1HB   LEU  17          HB2       LEU  17  24.957  -9.033   4.702
  113   2HB   LEU  17          HB1       LEU  17  25.679 -10.519   5.281
  114    HG   LEU  17           HG       LEU  17  26.760  -8.256   6.710
  115   1HD1  LEU  17          HD11      LEU  17  24.816  -7.424   7.787
  116   2HD1  LEU  17          HD12      LEU  17  23.782  -8.604   6.982
  117   3HD1  LEU  17          HD13      LEU  17  24.528  -7.304   6.052
  118   1HD2  LEU  17          HD21      LEU  17  26.511 -10.817   7.237
  119   2HD2  LEU  17          HD22      LEU  17  24.966 -10.307   7.916
  120   3HD2  LEU  17          HD23      LEU  17  26.468  -9.620   8.532
  121    H    ASN  18           HN       ASN  18  28.738 -10.089   5.961
  122    HA   ASN  18           HA       ASN  18  29.459  -7.689   7.262
  123   1HB   ASN  18          HB2       ASN  18  29.702 -10.145   8.072
  124   2HB   ASN  18          HB1       ASN  18  31.238 -10.108   7.209
  125   1HD2  ASN  18          HD21      ASN  18  32.916  -8.883   8.005
  126   2HD2  ASN  18          HD22      ASN  18  32.891  -8.158   9.574
  127    H    ARG  19           HN       ARG  19  30.944  -9.575   4.667
  128    HA   ARG  19           HA       ARG  19  33.329  -8.098   4.439
  129   1HB   ARG  19          HB2       ARG  19  31.902 -10.089   2.889
  130   2HB   ARG  19          HB1       ARG  19  32.663  -8.892   1.846
  131   1HG   ARG  19          HG2       ARG  19  34.614  -9.488   3.714
  132   2HG   ARG  19          HG1       ARG  19  33.854 -11.043   3.380
  133   1HD   ARG  19          HD2       ARG  19  35.848 -10.289   1.922
  134   2HD   ARG  19          HD1       ARG  19  34.435 -10.987   1.134
  135    HE   ARG  19           HE       ARG  19  33.963  -8.936   0.183
  136   1HH1  ARG  19          HH11      ARG  19  36.601  -8.606   2.488
  137   2HH1  ARG  19          HH12      ARG  19  36.977  -6.983   1.990
  138   1HH2  ARG  19          HH21      ARG  19  34.494  -6.843  -0.481
  139   2HH2  ARG  19          HH22      ARG  19  35.792  -5.983   0.291
  140    H    TYR  20           HN       TYR  20  30.365  -7.846   2.500
  141    HA   TYR  20           HA       TYR  20  31.116  -5.531   1.108
  142   1HB   TYR  20          HB2       TYR  20  29.258  -6.110  -0.003
  143   2HB   TYR  20          HB1       TYR  20  28.831  -7.244   1.270
  144    HD1  TYR  20           HD1      TYR  20  27.139  -6.703   2.898
  145    HD2  TYR  20           HD2      TYR  20  28.334  -3.832  -0.012
  146    HE1  TYR  20           HE1      TYR  20  25.181  -5.324   3.464
  147    HE2  TYR  20           HE2      TYR  20  26.385  -2.449   0.540
  148    HH   TYR  20           HH       TYR  20  23.808  -3.636   2.538
  149    H    TYR  21           HN       TYR  21  29.494  -6.006   4.180
  150    HA   TYR  21           HA       TYR  21  28.471  -3.506   4.717
  151   1HB   TYR  21          HB2       TYR  21  28.624  -5.815   6.079
  152   2HB   TYR  21          HB1       TYR  21  29.855  -4.899   6.942
  153    HD1  TYR  21           HD1      TYR  21  26.283  -5.008   6.039
  154    HD2  TYR  21           HD2      TYR  21  29.267  -3.151   8.425
  155    HE1  TYR  21           HE1      TYR  21  24.529  -3.938   7.377
  156    HE2  TYR  21           HE2      TYR  21  27.533  -2.069   9.777
  157    HH   TYR  21           HH       TYR  21  24.265  -3.006   9.666
  158    H    ALA  22           HN       ALA  22  31.632  -4.714   5.824
  159    HA   ALA  22           HA       ALA  22  32.370  -2.161   6.840
  160   1HB   ALA  22          HB1       ALA  22  33.897  -4.714   6.445
  161   2HB   ALA  22          HB2       ALA  22  33.237  -4.045   7.939
  162   3HB   ALA  22          HB3       ALA  22  34.613  -3.267   7.153
  163    H    SER  23           HN       SER  23  33.003  -3.860   3.820
  164    HA   SER  23           HA       SER  23  35.040  -2.077   2.931
  165   1HB   SER  23          HB2       SER  23  33.253  -3.991   1.419
  166   2HB   SER  23          HB1       SER  23  34.594  -3.105   0.692
  167    HG   SER  23           HG       SER  23  35.264  -4.421   3.001
  168    H    LEU  24           HN       LEU  24  31.532  -2.195   2.444
  169    HA   LEU  24           HA       LEU  24  31.453   0.014   0.662
  170   1HB   LEU  24          HB2       LEU  24  29.577  -1.292   0.412
  171   2HB   LEU  24          HB1       LEU  24  29.461  -1.650   2.123
  172    HG   LEU  24           HG       LEU  24  28.945   1.113   1.846
