*HEADER    GENE REGULATION                         07-MAR-03   1OQA              
*TITLE     SOLUTION STRUCTURE OF THE BRCT-C DOMAIN FROM HUMAN BRCA1              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BREAST CANCER TYPE 1 SUSCEPTIBILITY PROTEIN;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: BRCT-C;                                                    
*COMPND   5 SYNONYM: BRCA1;                                                      
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: BRCA1;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PGEX-4T1                                  
*KEYWDS    BRCT, BREAST CANCER                                                   
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    O.J.GAISER, L.J.BALL, P.SCHMIEDER, D.LEITNER, H.STRAUSS,              
*AUTHOR   2 M.WAHL, R.KUHNE, H.OSCHKINAT, U.HEINEMANN                            
*REVDAT   1   15-JUN-04 1OQA    0                                                
! noe2cns_838c_PDB.tbl (noe2cns_838c_sortEND.tbl)
! created 16 Dec 2003 by O. Gaiser
!
! residue 1    Gly , NOEs forward in sequence
! residue 2    Ser , NOEs forward in sequence
! residue 3    Gln , NOEs forward in sequence
assi (resi 3    and name HA   ) (resi 4    and name HN   )  3.50  3.50  0.00 
assi (resi 3    and name HB1  ) (resi 4    and name HN   )  5.00  5.00  0.00 
assi (resi 3    and name HB2  ) (resi 4    and name HN   )  5.00  5.00  0.00 
! residue 4    Asp , NOEs forward in sequence
assi (resi 4    and name HN   ) (resi 5    and name HB2  )  5.00  5.00  0.00 
assi (resi 4    and name HA   ) (resi 5    and name HN   )  3.50  3.50  0.00 
assi (resi 4    and name HB1  ) (resi 5    and name HN   )  3.50  3.50  0.00 
assi (resi 4    and name HB2  ) (resi 5    and name HN   )  3.50  3.50  0.00 
! residue 5    Arg , NOEs forward in sequence
assi (resi 5    and name HN   ) (resi 6    and name HN   )  3.50  3.50  0.00 
assi (resi 5    and name HA   ) (resi 6    and name HN   )  3.50  3.50  0.00 
assi (resi 5    and name HG2  ) (resi 6    and name HN   )  5.00  5.00  0.00 
assi (resi 5    and name HD#  ) (resi 7    and name HG2# )  5.00  5.00  0.00 
! residue 6    Lys , NOEs forward in sequence
assi (resi 6    and name HA   ) (resi 7    and name HN   )  3.50  3.50  0.00 
assi (resi 6    and name HB2  ) (resi 7    and name HN   )  5.00  5.00  0.00
assi (resi 6    and name HD1  ) (resi 7    and name HN   )  5.00  5.00  0.00
assi (resi 6    and name HD2  ) (resi 7    and name HN   )  5.00  5.00  0.00 
assi (resi 6    and name HA   ) (resi 8    and name HN   )  5.00  5.00  0.00
assi (resi 6    and name HB1  ) (resi 8    and name HN   )  5.00  5.00  0.00 
assi (resi 6    and name HB2  ) (resi 8    and name HN   )  5.00  5.00  0.00
assi (resi 6    and name HB2  ) (resi 9    and name HN   )  5.00  5.00  0.00 
assi (resi 6    and name HG1  ) (resi 9    and name HN   )  6.00  6.00  0.00 
assi (resi 6    and name HG1  ) (resi 9    and name HB1  )  6.00  6.00  0.00 
assi (resi 6    and name HA   ) (resi 34   and name HA   )  3.50  3.50  0.00
assi (resi 6    and name HB1  ) (resi 35   and name HA1  )  3.50  3.50  0.00
assi (resi 6    and name HB2  ) (resi 35   and name HN   )  5.00  5.00  0.00 
assi (resi 6    and name HB2  ) (resi 35   and name HA1  )  5.00  5.00  0.00 
assi (resi 6    and name HB2  ) (resi 35   and name HA2  )  5.00  5.00  0.00 
assi (resi 6    and name HG2  ) (resi 35   and name HN   )  6.00  6.00  0.00 
assi (resi 6    and name HG2  ) (resi 35   and name HA2  )  5.00  5.00  0.00
assi (resi 6    and name HD1  ) (resi 35   and name HN   )  5.00  5.00  0.00 
assi (resi 6    and name HD1  ) (resi 35   and name HA1  )  5.00  5.00  0.00 
assi (resi 6    and name HD1  ) (resi 35   and name HA2  )  5.00  5.00  0.00 
assi (resi 6    and name HD2  ) (resi 35   and name HN   )  5.00  5.00  0.00 
assi (resi 6    and name HD2  ) (resi 35   and name HA1  )  5.00  5.00  0.00 
assi (resi 6    and name HD2  ) (resi 35   and name HA2  )  5.00  5.00  0.00 
assi (resi 6    and name HA   ) (resi 92   and name HD#  )  5.00  5.00  0.00
assi (resi 6    and name HA   ) (resi 92   and name HE#  )  6.00  6.00  0.00
! residue 7    Ile , NOEs forward in sequence
assi (resi 7    and name HN   ) (resi 8    and name HN   )  3.50  3.50  0.00
assi (resi 7    and name HA   ) (resi 8    and name HN   )  5.00  5.00  0.00 
assi (resi 7    and name HB   ) (resi 8    and name HN   )  5.00  5.00  0.00 
assi (resi 7    and name HG11 ) (resi 8    and name HN   )  3.50  3.50  0.00
assi (resi 7    and name HG11 ) (resi 8    and name HB1  )  5.00  5.00  0.00
assi (resi 7    and name HG11 ) (resi 8    and name HD#  )  5.00  5.00  0.00 
assi (resi 7    and name HG11 ) (resi 8    and name HE#  )  6.00  6.00  0.00 
assi (resi 7    and name HG12 ) (resi 8    and name HN   )  5.00  5.00  0.00 
assi (resi 7    and name HG12 ) (resi 8    and name HD#  )  6.00  6.00  0.00
assi (resi 7    and name HG12 ) (resi 8    and name HE#  )  6.00  6.00  0.00
assi (resi 7    and name HG2# ) (resi 8    and name HN   )  6.00  6.00  0.00
assi (resi 7    and name HG2# ) (resi 8    and name HD#  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 8    and name HN   )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 8    and name HD#  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 8    and name HE#  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 8    and name HZ   )  6.00  6.00  0.00
assi (resi 7    and name HN   ) (resi 9    and name HN   )  6.00  6.00  0.00 
assi (resi 7    and name HB   ) (resi 9    and name HN   )  6.00  6.00  0.00 
assi (resi 7    and name HD1# ) (resi 31   and name HA   )  6.00  6.00  0.00 
assi (resi 7    and name HN   ) (resi 34   and name HA   )  5.00  5.00  0.00
assi (resi 7    and name HN   ) (resi 34   and name HB1  )  5.00  5.00  0.00 
assi (resi 7    and name HN   ) (resi 34   and name HB2  )  5.00  5.00  0.00 
assi (resi 7    and name HG11 ) (resi 34   and name HN   )  6.00  6.00  0.00 
assi (resi 7    and name HG11 ) (resi 34   and name HB1  )  5.00  5.00  0.00
assi (resi 7    and name HG11 ) (resi 34   and name HB2  )  5.00  5.00  0.00
assi (resi 7    and name HG12 ) (resi 34   and name HB1  )  5.00  5.00  0.00
assi (resi 7    and name HG12 ) (resi 34   and name HB2  )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 34   and name HB1  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 34   and name HB1  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 34   and name HB2  )  6.00  6.00  0.00
assi (resi 7    and name HG11 ) (resi 88   and name HB1  )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 88   and name HB1  )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 88   and name HA   )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 88   and name HB1  )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 88   and name HB2  )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 89   and name HA   )  6.00  6.00  0.00 
assi (resi 7    and name HD1# ) (resi 89   and name HN   )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 89   and name HA   )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 89   and name HG1# )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 89   and name HG2# )  6.00  6.00  0.00
assi (resi 7    and name HG11 ) (resi 92   and name HD#  )  3.50  3.50  0.00
assi (resi 7    and name HG2# ) (resi 92   and name HN   )  6.00  6.00  0.00 
assi (resi 7    and name HG2# ) (resi 92   and name HA   )  6.00  6.00  0.00
assi (resi 7    and name HG2# ) (resi 92   and name HD#  )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 92   and name HE#  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 92   and name HN   )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 92   and name HA   )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 92   and name HD#  )  6.00  6.00  0.00
assi (resi 7    and name HB   ) (resi 93   and name HN   )  5.00  5.00  0.00 