  173   1HD1  LEU  24          HD11      LEU  24  27.848   1.445  -0.043
  174   2HD1  LEU  24          HD12      LEU  24  26.789   0.067   0.285
  175   3HD1  LEU  24          HD13      LEU  24  28.317  -0.181  -0.559
  176   1HD2  LEU  24          HD21      LEU  24  27.947  -1.057   3.201
  177   2HD2  LEU  24          HD22      LEU  24  26.614  -0.609   2.137
  178   3HD2  LEU  24          HD23      LEU  24  27.292   0.580   3.249
  179    H    ARG  25           HN       ARG  25  31.130  -0.426   4.148
  180    HA   ARG  25           HA       ARG  25  30.420   2.228   4.758
  181   1HB   ARG  25          HB2       ARG  25  31.170  -0.101   6.221
  182   2HB   ARG  25          HB1       ARG  25  32.149   1.241   6.799
  183   1HG   ARG  25          HG2       ARG  25  30.176   1.106   8.144
  184   2HG   ARG  25          HG1       ARG  25  30.066   2.550   7.136
  185   1HD   ARG  25          HD2       ARG  25  28.845   0.799   5.520
  186   2HD   ARG  25          HD1       ARG  25  28.471   0.055   7.074
  187    HE   ARG  25           HE       ARG  25  27.490   2.599   6.059
  188   1HH1  ARG  25          HH11      ARG  25  27.816   0.467   8.815
  189   2HH1  ARG  25          HH12      ARG  25  26.502   1.185   9.698
  190   1HH2  ARG  25          HH21      ARG  25  25.755   3.532   7.184
  191   2HH2  ARG  25          HH22      ARG  25  25.295   2.902   8.741
  192    H    HIS  26           HN       HIS  26  33.530   0.684   4.200
  193    HA   HIS  26           HA       HIS  26  35.162   2.909   4.860
  194   1HB   HIS  26          HB2       HIS  26  35.487   0.300   3.506
  195   2HB   HIS  26          HB1       HIS  26  36.622   1.542   3.000
  196    HD1  HIS  26           HD1      HIS  26  36.409  -1.117   5.285
  197    HD2  HIS  26           HD2      HIS  26  37.790   2.798   5.549
  198    HE1  HIS  26           HE1      HIS  26  37.940  -1.069   7.281
  199    HE2  HIS  26           HE2      HIS  26  38.914   1.254   7.298
  200    H    TYR  27           HN       TYR  27  34.147   1.571   1.740
  201    HA   TYR  27           HA       TYR  27  35.243   3.586   0.140
  202   1HB   TYR  27          HB2       TYR  27  34.742   1.567  -0.930
  203   2HB   TYR  27          HB1       TYR  27  33.114   1.510  -0.275
  204    HD1  TYR  27           HD1      TYR  27  34.783   4.298  -2.144
  205    HD2  TYR  27           HD2      TYR  27  31.775   1.291  -2.136
  206    HE1  TYR  27           HE1      TYR  27  33.907   5.172  -4.270
  207    HE2  TYR  27           HE2      TYR  27  30.900   2.143  -4.263
  208    HH   TYR  27           HH       TYR  27  32.369   4.969  -5.865
  209    H    LEU  28           HN       LEU  28  31.899   3.149   1.296
  210    HA   LEU  28           HA       LEU  28  30.874   5.427  -0.010
  211   1HB   LEU  28          HB2       LEU  28  29.928   3.524   1.971
  212   2HB   LEU  28          HB1       LEU  28  29.315   5.139   2.266
  213    HG   LEU  28           HG       LEU  28  28.354   5.215   0.027
  214   1HD1  LEU  28          HD11      LEU  28  30.214   3.262  -0.580
  215   2HD1  LEU  28          HD12      LEU  28  28.939   3.882  -1.632
  216   3HD1  LEU  28          HD13      LEU  28  28.656   2.438  -0.658
  217   1HD2  LEU  28          HD21      LEU  28  26.548   3.775   0.404
  218   2HD2  LEU  28          HD22      LEU  28  27.175   4.149   2.010
  219   3HD2  LEU  28          HD23      LEU  28  27.555   2.602   1.253
  220    H    ASN  29           HN       ASN  29  32.090   5.056   3.337
  221    HA   ASN  29           HA       ASN  29  31.466   7.656   4.180
  222   1HB   ASN  29          HB2       ASN  29  32.060   5.984   5.807
  223   2HB   ASN  29          HB1       ASN  29  33.653   5.776   5.089
  224   1HD2  ASN  29          HD21      ASN  29  35.051   6.458   6.535
  225   2HD2  ASN  29          HD22      ASN  29  34.995   7.964   7.381
  226    H    LEU  30           HN       LEU  30  34.395   6.378   2.662
  227    HA   LEU  30           HA       LEU  30  35.841   8.815   2.856
  228   1HB   LEU  30          HB2       LEU  30  36.218   6.168   1.617
  229   2HB   LEU  30          HB1       LEU  30  37.087   7.484   0.854
  230    HG   LEU  30           HG       LEU  30  38.465   6.320   2.497
  231   1HD1  LEU  30          HD11      LEU  30  37.711   9.170   3.015
  232   2HD1  LEU  30          HD12      LEU  30  39.136   8.528   2.196
  233   3HD1  LEU  30          HD13      LEU  30  38.983   8.377   3.947
  234   1HD2  LEU  30          HD21      LEU  30  37.979   6.422   4.864
  235   2HD2  LEU  30          HD22      LEU  30  36.664   5.615   4.015
  236   3HD2  LEU  30          HD23      LEU  30  36.476   7.286   4.544
  237    H    VAL  31           HN       VAL  31  33.385   7.764   0.717
  238    HA   VAL  31           HA       VAL  31  34.244   9.696  -1.318
  239    HB   VAL  31           HB       VAL  31  33.633   7.198  -1.822
  240   1HG1  VAL  31          HG11      VAL  31  31.182   7.225  -2.705
  241   2HG1  VAL  31          HG12      VAL  31  30.957   8.481  -1.485
  242   3HG1  VAL  31          HG13      VAL  31  31.504   6.874  -1.007
  243   1HG2  VAL  31          HG21      VAL  31  32.483   8.190  -4.031
  244   2HG2  VAL  31          HG22      VAL  31  34.214   8.284  -3.713
  245   3HG2  VAL  31          HG23      VAL  31  33.179   9.670  -3.369
  246    H    THR  32           HN       THR  32  32.157   9.501   1.286
  247    HA   THR  32           HA       THR  32  30.240  11.359   0.060
  248    HB   THR  32           HB       THR  32  29.041  11.006   2.339
  249    HG1  THR  32           HG1      THR  32  30.433   8.544   2.270
  250   1HG2  THR  32          HG21      THR  32  27.667   9.898   0.980
  251   2HG2  THR  32          HG22      THR  32  28.666   8.457   1.162
  252   3HG2  THR  32          HG23      THR  32  28.993   9.597  -0.143
  253    H    ARG  33           HN       ARG  33  32.231  10.970   2.977
  254    HA   ARG  33           HA       ARG  33  31.660  13.455   4.122
  255   1HB   ARG  33          HB2       ARG  33  33.095  11.286   4.909
  256   2HB   ARG  33          HB1       ARG  33  34.390  12.426   4.569
  257   1HG   ARG  33          HG2       ARG  33  33.376  14.044   6.090
  258   2HG   ARG  33          HG1       ARG  33  32.072  12.904   6.431
  259   1HD   ARG  33          HD2       ARG  33  34.968  12.234   6.883
  260   2HD   ARG  33          HD1       ARG  33  33.972  13.012   8.116
  261    HE   ARG  33           HE       ARG  33  33.334  10.374   6.947
  262   1HH1  ARG  33          HH11      ARG  33  33.530  12.550   9.706
  263   2HH1  ARG  33          HH12      ARG  33  32.946  11.352  10.830
  264   1HH2  ARG  33          HH21      ARG  33  32.564   8.835   8.428
  265   2HH2  ARG  33          HH22      ARG  33  32.405   9.248  10.109
  266    H    GLN  34           HN       GLN  34  34.484  12.499   2.187
  267    HA   GLN  34           HA       GLN  34  35.998  13.670   0.979
  268   1HB   GLN  34          HB2       GLN  34  33.494  14.654   0.251
  269   2HB   GLN  34          HB1       GLN  34  34.452  16.097   0.542
  270   1HG   GLN  34          HG2       GLN  34  35.684  13.965  -1.091
  271   2HG   GLN  34          HG1       GLN  34  34.358  14.874  -1.810
  272   1HE2  GLN  34          HE21      GLN  34  37.619  14.766  -1.428
  273   2HE2  GLN  34          HE22      GLN  34  38.005  16.422  -1.754
  274    H    ARG  35           HN       ARG  35  36.111  13.950   3.764
  275    HA   ARG  35           HA       ARG  35  37.033  16.725   4.085
  276   1HB   ARG  35          HB2       ARG  35  35.179  15.836   5.612
  277   2HB   ARG  35          HB1       ARG  35  36.414  14.817   6.336
  278   1HG   ARG  35          HG2       ARG  35  36.138  16.765   7.689
  279   2HG   ARG  35          HG1       ARG  35  37.705  16.861   6.883
  280   1HD   ARG  35          HD2       ARG  35  36.246  18.972   6.957
  281   2HD   ARG  35          HD1       ARG  35  36.991  18.529   5.422
  282    HE   ARG  35           HE       ARG  35  34.263  17.598   5.896
  283   1HH1  ARG  35          HH11      ARG  35  36.374  19.953   4.386
  284   2HH1  ARG  35          HH12      ARG  35  35.202  20.421   3.186
  285   1HH2  ARG  35          HH21      ARG  35  32.726  18.218   4.339
  286   2HH2  ARG  35          HH22      ARG  35  33.118  19.437   3.164
  287    H    TYR  36           HN       TYR  36  39.092  16.639   3.472
  288    HA   TYR  36           HA       TYR  36  41.300  16.172   3.421
  289   1HB   TYR  36          HB2       TYR  36  40.510  15.576   6.149
  290   2HB   TYR  36          HB1       TYR  36  41.864  14.573   5.636
  291    HD1  TYR  36           HD1      TYR  36  40.905  18.128   4.986
  292    HD2  TYR  36           HD2      TYR  36  43.842  15.424   6.441