assi (resi 7    and name HB   ) (resi 93   and name HA   )  6.00  6.00  0.00 
assi (resi 7    and name HG11 ) (resi 93   and name HA   )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 93   and name HN   )  6.00  6.00  0.00
assi (resi 7    and name HG2# ) (resi 93   and name HA   )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 93   and name HN   )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 93   and name HA   )  6.00  6.00  0.00
assi (resi 7    and name HB   ) (resi 94   and name HN   )  5.00  5.00  0.00
assi (resi 7    and name HB   ) (resi 94   and name HB1  )  5.00  5.00  0.00 
assi (resi 7    and name HB   ) (resi 94   and name HB2  )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 94   and name HN   )  5.00  5.00  0.00
assi (resi 7    and name HG2# ) (resi 94   and name HB1  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 94   and name HN   )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 94   and name HA   )  5.00  5.00  0.00
assi (resi 7    and name HD1# ) (resi 94   and name HB1  )  6.00  6.00  0.00
assi (resi 7    and name HD1# ) (resi 95   and name HN   )  6.00  6.00  0.00
! residue 8    Phe , NOEs forward in sequence
assi (resi 8    and name HN   ) (resi 9    and name HN   )  3.50  3.50  0.00
assi (resi 8    and name HN   ) (resi 9    and name HA   )  5.00  5.00  0.00 
assi (resi 8    and name HN   ) (resi 9    and name HA   )  5.00  5.00  0.00 
assi (resi 8    and name HN   ) (resi 9    and name HB1  )  5.00  5.00  0.00 
assi (resi 8    and name HN   ) (resi 9    and name HB1  )  5.00  5.00  0.00 
assi (resi 8    and name HN   ) (resi 9    and name HB2  )  6.00  6.00  0.00 
assi (resi 8    and name HN   ) (resi 9    and name HB2  )  6.00  6.00  0.00 
assi (resi 8    and name HA   ) (resi 9    and name HN   )  5.00  5.00  0.00
assi (resi 8    and name HN   ) (resi 11   and name HD1# )  6.00  6.00  0.00 
assi (resi 8    and name HA   ) (resi 11   and name HG   )  5.00  5.00  0.00
assi (resi 8    and name HA   ) (resi 11   and name HD1# )  6.00  6.00  0.00
assi (resi 8    and name HA   ) (resi 11   and name HD2# )  5.00  5.00  0.00
assi (resi 8    and name HB1  ) (resi 11   and name HD1# )  6.00  6.00  0.00 
assi (resi 8    and name HB1  ) (resi 11   and name HD2# )  6.00  6.00  0.00 
assi (resi 8    and name HB2  ) (resi 11   and name HD1# )  5.00  5.00  0.00
assi (resi 8    and name HB2  ) (resi 11   and name HD2# )  5.00  5.00  0.00
assi (resi 8    and name HD#  ) (resi 11   and name HD1# )  6.00  6.00  0.00
assi (resi 8    and name HD#  ) (resi 11   and name HD2# )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 11   and name HD1# )  6.00  6.00  0.00 
assi (resi 8    and name HE#  ) (resi 11   and name HD2# )  6.00  6.00  0.00
assi (resi 8    and name HA   ) (resi 13   and name HD1# )  6.00  6.00  0.00
assi (resi 8    and name HB1  ) (resi 13   and name HD1# )  5.00  5.00  0.00
assi (resi 8    and name HB2  ) (resi 13   and name HD1# )  5.00  5.00  0.00
assi (resi 8    and name HD#  ) (resi 13   and name HD1# )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 13   and name HG2# )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 13   and name HD1# )  6.00  6.00  0.00
assi (resi 8    and name HZ   ) (resi 13   and name HD1# )  6.00  6.00  0.00 
assi (resi 8    and name HZ   ) (resi 13   and name HD1# )  6.00  6.00  0.00 
assi (resi 8    and name HD#  ) (resi 31   and name HA   )  5.00  5.00  0.00 
assi (resi 8    and name HD#  ) (resi 31   and name HB   )  5.00  5.00  0.00 
assi (resi 8	and name HD#  ) (resi 31   and name HG2# )  6.00  6.00  0.00 
assi (resi 8    and name HE#  ) (resi 31   and name HA   )  5.00  5.00  0.00 
assi (resi 8    and name HE#  ) (resi 31   and name HB   )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 31   and name HG2# )  5.00  5.00  0.00
assi (resi 8    and name HZ   ) (resi 31   and name HG2# )  6.00  6.00  0.00
assi (resi 8    and name HN   ) (resi 34   and name HB1  )  3.50  3.50  0.00 
assi (resi 8    and name HN   ) (resi 34   and name HB2  )  5.00  5.00  0.00 
assi (resi 8    and name HD#  ) (resi 34   and name HN   )  5.00  5.00  0.00 
assi (resi 8    and name HD#  ) (resi 34   and name HA   )  6.00  6.00  0.00 
assi (resi 8    and name HD#  ) (resi 34   and name HB1  )  5.00  5.00  0.00 
assi (resi 8    and name HD#  ) (resi 34   and name HB2  )  5.00  5.00  0.00 
assi (resi 8    and name HE#  ) (resi 34   and name HB1  )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 34   and name HB2  )  5.00  5.00  0.00
assi (resi 8    and name HN   ) (resi 36   and name HB#  )  6.00  6.00  0.00 
assi (resi 8    and name HA   ) (resi 36   and name HB#  )  6.00  6.00  0.00 
assi (resi 8    and name HB1  ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 8    and name HB1  ) (resi 36   and name HA   )  5.00  5.00  0.00 
assi (resi 8    and name HB1  ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 8    and name HB2  ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 8    and name HB2  ) (resi 36   and name HA   )  5.00  5.00  0.00
assi (resi 8    and name HB2  ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 8    and name HD#  ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 8    and name HD#  ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 8    and name HD#  ) (resi 84   and name HZ3  )  5.00  5.00  0.00 
assi (resi 8    and name HE#  ) (resi 84   and name HH2  )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 84   and name HZ2  )  5.00  5.00  0.00 
assi (resi 8    and name HE#  ) (resi 84   and name HZ3  )  6.00  6.00  0.00
assi (resi 8    and name HZ   ) (resi 84   and name HE3  )  5.00  5.00  0.00
assi (resi 8    and name HD#  ) (resi 85   and name HG1# )  6.00  6.00  0.00
assi (resi 8    and name HD#  ) (resi 85   and name HG2# )  6.00  6.00  0.00
assi (resi 8    and name HE#  ) (resi 85   and name HA   )  5.00  5.00  0.00 
assi (resi 8    and name HE#  ) (resi 85   and name HG1# )  5.00  5.00  0.00
assi (resi 8    and name HE#  ) (resi 85   and name HG2# )  6.00  6.00  0.00
assi (resi 8    and name HZ   ) (resi 85   and name HA   )  3.50  3.50  0.00
assi (resi 8    and name HZ   ) (resi 85   and name HG1# )  5.00  5.00  0.00
assi (resi 8    and name HZ   ) (resi 85   and name HG2# )  6.00  6.00  0.00
assi (resi 8    and name HE#  ) (resi 88   and name HB1  )  5.00  5.00  0.00 
assi (resi 8    and name HE#  ) (resi 88   and name HB2  )  5.00  5.00  0.00
assi (resi 8    and name HZ   ) (resi 88   and name HN   )  6.00  6.00  0.00 
assi (resi 8    and name HZ   ) (resi 88   and name HB1  )  3.50  3.50  0.00
assi (resi 8    and name HZ   ) (resi 88   and name HB2  )  3.50  3.50  0.00
assi (resi 8    and name HZ   ) (resi 89   and name HN   )  5.00  5.00  0.00
assi (resi 8	and name HZ   ) (resi 89   and name HG2# )  5.00  5.00  0.00 
assi (resi 8    and name HD#  ) (resi 94   and name HA   )  3.50  3.50  0.00
assi (resi 8    and name HE#  ) (resi 94   and name HA   )  5.00  5.00  0.00
assi (resi 8    and name HZ   ) (resi 94   and name HA   )  6.00  6.00  0.00
assi (resi 8    and name HE#  ) (resi 95   and name HN   )  5.00  5.00  0.00
! residue 9    Arg , NOEs forward in sequence
assi (resi 9    and name HN   ) (resi 10   and name HN   )  3.50  3.50  0.00 
assi (resi 9    and name HA   ) (resi 10   and name HN   )  2.50  2.50  0.00
assi (resi 9    and name HB1  ) (resi 10   and name HN   )  5.00  5.00  0.00 
assi (resi 9    and name HB2  ) (resi 10   and name HN   )  5.00  5.00  0.00 
assi (resi 9    and name HG#  ) (resi 10   and name HN   )  5.00  5.00  0.00
assi (resi 9    and name HA   ) (resi 11   and name HN   )  5.00  5.00  0.00 
assi (resi 9    and name HA   ) (resi 35   and name HA2  )  5.00  5.00  0.00 
assi (resi 9    and name HA   ) (resi 36   and name HA   )  6.00  6.00  0.00 
! residue 10   Gly , NOEs forward in sequence
assi (resi 10   and name HN   ) (resi 11   and name HN   )  3.50  3.50  0.00