  293    HE1  TYR  36           HE1      TYR  36  42.435  20.010   5.373
  294    HE2  TYR  36           HE2      TYR  36  45.387  17.299   6.840
  295    HH   TYR  36           HH       TYR  36  45.244  20.095   5.482
  296   1HN   NH2  37          H1        NH2  37  40.875  12.116   3.754
  297   2HN   NH2  37          H2        NH2  37  40.465  13.142   5.086
  Start of MODEL   20
    1   1H    TYR   1          HT1       TYR   1  24.369   0.928  -9.197
    2   2H    TYR   1          HT2       TYR   1  25.509   2.184  -9.160
    3   3H    TYR   1          HT3       TYR   1  25.172   1.300  -7.750
    4    HA   TYR   1           HA       TYR   1  26.450  -0.423  -8.319
    5   1HB   TYR   1          HB2       TYR   1  24.982  -0.182 -10.727
    6   2HB   TYR   1          HB1       TYR   1  26.679  -0.273 -11.181
    7    HD1  TYR   1           HD1      TYR   1  24.250  -1.983  -8.904
    8    HD2  TYR   1           HD2      TYR   1  27.610  -2.362 -11.488
    9    HE1  TYR   1           HE1      TYR   1  24.187  -4.426  -8.617
   10    HE2  TYR   1           HE2      TYR   1  27.558  -4.807 -11.206
   11    HH   TYR   1           HH       TYR   1  24.951  -6.469  -9.997
   12    HA   PRO   2           HA       PRO   2  29.777   2.637  -9.148
   13   1HB   PRO   2          HB2       PRO   2  30.645   2.461  -6.443
   14   2HB   PRO   2          HB1       PRO   2  29.829   3.822  -7.216
   15   1HG   PRO   2          HG2       PRO   2  28.760   2.240  -5.192
   16   2HG   PRO   2          HG1       PRO   2  27.834   3.292  -6.277
   17   1HD   PRO   2          HD2       PRO   2  28.270   0.337  -6.413
   18   2HD   PRO   2          HD1       PRO   2  26.820   1.285  -6.812
   19    H    ILE   3           HN       ILE   3  32.129   2.139  -7.550
   20    HA   ILE   3           HA       ILE   3  33.017  -0.299  -8.782
   21    HB   ILE   3           HB       ILE   3  34.473   1.747  -8.465
   22   1HG1  ILE   3          HG12      ILE   3  36.484   0.303  -7.709
   23   2HG1  ILE   3          HG11      ILE   3  35.315  -1.007  -7.619
   24   1HG2  ILE   3          HG21      ILE   3  33.728   1.558  -5.836
   25   2HG2  ILE   3          HG22      ILE   3  35.078   2.511  -6.450
   26   3HG2  ILE   3          HG23      ILE   3  35.358   0.889  -5.822
   27   1HD1  ILE   3          HD11      ILE   3  36.708  -0.012  -9.882
   28   2HD1  ILE   3          HD12      ILE   3  34.982   0.251 -10.130
   29   3HD1  ILE   3          HD13      ILE   3  35.589  -1.369  -9.781
   30    H    LYS   4           HN       LYS   4  31.577   0.543  -5.834
   31    HA   LYS   4           HA       LYS   4  32.091  -2.136  -4.803
   32   1HB   LYS   4          HB2       LYS   4  33.198   0.144  -3.699
   33   2HB   LYS   4          HB1       LYS   4  31.783  -0.147  -2.696
   34   1HG   LYS   4          HG2       LYS   4  33.760  -1.198  -1.759
   35   2HG   LYS   4          HG1       LYS   4  32.569  -2.411  -2.235
   36   1HD   LYS   4          HD2       LYS   4  33.979  -3.351  -3.681
   37   2HD   LYS   4          HD1       LYS   4  34.396  -1.792  -4.395
   38   1HE   LYS   4          HE2       LYS   4  35.976  -1.387  -2.568
   39   2HE   LYS   4          HE1       LYS   4  35.564  -2.952  -1.867
   40   1HZ   LYS   4          HZ1       LYS   4  37.502  -2.409  -3.785
   41   2HZ   LYS   4          HZ2       LYS   4  36.284  -3.286  -4.578
   42   3HZ   LYS   4          HZ3       LYS   4  37.026  -3.926  -3.192
   43    HA   PRO   5           HA       PRO   5  27.771  -2.528  -4.700
   44   1HB   PRO   5          HB2       PRO   5  27.411  -4.113  -2.509
   45   2HB   PRO   5          HB1       PRO   5  28.061  -4.706  -4.044
   46   1HG   PRO   5          HG2       PRO   5  29.552  -3.788  -1.594
   47   2HG   PRO   5          HG1       PRO   5  29.775  -5.282  -2.537
   48   1HD   PRO   5          HD2       PRO   5  31.390  -3.219  -2.925
   49   2HD   PRO   5          HD1       PRO   5  30.772  -4.129  -4.324
   50    H    GLU   6           HN       GLU   6  26.246  -1.119  -4.142
   51    HA   GLU   6           HA       GLU   6  26.214  -0.004  -1.433
   52   1HB   GLU   6          HB2       GLU   6  24.670   1.630  -2.264
   53   2HB   GLU   6          HB1       GLU   6  25.971   1.498  -3.438
   54   1HG   GLU   6          HG2       GLU   6  23.580  -0.194  -3.870
   55   2HG   GLU   6          HG1       GLU   6  23.403   1.543  -4.125