assi (resi 10   and name HA1  ) (resi 11   and name HN   )  3.50  3.50  0.00
assi (resi 10   and name HA2  ) (resi 11   and name HN   )  3.50  3.50  0.00
assi (resi 10   and name HA1  ) (resi 51   and name HA   )  5.00  5.00  0.00 
assi (resi 10   and name HA2  ) (resi 51   and name HA   )  3.50  3.50  0.00
assi (resi 10   and name HA2  ) (resi 51   and name HG1# )  5.00  5.00  0.00 
assi (resi 10   and name HA2  ) (resi 51   and name HG2# )  5.00  5.00  0.00 
assi (resi 10   and name HA2  ) (resi 52   and name HN   )  6.00  6.00  0.00 
! residue 11   Leu , NOEs forward in sequence
assi (resi 11   and name HN   ) (resi 12   and name HN   )  5.00  5.00  0.00
assi (resi 11   and name HA   ) (resi 12   and name HN   )  2.50  2.50  0.00 
assi (resi 11   and name HB1  ) (resi 12   and name HN   )  5.00  5.00  0.00 
assi (resi 11   and name HB2  ) (resi 12   and name HN   )  5.00  5.00  0.00 
assi (resi 11   and name HD1# ) (resi 12   and name HN   )  5.00  5.00  0.00
assi (resi 11   and name HD1# ) (resi 12   and name HA   )  6.00  6.00  0.00
assi (resi 11   and name HD2# ) (resi 12   and name HN   )  5.00  5.00  0.00
assi (resi 11   and name HB2  ) (resi 13   and name HD1# )  6.00  6.00  0.00
assi (resi 11   and name HD2# ) (resi 13   and name HD1# )  6.00  6.00  0.00
assi (resi 11   and name HN   ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 11   and name HN   ) (resi 36   and name HA   )  3.50  3.50  0.00 
assi (resi 11   and name HN   ) (resi 36   and name HB#  )  6.00  6.00  0.00
assi (resi 11   and name HB1  ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 11   and name HB1  ) (resi 36   and name HA   )  5.00  5.00  0.00
assi (resi 11   and name HB1  ) (resi 36   and name HB#  )  5.00  5.00  0.00 
assi (resi 11   and name HB2  ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 11   and name HB2  ) (resi 36   and name HA   )  5.00  5.00  0.00
assi (resi 11   and name HD1# ) (resi 36   and name HA   )  5.00  5.00  0.00 
assi (resi 11   and name HD2# ) (resi 36   and name HN   )  6.00  6.00  0.00
assi (resi 11   and name HD2# ) (resi 36   and name HA   )  6.00  6.00  0.00 
assi (resi 11   and name HB1  ) (resi 37   and name HN   )  6.00  6.00  0.00 
assi (resi 11   and name HB2  ) (resi 37   and name HN   )  6.00  6.00  0.00 
assi (resi 11   and name HN   ) (resi 52   and name HN   )  6.00  6.00  0.00 
assi (resi 11   and name HA   ) (resi 52   and name HN   )  5.00  5.00  0.00
assi (resi 11   and name HA   ) (resi 52   and name HB1  )  5.00  5.00  0.00
assi (resi 11   and name HA   ) (resi 52   and name HB2  )  5.00  5.00  0.00
assi (resi 11   and name HD1# ) (resi 52   and name HN   )  5.00  5.00  0.00 
assi (resi 11   and name HD1# ) (resi 52   and name HB1  )  5.00  5.00  0.00
assi (resi 11   and name HD1# ) (resi 52   and name HB2  )  5.00  5.00  0.00
assi (resi 11   and name HD2# ) (resi 52   and name HB2  )  6.00  6.00  0.00 
assi (resi 11   and name HB1  ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 11   and name HB2  ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 11   and name HG   ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 11   and name HG   ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 11	and name HD1# ) (resi 54   and name HD1# )  6.00  6.00  0.00 
assi (resi 11   and name HD2# ) (resi 54   and name HB   )  6.00  6.00  0.00 
assi (resi 11   and name HD2# ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 11   and name HD2# ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 11   and name HD1# ) (resi 84   and name HH2  )  6.00  6.00  0.00
assi (resi 11   and name HD1# ) (resi 84   and name HZ2  )  5.00  5.00  0.00
assi (resi 11   and name HD1# ) (resi 84   and name HZ3  )  5.00  5.00  0.00
assi (resi 11   and name HD2# ) (resi 84   and name HH2  )  5.00  5.00  0.00
assi (resi 11   and name HD2# ) (resi 84   and name HZ2  )  5.00  5.00  0.00 
assi (resi 11   and name HD2# ) (resi 84   and name HZ3  )  6.00  6.00  0.00
! residue 12   Glu , NOEs forward in sequence
assi (resi 12   and name HA   ) (resi 13   and name HN   )  2.50  2.50  0.00 
assi (resi 12   and name HA   ) (resi 13   and name HB   )  5.00  5.00  0.00
assi (resi 12   and name HA   ) (resi 13   and name HG11 )  5.00  5.00  0.00
assi (resi 12   and name HB1  ) (resi 13   and name HN   )  5.00  5.00  0.00
assi (resi 12   and name HG#  ) (resi 13   and name HN   )  5.00  5.00  0.00 
assi (resi 12   and name HA   ) (resi 36   and name HB#  )  5.00  5.00  0.00 
assi (resi 12   and name HN   ) (resi 37   and name HN   )  5.00  5.00  0.00
assi (resi 12   and name HA   ) (resi 37   and name HN   )  3.50  3.50  0.00
assi (resi 12   and name HA   ) (resi 37   and name HB1  )  3.50  3.50  0.00
assi (resi 12   and name HA   ) (resi 37   and name HB2  )  3.50  3.50  0.00
assi (resi 12   and name HG#  ) (resi 37   and name HN   )  3.50  3.50  0.00
assi (resi 12	and name HG#  ) (resi 37   and name HA   )  5.00  5.00  0.00 
assi (resi 12	and name HG#  ) (resi 37   and name HB1  )  5.00  5.00  0.00 
assi (resi 12	and name HG#  ) (resi 37   and name HB2  )  5.00  5.00  0.00 
assi (resi 12   and name HA   ) (resi 39   and name HB   )  6.00  6.00  0.00 
assi (resi 12   and name HA   ) (resi 39   and name HG1# )  5.00  5.00  0.00
assi (resi 12   and name HA   ) (resi 39   and name HG2# )  5.00  5.00  0.00
assi (resi 12   and name HB1  ) (resi 39   and name HG2# )  5.00  5.00  0.00
assi (resi 12   and name HB2  ) (resi 39   and name HG2# )  6.00  6.00  0.00
assi (resi 12   and name HG#  ) (resi 39   and name HG1# )  6.00  6.00  0.00
assi (resi 12   and name HG#  ) (resi 39   and name HG2# )  6.00  6.00  0.00
assi (resi 12   and name HB1  ) (resi 45   and name HD#  )  5.00  5.00  0.00 
assi (resi 12   and name HB1  ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 12   and name HB2  ) (resi 45   and name HD#  )  5.00  5.00  0.00 
assi (resi 12   and name HB2  ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 12   and name HG#  ) (resi 45   and name HD#  )  5.00  5.00  0.00 
assi (resi 12   and name HG#  ) (resi 45   and name HE#  )  5.00  5.00  0.00 
assi (resi 12   and name HN   ) (resi 51   and name HG1# )  6.00  6.00  0.00
assi (resi 12   and name HN   ) (resi 52   and name HN   )  5.00  5.00  0.00 
assi (resi 12   and name HN   ) (resi 53   and name HA   )  3.50  3.50  0.00 
assi (resi 12   and name HB1  ) (resi 53   and name HA   )  5.00  5.00  0.00 
assi (resi 12   and name HB2  ) (resi 53   and name HA   )  5.00  5.00  0.00 
assi (resi 12	and name HG#  ) (resi 53   and name HA   )  6.00  6.00  0.00 
! residue 13   Ile , NOEs forward in sequence
assi (resi 13   and name HA   ) (resi 14   and name HN   )  2.50  2.50  0.00 
assi (resi 13   and name HB   ) (resi 14   and name HN   )  5.00  5.00  0.00 
assi (resi 13   and name HB   ) (resi 14   and name HA   )  5.00  5.00  0.00
assi (resi 13   and name HG12 ) (resi 14   and name HN   )  5.00  5.00  0.00
assi (resi 13   and name HG2# ) (resi 14   and name HN   )  5.00  5.00  0.00
assi (resi 13	and name HG2# ) (resi 14   and name HA   )  6.00  6.00  0.00 
assi (resi 13   and name HG2# ) (resi 15   and name HA   )  6.00  6.00  0.00
assi (resi 13	and name HD1# ) (resi 27   and name HD1# )  6.00  6.00  0.00 
assi (resi 13   and name HB   ) (resi 31   and name HB   )  5.00  5.00  0.00 
assi (resi 13   and name HB   ) (resi 31   and name HG1# )  5.00  5.00  0.00 
assi (resi 13   and name HG11 ) (resi 31   and name HB   )  5.00  5.00  0.00 
assi (resi 13   and name HG11 ) (resi 31   and name HG1# )  5.00  5.00  0.00 
assi (resi 13   and name HG2# ) (resi 31   and name HB   )  5.00  5.00  0.00
assi (resi 13   and name HD1# ) (resi 31   and name HA   )  6.00  6.00  0.00
assi (resi 13   and name HD1# ) (resi 31   and name HB   )  5.00  5.00  0.00
assi (resi 13   and name HD1# ) (resi 31   and name HG1# )  5.00  5.00  0.00
assi (resi 13   and name HD1# ) (resi 34   and name HB1  )  6.00  6.00  0.00
assi (resi 13   and name HD1# ) (resi 34   and name HB2  )  6.00  6.00  0.00
assi (resi 13   and name HN   ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 13   and name HG2# ) (resi 36   and name HB#  )  6.00  6.00  0.00 
assi (resi 13   and name HD1# ) (resi 36   and name HN   )  6.00  6.00  0.00 
assi (resi 13   and name HD1# ) (resi 36   and name HA   )  6.00  6.00  0.00
assi (resi 13   and name HD1# ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 13   and name HN   ) (resi 37   and name HN   )  5.00  5.00  0.00
assi (resi 13   and name HB   ) (resi 37   and name HN   )  6.00  6.00  0.00 
assi (resi 13   and name HG11 ) (resi 37   and name HN   )  5.00  5.00  0.00 
assi (resi 13   and name HD1# ) (resi 37   and name HN   )  6.00  6.00  0.00 
assi (resi 13   and name HB   ) (resi 38   and name HA   )  5.00  5.00  0.00
assi (resi 13   and name HN   ) (resi 39   and name HN   )  5.00  5.00  0.00 
assi (resi 13   and name HN   ) (resi 39   and name HG1# )  6.00  6.00  0.00
assi (resi 13   and name HN   ) (resi 39   and name HG2# )  6.00  6.00  0.00
assi (resi 13   and name HA   ) (resi 39   and name HG2# )  6.00  6.00  0.00 
assi (resi 13   and name HA   ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 13   and name HA   ) (resi 45   and name HZ   )  6.00  6.00  0.00
assi (resi 13   and name HB   ) (resi 45   and name HE#  )  6.00  6.00  0.00 
assi (resi 13   and name HG11 ) (resi 45   and name HE#  )  5.00  5.00  0.00 
assi (resi 13   and name HN   ) (resi 54   and name HN   )  5.00  5.00  0.00 
assi (resi 13   and name HA   ) (resi 54   and name HN   )  3.50  3.50  0.00
assi (resi 13   and name HA   ) (resi 54   and name HA   )  6.00  6.00  0.00 
assi (resi 13   and name HA   ) (resi 54   and name HB   )  5.00  5.00  0.00 
assi (resi 13   and name HA   ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 13   and name HA   ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 13   and name HB   ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 13   and name HG11 ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 13   and name HG11 ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 13   and name HG12 ) (resi 54   and name HG2# )  5.00  5.00  0.00
assi (resi 13   and name HG12 ) (resi 54   and name HD1# )  5.00  5.00  0.00
assi (resi 13   and name HG2# ) (resi 54   and name HB   )  5.00  5.00  0.00
assi (resi 13   and name HG2# ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 13   and name HG2# ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 13   and name HD1# ) (resi 54   and name HB   )  6.00  6.00  0.00
assi (resi 13   and name HD1# ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 13   and name HD1# ) (resi 54   and name HD1# )  6.00  6.00  0.00
assi (resi 13   and name HA   ) (resi 55   and name HA   )  6.00  6.00  0.00
assi (resi 13   and name HG2# ) (resi 55   and name HA   )  6.00  6.00  0.00
assi (resi 13   and name HA   ) (resi 56   and name HN   )  6.00  6.00  0.00 
assi (resi 13   and name HG2# ) (resi 56   and name HN   )  6.00  6.00  0.00 
assi (resi 13   and name HG2# ) (resi 56   and name HA   )  6.00  6.00  0.00
assi (resi 13   and name HG2# ) (resi 56   and name HB   )  5.00  5.00  0.00
assi (resi 13   and name HG2# ) (resi 56   and name HG1# )  6.00  6.00  0.00
assi (resi 13	and name HD1# ) (resi 56   and name HG1# )  6.00  6.00  0.00 
assi (resi 13   and name HG12 ) (resi 84   and name HH2  )  5.00  5.00  0.00
assi (resi 13   and name HG12 ) (resi 84   and name HZ3  )  3.50  3.50  0.00
assi (resi 13   and name HG2# ) (resi 84   and name HZ3  )  5.00  5.00  0.00
assi (resi 13   and name HD1# ) (resi 84   and name HH2  )  5.00  5.00  0.00
assi (resi 13   and name HD1# ) (resi 84   and name HZ3  )  5.00  5.00  0.00
! residue 14   Cys , NOEs forward in sequence
assi (resi 14   and name HA   ) (resi 15   and name HN   )  2.50  2.50  0.00
assi (resi 14   and name HB2  ) (resi 15   and name HN   )  5.00  5.00  0.00
assi (resi 14   and name HN   ) (resi 39   and name HB   )  6.00  6.00  0.00 
assi (resi 14   and name HN   ) (resi 39   and name HG1# )  5.00  5.00  0.00
assi (resi 14   and name HN   ) (resi 39   and name HG2# )  6.00  6.00  0.00
assi (resi 14   and name HA   ) (resi 39   and name HN   )  3.50  3.50  0.00
assi (resi 14   and name HA   ) (resi 39   and name HB   )  5.00  5.00  0.00 
assi (resi 14   and name HA   ) (resi 39   and name HG1# )  6.00  6.00  0.00 
assi (resi 14   and name HA   ) (resi 39   and name HG2# )  6.00  6.00  0.00 
assi (resi 14   and name HB1  ) (resi 39   and name HN   )  3.50  3.50  0.00
assi (resi 14   and name HB1  ) (resi 39   and name HB   )  5.00  5.00  0.00
assi (resi 14   and name HB1  ) (resi 39   and name HG1# )  6.00  6.00  0.00
assi (resi 14   and name HB1  ) (resi 39   and name HG2# )  6.00  6.00  0.00
assi (resi 14   and name HB2  ) (resi 39   and name HN   )  5.00  5.00  0.00
assi (resi 14   and name HB2  ) (resi 39   and name HB   )  5.00  5.00  0.00 
assi (resi 14   and name HB2  ) (resi 39   and name HG1# )  5.00  5.00  0.00
assi (resi 14   and name HB2  ) (resi 39   and name HG2# )  5.00  5.00  0.00
assi (resi 14   and name HB1  ) (resi 42   and name HD2# )  5.00  5.00  0.00 
assi (resi 14   and name HB2  ) (resi 42   and name HD2# )  5.00  5.00  0.00 
assi (resi 14   and name HN   ) (resi 45   and name HE#  )  5.00  5.00  0.00 
assi (resi 14   and name HN   ) (resi 45   and name HZ   )  5.00  5.00  0.00 
assi (resi 14	and name HA   ) (resi 45   and name HE#  )  6.00  6.00  0.00 
assi (resi 14   and name HA   ) (resi 45   and name HZ   )  6.00  6.00  0.00 
assi (resi 14   and name HB1  ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 14   and name HB1  ) (resi 45   and name HZ   )  5.00  5.00  0.00 
assi (resi 14   and name HB2  ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 14   and name HB2  ) (resi 45   and name HZ   )  5.00  5.00  0.00 
assi (resi 14   and name HN   ) (resi 54   and name HN   )  5.00  5.00  0.00 
assi (resi 14   and name HN   ) (resi 54   and name HB   )  6.00  6.00  0.00 
assi (resi 14   and name HN   ) (resi 54   and name HG2# )  6.00  6.00  0.00
assi (resi 14   and name HN   ) (resi 55   and name HN   )  5.00  5.00  0.00 
assi (resi 14   and name HN   ) (resi 55   and name HA   )  3.50  3.50  0.00
assi (resi 14   and name HN   ) (resi 55   and name HG1# )  6.00  6.00  0.00 
assi (resi 14   and name HA   ) (resi 55   and name HA   )  5.00  5.00  0.00 
assi (resi 14   and name HB1  ) (resi 55   and name HA   )  5.00  5.00  0.00
assi (resi 14   and name HB1  ) (resi 55   and name HG1# )  5.00  5.00  0.00
assi (resi 14   and name HB1  ) (resi 55   and name HG2# )  5.00  5.00  0.00
assi (resi 14   and name HB2  ) (resi 55   and name HA   )  5.00  5.00  0.00
assi (resi 14   and name HB2  ) (resi 55   and name HG1# )  5.00  5.00  0.00
assi (resi 14   and name HB2  ) (resi 55   and name HG2# )  5.00  5.00  0.00
assi (resi 14   and name HN   ) (resi 56   and name HN   )  5.00  5.00  0.00
assi (resi 14   and name HA   ) (resi 56   and name HN   )  5.00  5.00  0.00
! residue 15   Cys , NOEs forward in sequence
assi (resi 15   and name HN   ) (resi 16   and name HA   )  5.00  5.00  0.00 
assi (resi 15   and name HA   ) (resi 16   and name HN   )  2.50  2.50  0.00 
assi (resi 15   and name HA   ) (resi 16   and name HB2  )  6.00  6.00  0.00 
assi (resi 15   and name HB1  ) (resi 16   and name HN   )  6.00  6.00  0.00 
assi (resi 15   and name HB2  ) (resi 16   and name HN   )  6.00  6.00  0.00 
assi (resi 15   and name HA   ) (resi 19   and name HE#  )  5.00  5.00  0.00
assi (resi 15   and name HA   ) (resi 19   and name HZ   )  5.00  5.00  0.00
assi (resi 15   and name HB1  ) (resi 19   and name HE#  )  5.00  5.00  0.00
assi (resi 15   and name HB1  ) (resi 19   and name HZ   )  5.00  5.00  0.00
assi (resi 15   and name HB2  ) (resi 19   and name HE#  )  5.00  5.00  0.00 
assi (resi 15   and name HB2  ) (resi 19   and name HZ   )  5.00  5.00  0.00 