   56    H    ALA   7           HN       ALA   7  24.867  -2.482  -3.262
   57    HA   ALA   7           HA       ALA   7  22.517  -2.688  -1.503
   58   1HB   ALA   7          HB1       ALA   7  21.711  -4.289  -3.324
   59   2HB   ALA   7          HB2       ALA   7  23.019  -3.631  -4.308
   60   3HB   ALA   7          HB3       ALA   7  21.745  -2.569  -3.712
   61    HA   PRO   8           HA       PRO   8  24.487  -6.094   0.488
   62   1HB   PRO   8          HB2       PRO   8  21.772  -7.063   1.088
   63   2HB   PRO   8          HB1       PRO   8  23.058  -6.570   2.192
   64   1HG   PRO   8          HG2       PRO   8  20.867  -5.070   1.806
   65   2HG   PRO   8          HG1       PRO   8  22.457  -4.344   2.103
   66   1HD   PRO   8          HD2       PRO   8  20.958  -4.649  -0.470
   67   2HD   PRO   8          HD1       PRO   8  21.951  -3.293   0.105
   68    H    GLY   9           HN       GLY   9  21.658  -6.782  -1.550
   69   1HA   GLY   9          HA2       GLY   9  21.829  -8.375  -3.352
   70   2HA   GLY   9          HA1       GLY   9  22.986  -9.280  -2.386
   71    H    GLU  10           HN       GLU  10  19.702  -8.004  -1.938
   72    HA   GLU  10           HA       GLU  10  17.800  -8.892  -1.097
   73   1HB   GLU  10          HB2       GLU  10  18.914 -10.951  -2.744
   74   2HB   GLU  10          HB1       GLU  10  18.171 -11.696  -1.335
   75   1HG   GLU  10          HG2       GLU  10  16.343 -11.623  -2.642
   76   2HG   GLU  10          HG1       GLU  10  16.225  -9.991  -1.986
   77    H    ASP  11           HN       ASP  11  19.082 -11.952  -0.229
   78    HA   ASP  11           HA       ASP  11  18.670 -11.370   2.558
   79   1HB   ASP  11          HB2       ASP  11  18.336 -13.582   2.714
   80   2HB   ASP  11          HB1       ASP  11  18.577 -13.677   0.976
   81    H    ALA  12           HN       ALA  12  21.338 -11.605   0.375
   82    HA   ALA  12           HA       ALA  12  23.484 -10.917   0.526
   83   1HB   ALA  12          HB1       ALA  12  24.244  -9.719   2.605
   84   2HB   ALA  12          HB2       ALA  12  22.617  -9.964   3.238
   85   3HB   ALA  12          HB3       ALA  12  22.858  -9.017   1.771
   86    H    SER  13           HN       SER  13  22.456 -12.565   3.499
   87    HA   SER  13           HA       SER  13  23.192 -14.462   4.505
   88   1HB   SER  13          HB2       SER  13  25.341 -14.681   2.393
   89   2HB   SER  13          HB1       SER  13  24.753 -15.958   3.459
   90    HG   SER  13           HG       SER  13  22.746 -14.783   2.013
   91    HA   PRO  14           HA       PRO  14  26.058 -12.866   7.423
   92   1HB   PRO  14          HB2       PRO  14  26.840 -15.701   7.869
   93   2HB   PRO  14          HB1       PRO  14  26.276 -14.492   9.027
   94   1HG   PRO  14          HG2       PRO  14  24.665 -16.447   8.224
   95   2HG   PRO  14          HG1       PRO  14  24.045 -14.803   8.463
   96   1HD   PRO  14          HD2       PRO  14  24.706 -16.231   5.921
   97   2HD   PRO  14          HD1       PRO  14  23.366 -15.124   6.276
   98    H    GLU  15           HN       GLU  15  28.059 -12.142   7.388
   99    HA   GLU  15           HA       GLU  15  30.287 -11.923   7.047
  100   1HB   GLU  15          HB2       GLU  15  29.957 -14.785   6.681
  101   2HB   GLU  15          HB1       GLU  15  31.218 -14.133   5.643
  102   1HG   GLU  15          HG2       GLU  15  31.133 -13.437   8.547
  103   2HG   GLU  15          HG1       GLU  15  31.828 -14.963   8.010
  104    H    GLU  16           HN       GLU  16  28.399 -13.268   4.430
  105    HA   GLU  16           HA       GLU  16  29.872 -12.010   2.345
  106   1HB   GLU  16          HB2       GLU  16  27.165 -13.283   2.574
  107   2HB   GLU  16          HB1       GLU  16  27.613 -12.409   1.110
  108   1HG   GLU  16          HG2       GLU  16  28.676 -14.967   2.200
  109   2HG   GLU  16          HG1       GLU  16  28.184 -14.559   0.557
  110    H    LEU  17           HN       LEU  17  26.858 -11.264   4.083
  111    HA   LEU  17           HA       LEU  17  26.494  -8.691   3.012
  112   1HB   LEU  17          HB2       LEU  17  24.879  -8.351   4.633
  113   2HB   LEU  17          HB1       LEU  17  24.901 -10.098   4.506
  114    HG   LEU  17           HG       LEU  17  26.723  -9.577   6.534
  115   1HD1  LEU  17          HD11      LEU  17  25.899  -7.955   7.955
  116   2HD1  LEU  17          HD12      LEU  17  24.309  -7.947   7.195