assi (resi 15   and name HN   ) (resi 24   and name HG2# )  6.00  6.00  0.00 
assi (resi 15   and name HA   ) (resi 24   and name HG2# )  6.00  6.00  0.00 
assi (resi 15   and name HB1  ) (resi 24   and name HG2# )  5.00  5.00  0.00
assi (resi 15   and name HB2  ) (resi 24   and name HG2# )  5.00  5.00  0.00
assi (resi 15   and name HB1  ) (resi 27   and name HG   )  5.00  5.00  0.00
assi (resi 15   and name HB2  ) (resi 27   and name HG   )  5.00  5.00  0.00 
assi (resi 15   and name HB2  ) (resi 27   and name HD1# )  6.00  6.00  0.00
assi (resi 15   and name HB2  ) (resi 27   and name HD2# )  6.00  6.00  0.00
assi (resi 15   and name HN   ) (resi 42   and name HD2# )  6.00  6.00  0.00 
assi (resi 15   and name HA   ) (resi 55   and name HG1# )  5.00  5.00  0.00
assi (resi 15   and name HA   ) (resi 56   and name HN   )  3.50  3.50  0.00
assi (resi 15   and name HA   ) (resi 56   and name HB   )  3.50  3.50  0.00 
assi (resi 15   and name HA   ) (resi 56   and name HG1# )  5.00  5.00  0.00
assi (resi 15   and name HA   ) (resi 56   and name HG2# )  5.00  5.00  0.00 
! residue 16   Tyr , NOEs forward in sequence
assi (resi 16   and name HA   ) (resi 17   and name HN   )  2.50  2.50  0.00 
assi (resi 16   and name HB1  ) (resi 17   and name HN   )  5.00  5.00  0.00 
assi (resi 16   and name HB2  ) (resi 17   and name HN   )  6.00  6.00  0.00 
assi (resi 16   and name HD#  ) (resi 17   and name HN   )  5.00  5.00  0.00 
assi (resi 16	and name HN   ) (resi 19   and name HE#  )  6.00  6.00  0.00 
assi (resi 16   and name HN   ) (resi 19   and name HZ   )  5.00  5.00  0.00 
assi (resi 16   and name HB2  ) (resi 42   and name HD2# )  5.00  5.00  0.00 
assi (resi 16	and name HD#  ) (resi 42   and name HG   )  5.00  5.00  0.00 
assi (resi 16   and name HD#  ) (resi 42   and name HD1# )  5.00  5.00  0.00 
assi (resi 16   and name HD#  ) (resi 42   and name HD2# )  5.00  5.00  0.00 
assi (resi 16	and name HE#  ) (resi 42   and name HG   )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 42   and name HD1# )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 42   and name HD2# )  5.00  5.00  0.00 
assi (resi 16   and name HN   ) (resi 55   and name HG1# )  5.00  5.00  0.00 
assi (resi 16	and name HN   ) (resi 55   and name HG2# )  6.00  6.00  0.00 
assi (resi 16   and name HA   ) (resi 55   and name HG1# )  6.00  6.00  0.00 
assi (resi 16   and name HB1  ) (resi 55   and name HG1# )  5.00  5.00  0.00 
assi (resi 16   and name HB2  ) (resi 55   and name HG1# )  5.00  5.00  0.00 
assi (resi 16   and name HD#  ) (resi 55   and name HG1# )  5.00  5.00  0.00 
assi (resi 16	and name HD#  ) (resi 55   and name HG2# )  6.00  6.00  0.00 
assi (resi 16	and name HE#  ) (resi 55   and name HG1# )  6.00  6.00  0.00 
assi (resi 16   and name HN   ) (resi 56   and name HN   )  3.50  3.50  0.00 
assi (resi 16   and name HN   ) (resi 56   and name HB   )  5.00  5.00  0.00 
assi (resi 16	and name HN   ) (resi 56   and name HG1# )  6.00  6.00  0.00 
assi (resi 16   and name HN   ) (resi 56   and name HG2# )  6.00  6.00  0.00 
assi (resi 16   and name HN   ) (resi 57   and name HG1# )  5.00  5.00  0.00 
assi (resi 16   and name HB2  ) (resi 57   and name HG1# )  6.00  6.00  0.00 
assi (resi 16   and name HD#  ) (resi 57   and name HG1# )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 57   and name HG1# )  6.00  6.00  0.00 
assi (resi 16   and name HD#  ) (resi 62   and name HZ2  )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 62   and name HH2  )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 62   and name HZ2  )  5.00  5.00  0.00 
assi (resi 16   and name HB2  ) (resi 71   and name HD1# )  6.00  6.00  0.00 
assi (resi 16   and name HD#  ) (resi 71   and name HG2# )  5.00  5.00  0.00 
assi (resi 16   and name HD#  ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 71   and name HG2# )  6.00  6.00  0.00 
assi (resi 16   and name HE#  ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 16   and name HE#  ) (resi 74   and name HE#  )  6.00  6.00  0.00 
! residue 17   Gly , NOEs forward in sequence
assi (resi 17   and name HN   ) (resi 18   and name HD2  )  5.00  5.00  0.00
assi (resi 17   and name HA1  ) (resi 18   and name HD1  )  3.50  3.50  0.00
assi (resi 17   and name HA1  ) (resi 18   and name HD2  )  3.50  3.50  0.00
assi (resi 17   and name HA2  ) (resi 18   and name HD2  )  3.50  3.50  0.00 
! residue 18   Pro , NOEs forward in sequence
assi (resi 18   and name HA   ) (resi 19   and name HN   )  3.50  3.50  0.00
assi (resi 18   and name HB1  ) (resi 19   and name HN   )  5.00  5.00  0.00 
assi (resi 18   and name HB2  ) (resi 19   and name HN   )  5.00  5.00  0.00 
assi (resi 18   and name HA   ) (resi 24   and name HG2# )  5.00  5.00  0.00 
assi (resi 18   and name HD2  ) (resi 24   and name HG2# )  6.00  6.00  0.00 
assi (resi 18   and name HA   ) (resi 61   and name HB#  )  5.00  5.00  0.00 
assi (resi 18   and name HB1  ) (resi 61   and name HB#  )  5.00  5.00  0.00 
assi (resi 18   and name HG2  ) (resi 61   and name HA   )  6.00  6.00  0.00 
assi (resi 18   and name HD2  ) (resi 61   and name HB#  )  5.00  5.00  0.00 
assi (resi 18   and name HG1  ) (resi 62   and name HA   )  5.00  5.00  0.00 
assi (resi 18   and name HG2  ) (resi 62   and name HA   )  5.00  5.00  0.00
! residue 19   Phe , NOEs forward in sequence
assi (resi 19   and name HN   ) (resi 20   and name HG2# )  6.00  6.00  0.00
assi (resi 19   and name HA   ) (resi 20   and name HN   )  3.50  3.50  0.00
assi (resi 19   and name HB1  ) (resi 20   and name HN   )  5.00  5.00  0.00
assi (resi 19   and name HB2  ) (resi 20   and name HN   )  5.00  5.00  0.00
assi (resi 19	and name HD#  ) (resi 24   and name HG2#  )  6.00  6.00  0.00
assi (resi 19	and name HE#  ) (resi 24   and name HG2#  )  6.00  6.00  0.00
assi (resi 19	and name HZ   ) (resi 24   and name HG2#  )  6.00  6.00  0.00
assi (resi 19   and name HD#  ) (resi 27   and name HD1# )  6.00  6.00  0.00
assi (resi 19   and name HD#  ) (resi 27   and name HD2# )  6.00  6.00  0.00
assi (resi 19   and name HE#  ) (resi 27   and name HD1# )  6.00  6.00  0.00
assi (resi 19   and name HE#  ) (resi 27   and name HD2# )  6.00  6.00  0.00
assi (resi 19   and name HZ   ) (resi 27   and name HD1# )  6.00  6.00  0.00
assi (resi 19   and name HZ   ) (resi 27   and name HD2# )  6.00  6.00  0.00
assi (resi 19   and name HE#  ) (resi 56   and name HN   )  6.00  6.00  0.00 
assi (resi 19   and name HE#  ) (resi 56   and name HB   )  5.00  5.00  0.00
assi (resi 19   and name HE#  ) (resi 56   and name HG1# )  6.00  6.00  0.00 
assi (resi 19   and name HZ   ) (resi 56   and name HN   )  5.00  5.00  0.00
assi (resi 19   and name HZ   ) (resi 56   and name HB   )  5.00  5.00  0.00 
assi (resi 19   and name HZ   ) (resi 56   and name HG1# )  5.00  5.00  0.00
assi (resi 19   and name HZ   ) (resi 56   and name HG2# )  6.00  6.00  0.00
assi (resi 19   and name HE#  ) (resi 57   and name HA   )  5.00  5.00  0.00
assi (resi 19   and name HZ   ) (resi 57   and name HA   )  5.00  5.00  0.00 
assi (resi 19   and name HZ   ) (resi 57   and name HG1# )  6.00  6.00  0.00
assi (resi 19   and name HZ   ) (resi 57   and name HG2# )  6.00  6.00  0.00
assi (resi 19   and name HZ   ) (resi 58   and name HN   )  6.00  6.00  0.00 
assi (resi 19   and name HN   ) (resi 61   and name HB#  )  6.00  6.00  0.00
assi (resi 19   and name HA   ) (resi 61   and name HB#  )  5.00  5.00  0.00
assi (resi 19   and name HN   ) (resi 62   and name HA   )  6.00  6.00  0.00 
assi (resi 19   and name HD#  ) (resi 82   and name HB1  )  5.00  5.00  0.00
assi (resi 19   and name HD#  ) (resi 82   and name HB2  )  5.00  5.00  0.00
assi (resi 19   and name HD#  ) (resi 82   and name HG1  )  3.50  3.50  0.00 
assi (resi 19   and name HD#  ) (resi 82   and name HG2  )  5.00  5.00  0.00 
assi (resi 19   and name HD#  ) (resi 82   and name HD1  )  5.00  5.00  0.00
assi (resi 19   and name HD#  ) (resi 82   and name HD2  )  5.00  5.00  0.00
assi (resi 19   and name HE#  ) (resi 82   and name HB1  )  5.00  5.00  0.00
assi (resi 19   and name HE#  ) (resi 82   and name HB2  )  5.00  5.00  0.00 
assi (resi 19   and name HE#  ) (resi 82   and name HG1  )  6.00  6.00  0.00 
assi (resi 19   and name HE#  ) (resi 82   and name HG2  )  6.00  6.00  0.00 
assi (resi 19   and name HE#  ) (resi 82   and name HD1  )  6.00  6.00  0.00
assi (resi 19   and name HE#  ) (resi 82   and name HD2  )  5.00  5.00  0.00
! residue 20   Thr , NOEs forward in sequence
assi (resi 20   and name HN   ) (resi 58   and name HE22 )  6.00  6.00  0.00
assi (resi 20   and name HG2# ) (resi 58   and name HE21 )  6.00  6.00  0.00
assi (resi 20   and name HG2# ) (resi 58   and name HE22 )  6.00  6.00  0.00 
assi (resi 20   and name HN   ) (resi 61   and name HN   )  6.00  6.00  0.00 
assi (resi 20   and name HN   ) (resi 61   and name HB#  )  6.00  6.00  0.00
assi (resi 20   and name HA   ) (resi 61   and name HB#  )  6.00  6.00  0.00 
! residue 21   Asn , NOEs forward in sequence
! residue 22   Met , NOEs forward in sequence
assi (resi 22   and name HA   ) (resi 23   and name HD1  )  5.00  5.00  0.00 
assi (resi 22   and name HA   ) (resi 23   and name HD2  )  5.00  5.00  0.00 
assi (resi 22   and name HN   ) (resi 24   and name HN   )  5.00  5.00  0.00 
! residue 23   Pro , NOEs forward in sequence
! residue 24   Thr , NOEs forward in sequence
assi (resi 24   and name HA   ) (resi 25   and name HN   )  5.00  5.00  0.00
assi (resi 24   and name HB   ) (resi 25   and name HN   )  3.50  3.50  0.00 
assi (resi 24	and name HB   ) (resi 25   and name HA   )  6.00  6.00  0.00 
assi (resi 24   and name HG2# ) (resi 25   and name HN   )  5.00  5.00  0.00 
assi (resi 24   and name HG2# ) (resi 25   and name HA   )  5.00  5.00  0.00
assi (resi 24   and name HA   ) (resi 27   and name HN   )  5.00  5.00  0.00
assi (resi 24   and name HA   ) (resi 27   and name HB1  )  5.00  5.00  0.00
assi (resi 24   and name HA   ) (resi 27   and name HB2  )  5.00  5.00  0.00
assi (resi 24   and name HG2# ) (resi 28   and name HN   )  6.00  6.00  0.00
! residue 25   Asp , NOEs forward in sequence
assi (resi 25   and name HN   ) (resi 26   and name HN   )  3.50  3.50  0.00
assi (resi 25   and name HN   ) (resi 26   and name HB1  )  5.00  5.00  0.00 
assi (resi 25   and name HN   ) (resi 26   and name HB2  )  5.00  5.00  0.00 
assi (resi 25   and name HN   ) (resi 26   and name HG1  )  6.00  6.00  0.00 
assi (resi 25   and name HA   ) (resi 26   and name HN   )  5.00  5.00  0.00
assi (resi 25   and name HB1  ) (resi 26   and name HN   )  6.00  6.00  0.00 
assi (resi 25   and name HA   ) (resi 28   and name HN   )  3.50  3.50  0.00
! residue 26   Gln , NOEs forward in sequence
assi (resi 26   and name HN   ) (resi 27   and name HN   )  3.50  3.50  0.00 
assi (resi 26   and name HA   ) (resi 27   and name HN   )  3.50  3.50  0.00 
assi (resi 26   and name HB1  ) (resi 27   and name HN   )  5.00  5.00  0.00 
assi (resi 26   and name HB2  ) (resi 27   and name HN   )  5.00  5.00  0.00 
assi (resi 26   and name HA   ) (resi 29   and name HN   )  3.50  3.50  0.00 
assi (resi 26   and name HA   ) (resi 29   and name HB#  )  3.50  3.50  0.00
! residue 27   Leu , NOEs forward in sequence
assi (resi 27   and name HN   ) (resi 28   and name HN   )  3.50  3.50  0.00
assi (resi 27   and name HB1  ) (resi 28   and name HN   )  3.50  3.50  0.00 
assi (resi 27   and name HB2  ) (resi 28   and name HN   )  5.00  5.00  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HN   )  3.50  3.50  0.00
assi (resi 27   and name HA   ) (resi 30   and name HB1  )  5.00  5.00  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HB1  )  5.00  5.00  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HB2  )  3.50  3.50  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HB2  )  5.00  5.00  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HG1  )  6.00  6.00  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HG2  )  6.00  6.00  0.00 
assi (resi 27   and name HA   ) (resi 30   and name HE#  )  3.50  3.50  0.00 
assi (resi 27   and name HB1  ) (resi 30   and name HE#  )  6.00  6.00  0.00 
assi (resi 27   and name HB2  ) (resi 30   and name HE#  )  6.00  6.00  0.00 
assi (resi 27   and name HD1# ) (resi 30   and name HN   )  6.00  6.00  0.00 
assi (resi 27	and name HD1# ) (resi 30   and name HE#  )  6.00  6.00  0.00 
assi (resi 27	and name HD2# ) (resi 30   and name HE#  )  6.00  6.00  0.00 
assi (resi 27	and name HD1# ) (resi 31   and name HN   )  5.00  5.00  0.00 
assi (resi 27   and name HD1# ) (resi 56   and name HG1# )  5.00  5.00  0.00
assi (resi 27   and name HD2# ) (resi 56   and name HB   )  5.00  5.00  0.00 
assi (resi 27   and name HD2# ) (resi 56   and name HG1# )  6.00  6.00  0.00
assi (resi 27   and name HD1# ) (resi 82   and name HA   )  5.00  5.00  0.00 
assi (resi 27   and name HD1# ) (resi 82   and name HB1  )  6.00  6.00  0.00 
assi (resi 27   and name HD1# ) (resi 82   and name HB1  )  5.00  5.00  0.00
assi (resi 27   and name HD1# ) (resi 82   and name HD1  )  6.00  6.00  0.00
assi (resi 27   and name HD1# ) (resi 82   and name HD2  )  6.00  6.00  0.00
assi (resi 27   and name HD2# ) (resi 82   and name HB1  )  6.00  6.00  0.00
assi (resi 27   and name HD2# ) (resi 82   and name HB2  )  6.00  6.00  0.00 
assi (resi 27   and name HD2# ) (resi 82   and name HD1  )  6.00  6.00  0.00
assi (resi 27   and name HD2# ) (resi 82   and name HD2  )  6.00  6.00  0.00
assi (resi 27   and name HD1# ) (resi 85   and name HB   )  5.00  5.00  0.00
assi (resi 27   and name HD2# ) (resi 85   and name HN   )  6.00  6.00  0.00
assi (resi 27	and name HD2# ) (resi 85   and name HB   )  6.00  6.00  0.00 
! residue 28   Glu , NOEs forward in sequence
assi (resi 28   and name HN   ) (resi 29   and name HN   )  3.50  3.50  0.00
assi (resi 28   and name HA   ) (resi 29   and name HN   )  3.50  3.50  0.00
assi (resi 28   and name HB2  ) (resi 29   and name HN   )  5.00  5.00  0.00
assi (resi 28   and name HG2  ) (resi 29   and name HN   )  5.00  5.00  0.00
assi (resi 28   and name HA   ) (resi 31   and name HN   )  3.50  3.50  0.00
assi (resi 28	and name HA   ) (resi 31   and name HG1# )  5.00  5.00  0.00 
assi (resi 28	and name HA   ) (resi 31   and name HG2# )  5.00  5.00  0.00 
assi (resi 28   and name HB1  ) (resi 31   and name HG1# )  5.00  5.00  0.00 
assi (resi 28   and name HB1  ) (resi 38   and name HG1# )  5.00  5.00  0.00 
assi (resi 28   and name HB1  ) (resi 38   and name HG2# )  5.00  5.00  0.00 
assi (resi 28   and name HG1  ) (resi 38   and name HG1# )  5.00  5.00  0.00 
assi (resi 28   and name HG1  ) (resi 38   and name HG2# )  5.00  5.00  0.00 
assi (resi 28   and name HG2  ) (resi 38   and name HG1# )  5.00  5.00  0.00 
assi (resi 28   and name HG2  ) (resi 38   and name HG2# )  5.00  5.00  0.00 
! residue 29   Trp , NOEs forward in sequence
assi (resi 29   and name HA   ) (resi 30   and name HN   )  3.50  3.50  0.00
assi (resi 29   and name HB#  ) (resi 30   and name HN   )  3.50  3.50  0.00
assi (resi 29   and name HD1  ) (resi 30   and name HN   )  5.00  5.00  0.00
assi (resi 29   and name HE3  ) (resi 30   and name HA   )  5.00  5.00  0.00
assi (resi 29   and name HE3  ) (resi 30   and name HB1  )  5.00  5.00  0.00
assi (resi 29   and name HE3  ) (resi 30   and name HB2  )  5.00  5.00  0.00
assi (resi 29   and name HN   ) (resi 31   and name HG1# )  6.00  6.00  0.00 
assi (resi 29   and name HA   ) (resi 32   and name HN   )  3.50  3.50  0.00
assi (resi 29   and name HA   ) (resi 32   and name HB1  )  3.50  3.50  0.00 
assi (resi 29   and name HA   ) (resi 32   and name HB2  )  3.50  3.50  0.00 
assi (resi 29   and name HA   ) (resi 32   and name HG2  )  5.00  5.00  0.00 
assi (resi 29   and name HA   ) (resi 33   and name HD1# )  6.00  6.00  0.00 
assi (resi 29   and name HA   ) (resi 33   and name HD2# )  6.00  6.00  0.00 