  117   3HD1  LEU  17          HD13      LEU  17  25.682  -7.201   6.376
  118   1HD2  LEU  17          HD21      LEU  17  23.888 -10.039   7.258
  119   2HD2  LEU  17          HD22      LEU  17  25.343 -10.900   7.759
  120   3HD2  LEU  17          HD23      LEU  17  24.646 -11.198   6.167
  121    H    ASN  18           HN       ASN  18  28.546  -9.944   5.546
  122    HA   ASN  18           HA       ASN  18  29.402  -7.440   6.560
  123   1HB   ASN  18          HB2       ASN  18  29.708  -9.501   7.839
  124   2HB   ASN  18          HB1       ASN  18  30.809 -10.117   6.608
  125   1HD2  ASN  18          HD21      ASN  18  32.705 -10.205   7.611
  126   2HD2  ASN  18          HD22      ASN  18  33.465  -8.876   8.430
  127    H    ARG  19           HN       ARG  19  30.549  -9.557   3.973
  128    HA   ARG  19           HA       ARG  19  32.872  -8.220   3.229
  129   1HB   ARG  19          HB2       ARG  19  30.772  -9.382   1.376
  130   2HB   ARG  19          HB1       ARG  19  32.411  -8.954   0.907
  131   1HG   ARG  19          HG2       ARG  19  31.829 -10.984   3.036
  132   2HG   ARG  19          HG1       ARG  19  31.921 -11.399   1.324
  133   1HD   ARG  19          HD2       ARG  19  34.199 -10.725   1.200
  134   2HD   ARG  19          HD1       ARG  19  34.132  -9.978   2.798
  135    HE   ARG  19           HE       ARG  19  34.473 -12.774   2.189
  136   1HH1  ARG  19          HH11      ARG  19  33.620 -10.402   4.614
  137   2HH1  ARG  19          HH12      ARG  19  33.743 -11.518   5.941
  138   1HH2  ARG  19          HH21      ARG  19  34.688 -14.239   3.930
  139   2HH2  ARG  19          HH22      ARG  19  34.369 -13.695   5.557
  140    H    TYR  20           HN       TYR  20  29.631  -7.759   1.886
  141    HA   TYR  20           HA       TYR  20  30.193  -5.413   0.463
  142   1HB   TYR  20          HB2       TYR  20  28.212  -6.168  -0.314
  143   2HB   TYR  20          HB1       TYR  20  27.848  -7.003   1.189
  144    HD1  TYR  20           HD1      TYR  20  26.562  -5.905   2.944
  145    HD2  TYR  20           HD2      TYR  20  27.417  -3.931  -0.721
  146    HE1  TYR  20           HE1      TYR  20  24.836  -4.222   3.454
  147    HE2  TYR  20           HE2      TYR  20  25.695  -2.252  -0.230
  148    HH   TYR  20           HH       TYR  20  24.077  -1.627   1.146
  149    H    TYR  21           HN       TYR  21  29.096  -5.954   3.750
  150    HA   TYR  21           HA       TYR  21  28.280  -3.391   4.447
  151   1HB   TYR  21          HB2       TYR  21  28.284  -5.727   5.729
  152   2HB   TYR  21          HB1       TYR  21  29.713  -5.027   6.481
  153    HD1  TYR  21           HD1      TYR  21  26.087  -4.670   6.019
  154    HD2  TYR  21           HD2      TYR  21  29.541  -3.227   8.030
  155    HE1  TYR  21           HE1      TYR  21  24.652  -3.432   7.570
  156    HE2  TYR  21           HE2      TYR  21  28.129  -1.981   9.592
  157    HH   TYR  21           HH       TYR  21  25.027  -2.566  10.127
  158    H    ALA  22           HN       ALA  22  31.433  -4.885   5.168
  159    HA   ALA  22           HA       ALA  22  32.504  -2.462   6.183
  160   1HB   ALA  22          HB1       ALA  22  33.474  -4.367   7.062
  161   2HB   ALA  22          HB2       ALA  22  34.709  -3.774   5.948
  162   3HB   ALA  22          HB3       ALA  22  33.672  -5.124   5.481
  163    H    SER  23           HN       SER  23  32.458  -3.944   3.006
  164    HA   SER  23           HA       SER  23  34.367  -2.258   1.787
  165   1HB   SER  23          HB2       SER  23  31.918  -3.544   0.543
  166   2HB   SER  23          HB1       SER  23  33.294  -2.885  -0.339
  167    HG   SER  23           HG       SER  23  33.280  -5.109   1.431
  168    H    LEU  24           HN       LEU  24  30.826  -2.015   1.987
  169    HA   LEU  24           HA       LEU  24  30.559   0.463   0.721
  170   1HB   LEU  24          HB2       LEU  24  28.646  -0.955   0.938
  171   2HB   LEU  24          HB1       LEU  24  28.818  -1.028   2.681
  172    HG   LEU  24           HG       LEU  24  28.492   1.690   2.088
  173   1HD1  LEU  24          HD11      LEU  24  27.404   1.771   0.151
  174   2HD1  LEU  24          HD12      LEU  24  26.045   1.036   1.004
  175   3HD1  LEU  24          HD13      LEU  24  27.179   0.022   0.110
  176   1HD2  LEU  24          HD21      LEU  24  26.592  -0.392   3.152