assi (resi 29   and name HD1  ) (resi 33   and name HD1# )  6.00  6.00  0.00 
assi (resi 29   and name HD1  ) (resi 33   and name HD2# )  6.00  6.00  0.00
assi (resi 29   and name HE1  ) (resi 33   and name HD1# )  5.00  5.00  0.00
assi (resi 29   and name HE1  ) (resi 33   and name HD2# )  5.00  5.00  0.00
assi (resi 29   and name HE3  ) (resi 33   and name HD2# )  6.00  6.00  0.00
assi (resi 29   and name HZ2  ) (resi 33   and name HD1# )  5.00  5.00  0.00
assi (resi 29   and name HZ2  ) (resi 33   and name HD2# )  6.00  6.00  0.00
! residue 30   Met , NOEs forward in sequence
assi (resi 30   and name HA   ) (resi 31   and name HN   )  5.00  5.00  0.00
assi (resi 30   and name HB1  ) (resi 31   and name HN   )  3.50  3.50  0.00
assi (resi 30   and name HB2  ) (resi 31   and name HN   )  3.50  3.50  0.00
assi (resi 30   and name HA   ) (resi 33   and name HN   )  3.50  3.50  0.00
assi (resi 30   and name HA   ) (resi 33   and name HB1  )  3.50  3.50  0.00
assi (resi 30   and name HA   ) (resi 33   and name HB2  )  3.50  3.50  0.00
assi (resi 30   and name HA   ) (resi 33   and name HG   )  5.00  5.00  0.00
assi (resi 30   and name HA   ) (resi 33   and name HD1# )  5.00  5.00  0.00 
assi (resi 30   and name HA   ) (resi 33   and name HD2# )  5.00  5.00  0.00 
assi (resi 30   and name HB2  ) (resi 33   and name HN   )  6.00  6.00  0.00 
assi (resi 30   and name HA   ) (resi 34   and name HN   )  5.00  5.00  0.00 
assi (resi 30   and name HB1  ) (resi 85   and name HG1# )  5.00  5.00  0.00
assi (resi 30   and name HB2  ) (resi 85   and name HG1# )  5.00  5.00  0.00
assi (resi 30   and name HG1  ) (resi 85   and name HG1# )  6.00  6.00  0.00 
assi (resi 30   and name HG2  ) (resi 85   and name HG1# )  5.00  5.00  0.00 
assi (resi 30   and name HE#  ) (resi 85   and name HG1# )  5.00  5.00  0.00 
assi (resi 30   and name HE#  ) (resi 86   and name HA   )  6.00  6.00  0.00 
assi (resi 30   and name HE#  ) (resi 86   and name HD2# )  5.00  5.00  0.00 
assi (resi 30	and name HB1  ) (resi 89   and name HG2# )  5.00  5.00  0.00 
assi (resi 30	and name HB2  ) (resi 89   and name HG2# )  3.50  3.50  0.00 
assi (resi 30   and name HG1  ) (resi 89   and name HG2# )  6.00  6.00  0.00 
assi (resi 30   and name HG2  ) (resi 89   and name HG2# )  6.00  6.00  0.00 
assi (resi 30	and name HE#  ) (resi 89   and name HG1# )  5.00  5.00  0.00 
assi (resi 30	and name HE#  ) (resi 89   and name HG2# )  5.00  5.00  0.00 
! residue 31   Val , NOEs forward in sequence
assi (resi 31   and name HB   ) (resi 32   and name HN   )  3.50  3.50  0.00
assi (resi 31   and name HA   ) (resi 34   and name HN   )  5.00  5.00  0.00 
assi (resi 31   and name HA   ) (resi 34   and name HB1  )  5.00  5.00  0.00
assi (resi 31   and name HA   ) (resi 34   and name HB2  )  5.00  5.00  0.00
assi (resi 31   and name HA   ) (resi 36   and name HB#  )  5.00  5.00  0.00 
assi (resi 31   and name HB   ) (resi 36   and name HN   )  6.00  6.00  0.00 
assi (resi 31   and name HB   ) (resi 36   and name HA   )  5.00  5.00  0.00
assi (resi 31   and name HB   ) (resi 36   and name HB#  )  3.50  3.50  0.00
assi (resi 31   and name HG1# ) (resi 36   and name HN   )  6.00  6.00  0.00 
assi (resi 31   and name HG1# ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 31   and name HG2# ) (resi 36   and name HN   )  6.00  6.00  0.00 
assi (resi 31   and name HG1# ) (resi 38   and name HB   )  6.00  6.00  0.00
assi (resi 31   and name HG2# ) (resi 84   and name HH2  )  6.00  6.00  0.00
assi (resi 31   and name HG2# ) (resi 84   and name HZ3  )  5.00  5.00  0.00
assi (resi 31   and name HN   ) (resi 85   and name HG1# )  6.00  6.00  0.00
assi (resi 31   and name HN   ) (resi 85   and name HG2# )  6.00  6.00  0.00
! residue 32   Gln , NOEs forward in sequence
assi (resi 32   and name HN   ) (resi 33   and name HN   )  3.50  3.50  0.00
assi (resi 32   and name HB1  ) (resi 33   and name HN   )  3.50  3.50  0.00
assi (resi 32   and name HB2  ) (resi 33   and name HN   )  5.00  5.00  0.00
assi (resi 32   and name HN   ) (resi 34   and name HN   )  5.00  5.00  0.00 
assi (resi 32   and name HA   ) (resi 35   and name HN   )  3.50  3.50  0.00
assi (resi 32   and name HA   ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 32   and name HA   ) (resi 36   and name HB#  )  5.00  5.00  0.00
assi (resi 32   and name HG1  ) (resi 38   and name HB   )  6.00  6.00  0.00 
assi (resi 32   and name HG1  ) (resi 38   and name HG1# )  5.00  5.00  0.00 
assi (resi 32   and name HG1  ) (resi 38   and name HG2# )  5.00  5.00  0.00 
assi (resi 32   and name HG2  ) (resi 38   and name HG1# )  5.00  5.00  0.00 
assi (resi 32   and name HE21 ) (resi 38   and name HG1# )  6.00  6.00  0.00 
assi (resi 32   and name HE21 ) (resi 38   and name HG2# )  6.00  6.00  0.00 
assi (resi 32   and name HE22 ) (resi 38   and name HG1# )  6.00  6.00  0.00 
assi (resi 32   and name HE22 ) (resi 38   and name HG2# )  6.00  6.00  0.00 
! residue 33   Leu , NOEs forward in sequence
assi (resi 33   and name HN   ) (resi 34   and name HN   )  3.50  3.50  0.00
assi (resi 33   and name HA   ) (resi 34   and name HN   )  5.00  5.00  0.00
assi (resi 33   and name HB1  ) (resi 34   and name HN   )  5.00  5.00  0.00
assi (resi 33   and name HB2  ) (resi 34   and name HN   )  5.00  5.00  0.00
assi (resi 33   and name HD1# ) (resi 34   and name HN   )  5.00  5.00  0.00
assi (resi 33   and name HD2# ) (resi 34   and name HN   )  5.00  5.00  0.00 
! residue 34   Cys , NOEs forward in sequence
assi (resi 34   and name HN   ) (resi 35   and name HN   )  3.50  3.50  0.00
assi (resi 34   and name HA   ) (resi 35   and name HN   )  3.50  3.50  0.00 
assi (resi 34   and name HN   ) (resi 36   and name HN   )  5.00  5.00  0.00 
! residue 35   Gly , NOEs forward in sequence
assi (resi 35   and name HN   ) (resi 36   and name HN   )  5.00  5.00  0.00 
assi (resi 35   and name HN   ) (resi 36   and name HB#  )  6.00  6.00  0.00 
assi (resi 35   and name HA1  ) (resi 36   and name HN   )  3.50  3.50  0.00
assi (resi 35   and name HA2  ) (resi 36   and name HN   )  5.00  5.00  0.00
! residue 36   Ala , NOEs forward in sequence
assi (resi 36   and name HA   ) (resi 37   and name HN   )  2.50  2.50  0.00
assi (resi 36   and name HB#  ) (resi 37   and name HN   )  5.00  5.00  0.00 
assi (resi 36   and name HB#  ) (resi 84   and name HZ3  )  6.00  6.00  0.00
! residue 37   Ser , NOEs forward in sequence
assi (resi 37   and name HA   ) (resi 38   and name HN   )  2.50  2.50  0.00
assi (resi 37   and name HB1  ) (resi 38   and name HN   )  5.00  5.00  0.00 
assi (resi 37   and name HB2  ) (resi 38   and name HN   )  6.00  6.00  0.00 
! residue 38   Val , NOEs forward in sequence
assi (resi 38   and name HN   ) (resi 39   and name HN   )  5.00  5.00  0.00 
assi (resi 38   and name HA   ) (resi 39   and name HN   )  3.50  3.50  0.00 
assi (resi 38   and name HA   ) (resi 39   and name HG1# )  6.00  6.00  0.00
assi (resi 38   and name HA   ) (resi 39   and name HG2# )  6.00  6.00  0.00
assi (resi 38   and name HB   ) (resi 39   and name HN   )  5.00  5.00  0.00 
assi (resi 38   and name HG1# ) (resi 39   and name HN   )  6.00  6.00  0.00
assi (resi 38   and name HG2# ) (resi 39   and name HN   )  6.00  6.00  0.00
! residue 39   Val , NOEs forward in sequence
assi (resi 39   and name HN   ) (resi 40   and name HN   )  5.00  5.00  0.00
assi (resi 39   and name HA   ) (resi 40   and name HN   )  3.50  3.50  0.00 
assi (resi 39	and name HB   ) (resi 40   and name HN   )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 40   and name HN   )  5.00  5.00  0.00
assi (resi 39   and name HG1# ) (resi 40   and name HD2  )  6.00  6.00  0.00 
assi (resi 39   and name HG2# ) (resi 40   and name HN   )  5.00  5.00  0.00
assi (resi 39	and name HA   ) (resi 41   and name HN   )  5.00  5.00  0.00 
assi (resi 39   and name HB   ) (resi 41   and name HN   )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 41   and name HN   )  5.00  5.00  0.00 