  177   2HD2  LEU  24          HD22      LEU  24  26.314   1.347   3.237
  178   3HD2  LEU  24          HD23      LEU  24  27.685   0.630   4.083
  179    H    ARG  25           HN       ARG  25  30.994  -0.481   4.091
  180    HA   ARG  25           HA       ARG  25  30.648   2.007   5.302
  181   1HB   ARG  25          HB2       ARG  25  31.302  -0.512   6.164
  182   2HB   ARG  25          HB1       ARG  25  32.799   0.363   6.442
  183   1HG   ARG  25          HG2       ARG  25  31.528   0.450   8.439
  184   2HG   ARG  25          HG1       ARG  25  31.486   2.059   7.712
  185   1HD   ARG  25          HD2       ARG  25  29.290   0.887   6.594
  186   2HD   ARG  25          HD1       ARG  25  29.318   0.142   8.196
  187    HE   ARG  25           HE       ARG  25  29.102   3.032   7.636
  188   1HH1  ARG  25          HH11      ARG  25  28.855   0.334   9.863
  189   2HH1  ARG  25          HH12      ARG  25  28.103   1.268  11.114
  190   1HH2  ARG  25          HH21      ARG  25  28.100   4.269   9.292
  191   2HH2  ARG  25          HH22      ARG  25  27.667   3.494  10.793
  192    H    HIS  26           HN       HIS  26  33.658   0.473   4.186
  193    HA   HIS  26           HA       HIS  26  35.241   2.766   4.789
  194   1HB   HIS  26          HB2       HIS  26  36.872   1.250   4.640
  195   2HB   HIS  26          HB1       HIS  26  35.696   0.057   4.130
  196    HD1  HIS  26           HD1      HIS  26  38.653   1.875   3.039
  197    HD2  HIS  26           HD2      HIS  26  35.539  -0.204   1.228
  198    HE1  HIS  26           HE1      HIS  26  39.440   1.372   0.703
  199    HE2  HIS  26           HE2      HIS  26  37.607  -0.035  -0.316
  200    H    TYR  27           HN       TYR  27  33.615   1.575   1.929
  201    HA   TYR  27           HA       TYR  27  34.784   3.332   0.043
  202   1HB   TYR  27          HB2       TYR  27  33.469   1.247  -0.473
  203   2HB   TYR  27          HB1       TYR  27  32.012   2.128  -0.036
  204    HD1  TYR  27           HD1      TYR  27  34.729   3.809  -1.829
  205    HD2  TYR  27           HD2      TYR  27  31.032   1.751  -2.196
  206    HE1  TYR  27           HE1      TYR  27  34.539   4.577  -4.156
  207    HE2  TYR  27           HE2      TYR  27  30.827   2.502  -4.520
  208    HH   TYR  27           HH       TYR  27  33.406   4.399  -6.070
  209    H    LEU  28           HN       LEU  28  31.608   3.415   1.663
  210    HA   LEU  28           HA       LEU  28  30.880   5.951   0.674
  211   1HB   LEU  28          HB2       LEU  28  29.976   4.430   3.108
  212   2HB   LEU  28          HB1       LEU  28  29.298   5.986   2.668
  213    HG   LEU  28           HG       LEU  28  28.892   3.320   1.433
  214   1HD1  LEU  28          HD11      LEU  28  26.834   3.790   2.091
  215   2HD1  LEU  28          HD12      LEU  28  26.789   5.148   0.967
  216   3HD1  LEU  28          HD13      LEU  28  27.348   5.391   2.623
  217   1HD2  LEU  28          HD21      LEU  28  29.344   3.944  -0.652
  218   2HD2  LEU  28          HD22      LEU  28  29.660   5.608  -0.155
  219   3HD2  LEU  28          HD23      LEU  28  28.014   5.095  -0.524
  220    H    ASN  29           HN       ASN  29  32.644   5.012   3.580
  221    HA   ASN  29           HA       ASN  29  32.756   7.544   4.802
  222   1HB   ASN  29          HB2       ASN  29  33.471   5.301   5.798
  223   2HB   ASN  29          HB1       ASN  29  34.977   5.499   4.907
  224   1HD2  ASN  29          HD21      ASN  29  36.388   5.830   6.495
  225   2HD2  ASN  29          HD22      ASN  29  36.303   7.113   7.645
  226    H    LEU  30           HN       LEU  30  34.828   6.005   2.388
  227    HA   LEU  30           HA       LEU  30  36.775   8.032   2.260
  228   1HB   LEU  30          HB2       LEU  30  36.269   5.564   1.014
  229   2HB   LEU  30          HB1       LEU  30  36.395   6.737  -0.280
  230    HG   LEU  30           HG       LEU  30  38.495   5.406   0.862
  231   1HD1  LEU  30          HD11      LEU  30  38.504   6.486  -1.305
  232   2HD1  LEU  30          HD12      LEU  30  39.903   7.009  -0.367
  233   3HD1  LEU  30          HD13      LEU  30  38.507   8.072  -0.541
  234   1HD2  LEU  30          HD21      LEU  30  38.416   8.173   2.062
  235   2HD2  LEU  30          HD22      LEU  30  39.822   7.109   2.054
  236   3HD2  LEU  30          HD23      LEU  30  38.369   6.647   2.943
  237    H    VAL  31           HN       VAL  31  33.876   7.467   0.273
  238    HA   VAL  31           HA       VAL  31  34.451   9.719  -1.420
  239    HB   VAL  31           HB       VAL  31  31.873   8.156  -1.294
  240   1HG1  VAL  31          HG11      VAL  31  32.197  10.414  -2.592
  241   2HG1  VAL  31          HG12      VAL  31  31.326   9.067  -3.325
  242   3HG1  VAL  31          HG13      VAL  31  33.008   9.374  -3.762
  243   1HG2  VAL  31          HG21      VAL  31  33.532   6.515  -1.633
  244   2HG2  VAL  31          HG22      VAL  31  34.452   7.559  -2.717
  245   3HG2  VAL  31          HG23      VAL  31  32.904   6.891  -3.237
  246    H    THR  32           HN       THR  32  31.852   9.017   0.939
  247    HA   THR  32           HA       THR  32  30.596  11.531   0.555
  248    HB   THR  32           HB       THR  32  30.183  10.029   3.099
  249    HG1  THR  32           HG1      THR  32  30.191   8.295   1.769
  250   1HG2  THR  32          HG21      THR  32  27.753  10.441   2.039
  251   2HG2  THR  32          HG22      THR  32  28.638  11.746   1.251
  252   3HG2  THR  32          HG23      THR  32  28.592  11.650   3.011
  253    H    ARG  33           HN       ARG  33  33.060  10.394   2.763
  254    HA   ARG  33           HA       ARG  33  32.975  12.975   4.161
  255   1HB   ARG  33          HB2       ARG  33  34.521  10.512   4.959
  256   2HB   ARG  33          HB1       ARG  33  34.241  11.950   5.930
  257   1HG   ARG  33          HG2       ARG  33  31.815  10.588   4.992
  258   2HG   ARG  33          HG1       ARG  33  32.811   9.670   6.123
  259   1HD   ARG  33          HD2       ARG  33  32.829  11.845   7.514
  260   2HD   ARG  33          HD1       ARG  33  31.448  12.307   6.516
  261    HE   ARG  33           HE       ARG  33  31.558  10.072   8.422
  262   1HH1  ARG  33          HH11      ARG  33  29.720  12.057   6.203
  263   2HH1  ARG  33          HH12      ARG  33  28.181  11.428   6.700
  264   1HH2  ARG  33          HH21      ARG  33  29.530   9.253   9.104
  265   2HH2  ARG  33          HH22      ARG  33  28.072   9.875   8.383
  266    H    GLN  34           HN       GLN  34  33.936  13.316   1.727
  267    HA   GLN  34           HA       GLN  34  36.809  13.078   1.659
  268   1HB   GLN  34          HB2       GLN  34  34.693  14.150  -0.128
  269   2HB   GLN  34          HB1       GLN  34  36.287  14.874  -0.283
  270   1HG   GLN  34          HG2       GLN  34  35.641  11.949  -0.542
  271   2HG   GLN  34          HG1       GLN  34  35.978  13.062  -1.870
  272   1HE2  GLN  34          HE21      GLN  34  37.271  10.850   0.264
  273   2HE2  GLN  34          HE22      GLN  34  38.952  11.206   0.028
  274    H    ARG  35           HN       ARG  35  36.406  14.188   3.975
  275    HA   ARG  35           HA       ARG  35  36.989  17.054   3.639
  276   1HB   ARG  35          HB2       ARG  35  34.665  16.366   4.628
  277   2HB   ARG  35          HB1       ARG  35  35.589  15.997   6.080
  278   1HG   ARG  35          HG2       ARG  35  36.494  18.353   5.958
  279   2HG   ARG  35          HG1       ARG  35  35.286  18.657   4.709
  280   1HD   ARG  35          HD2       ARG  35  34.449  19.385   6.858
  281   2HD   ARG  35          HD1       ARG  35  33.516  18.003   6.291
  282    HE   ARG  35           HE       ARG  35  35.699  17.269   8.005
  283   1HH1  ARG  35          HH11      ARG  35  32.373  18.371   7.951
  284   2HH1  ARG  35          HH12      ARG  35  31.997  17.712   9.512
  285   1HH2  ARG  35          HH21      ARG  35  35.214  16.380  10.029
  286   2HH2  ARG  35          HH22      ARG  35  33.609  16.545  10.684
  287    H    TYR  36           HN       TYR  36  38.689  17.825   4.795
  288    HA   TYR  36           HA       TYR  36  40.361  15.845   6.121
  289   1HB   TYR  36          HB2       TYR  36  40.772  18.399   4.770
  290   2HB   TYR  36          HB1       TYR  36  41.666  18.289   6.283
  291    HD1  TYR  36           HD1      TYR  36  41.036  15.156   4.604
  292    HD2  TYR  36           HD2      TYR  36  43.719  18.449   4.854
  293    HE1  TYR  36           HE1      TYR  36  42.766  13.824   3.478
  294    HE2  TYR  36           HE2      TYR  36  45.457  17.123   3.730
  295    HH   TYR  36           HH       TYR  36  45.018  13.701   3.072
  296   1HN   NH2  37          H1        NH2  37  40.597  17.673   9.306
  297   2HN   NH2  37          H2        NH2  37  41.682  17.157   8.060