assi (resi 39   and name HG2# ) (resi 41   and name HN   )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 42   and name HA   )  6.00  6.00  0.00
assi (resi 39   and name HB   ) (resi 44   and name HB1  )  5.00  5.00  0.00 
assi (resi 39   and name HB   ) (resi 44   and name HB2  )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 44   and name HN   )  6.00  6.00  0.00
assi (resi 39   and name HG1# ) (resi 44   and name HB1  )  5.00  5.00  0.00
assi (resi 39   and name HG1# ) (resi 44   and name HB2  )  5.00  5.00  0.00
assi (resi 39   and name HG2# ) (resi 44   and name HB1  )  6.00  6.00  0.00 
assi (resi 39   and name HG2# ) (resi 44   and name HB2  )  5.00  5.00  0.00 
assi (resi 39   and name HB   ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 39	and name HG1# ) (resi 45   and name HN   )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 45   and name HA   )  6.00  6.00  0.00 
assi (resi 39   and name HG1# ) (resi 45   and name HD#  )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 45   and name HE#  )  5.00  5.00  0.00 
assi (resi 39   and name HG1# ) (resi 45   and name HZ   )  6.00  6.00  0.00
assi (resi 39	and name HG2# ) (resi 45   and name HN   )  6.00  6.00  0.00 
assi (resi 39   and name HG2# ) (resi 45   and name HA   )  6.00  6.00  0.00 
assi (resi 39   and name HG2# ) (resi 45   and name HD#  )  5.00  5.00  0.00
assi (resi 39   and name HG2# ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 39   and name HG2# ) (resi 45   and name HZ   )  6.00  6.00  0.00
assi (resi 39   and name HG1# ) (resi 46   and name HN   )  6.00  6.00  0.00
! residue 40   Lys , NOEs forward in sequence
assi (resi 40   and name HN   ) (resi 41   and name HN   )  3.50  3.50  0.00
assi (resi 40   and name HA   ) (resi 41   and name HN   )  3.50  3.50  0.00
assi (resi 40   and name HB1  ) (resi 41   and name HN   )  5.00  5.00  0.00 
assi (resi 40   and name HB2  ) (resi 41   and name HN   )  5.00  5.00  0.00 
assi (resi 40   and name HG1  ) (resi 41   and name HN   )  5.00  5.00  0.00
assi (resi 40	and name HN   ) (resi 44   and name HB1  )  6.00  6.00  0.00 
assi (resi 40	and name HN   ) (resi 44   and name HB2  )  5.00  5.00  0.00 
! residue 41   Glu , NOEs forward in sequence
assi (resi 41	and name HN   ) (resi 42   and name HN   )  5.00  5.00  0.00 
assi (resi 41	and name HA   ) (resi 42   and name HN   )  3.50  3.50  0.00 
assi (resi 41	and name HB1  ) (resi 42   and name HN   )  5.00  5.00  0.00 
assi (resi 41	and name HB2  ) (resi 42   and name HN   )  3.50  3.50  0.00 
assi (resi 41   and name HA   ) (resi 43   and name HN   )  6.00  6.00  0.00 
assi (resi 41   and name HB1  ) (resi 43   and name HN   )  5.00  5.00  0.00
assi (resi 41	and name HB1  ) (resi 43   and name HA   )  6.00  6.00  0.00 
assi (resi 41   and name HB2  ) (resi 43   and name HN   )  5.00  5.00  0.00 
assi (resi 41   and name HN   ) (resi 44   and name HB1  )  6.00  6.00  0.00 
assi (resi 41   and name HN   ) (resi 44   and name HB2  )  5.00  5.00  0.00
assi (resi 41   and name HA   ) (resi 44   and name HN   )  5.00  5.00  0.00 
assi (resi 41   and name HB1  ) (resi 44   and name HN   )  5.00  5.00  0.00
assi (resi 41	and name HB1  ) (resi 44   and name HB1  )  6.00  6.00  0.00 
assi (resi 41   and name HB2  ) (resi 44   and name HN   )  5.00  5.00  0.00 
assi (resi 41	and name HB2  ) (resi 44   and name HB1  )  6.00  6.00  0.00 
assi (resi 41	and name HB2  ) (resi 44   and name HB2  )  5.00  5.00  0.00 
! residue 42   Leu , NOEs forward in sequence
assi (resi 42   and name HN   ) (resi 43   and name HN   )  5.00  5.00  0.00 
assi (resi 42   and name HA   ) (resi 43   and name HN   )  5.00  5.00  0.00
assi (resi 42   and name HB1  ) (resi 43   and name HN   )  5.00  5.00  0.00 
assi (resi 42   and name HB2  ) (resi 43   and name HN   )  5.00  5.00  0.00
assi (resi 42   and name HA   ) (resi 44   and name HN   )  6.00  6.00  0.00 
assi (resi 42   and name HA   ) (resi 45   and name HD#  )  6.00  6.00  0.00
assi (resi 42   and name HA   ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 42   and name HA   ) (resi 45   and name HZ   )  6.00  6.00  0.00
assi (resi 42   and name HD2# ) (resi 45   and name HD#  )  6.00  6.00  0.00
assi (resi 42   and name HD2# ) (resi 45   and name HE#  )  5.00  5.00  0.00
assi (resi 42   and name HD2# ) (resi 45   and name HZ   )  6.00  6.00  0.00
assi (resi 42   and name HD1# ) (resi 55   and name HG1# )  6.00  6.00  0.00
assi (resi 42	and name HD1# ) (resi 55   and name HG2# )  6.00  6.00  0.00 
assi (resi 42   and name HD2# ) (resi 55   and name HA   )  6.00  6.00  0.00 
assi (resi 42	and name HD2# ) (resi 55   and name HG1# )  6.00  6.00  0.00 
assi (resi 42	and name HD2# ) (resi 55   and name HG2# )  6.00  6.00  0.00 
assi (resi 42   and name HD1# ) (resi 71   and name HA   )  6.00  6.00  0.00 
assi (resi 42   and name HD1# ) (resi 71   and name HG2# )  5.00  5.00  0.00 
assi (resi 42   and name HD1# ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 42   and name HD1# ) (resi 74   and name HN   )  6.00  6.00  0.00 
assi (resi 42   and name HD1# ) (resi 74   and name HB1  )  5.00  5.00  0.00 
assi (resi 42   and name HD1# ) (resi 74   and name HB2  )  5.00  5.00  0.00 
assi (resi 42   and name HD1# ) (resi 74   and name HG#  )  5.00  5.00  0.00 
assi (resi 42   and name HD1# ) (resi 74   and name HE#  )  5.00  5.00  0.00 
assi (resi 42   and name HD2# ) (resi 74   and name HE#  )  5.00  5.00  0.00 
assi (resi 42   and name HB2  ) (resi 75   and name HB1  )  6.00  6.00  0.00 
assi (resi 42	and name HD1# ) (resi 75   and name HN   )  6.00  6.00  0.00 
assi (resi 42   and name HD1# ) (resi 75   and name HB1  )  6.00  6.00  0.00
assi (resi 42   and name HD1# ) (resi 75   and name HB2  )  5.00  5.00  0.00
assi (resi 42   and name HD2# ) (resi 75   and name HB1  )  6.00  6.00  0.00 
assi (resi 42   and name HD2# ) (resi 75   and name HB2  )  6.00  6.00  0.00 
! residue 43   Ser , NOEs forward in sequence
assi (resi 43   and name HA   ) (resi 44   and name HN   )  3.50  3.50  0.00
assi (resi 43   and name HB1  ) (resi 44   and name HN   )  5.00  5.00  0.00
assi (resi 43   and name HB1  ) (resi 44   and name HA   )  5.00  5.00  0.00 
assi (resi 43   and name HB2  ) (resi 44   and name HN   )  5.00  5.00  0.00 
! residue 44   Ser , NOEs forward in sequence
assi (resi 44   and name HN   ) (resi 45   and name HN   )  3.50  3.50  0.00 
assi (resi 44   and name HA   ) (resi 45   and name HN   )  3.50  3.50  0.00 
assi (resi 44   and name HB1  ) (resi 45   and name HN   )  5.00  5.00  0.00 
assi (resi 44   and name HB2  ) (resi 45   and name HN   )  5.00  5.00  0.00 
! residue 45   Phe , NOEs forward in sequence
assi (resi 45   and name HN   ) (resi 46   and name HN   )  6.00  6.00  0.00
assi (resi 45   and name HA   ) (resi 46   and name HN   )  3.50  3.50  0.00 
assi (resi 45   and name HB1  ) (resi 46   and name HN   )  5.00  5.00  0.00
assi (resi 45   and name HB2  ) (resi 46   and name HN   )  5.00  5.00  0.00
assi (resi 45   and name HD#  ) (resi 46   and name HN   )  5.00  5.00  0.00
assi (resi 45   and name HD#  ) (resi 53   and name HA   )  5.00  5.00  0.00
assi (resi 45   and name HD#  ) (resi 53   and name HB1  )  5.00  5.00  0.00
assi (resi 45   and name HD#  ) (resi 53   and name HB2  )  5.00  5.00  0.00
assi (resi 45   and name HE#  ) (resi 53   and name HA   )  5.00  5.00  0.00 
assi (resi 45   and name HE#  ) (resi 53   and name HB1  )  5.00  5.00  0.00
assi (resi 45   and name HE#  ) (resi 53   and name HB2  )  5.00  5.00  0.00
assi (resi 45   and name HZ   ) (resi 53   and name HA   )  5.00  5.00  0.00
assi (resi 45	and name HD#  ) (resi 54   and name HN   )  6.00  6.00  0.00 
assi (resi 45	and name HE#  ) (resi 54   and name HN   )  5.00  5.00  0.00 
assi (resi 45	and name HZ   ) (resi 54   and name HN   )  6.00  6.00  0.00 
assi (resi 45   and name HD#  ) (resi 55   and name HG2# )  6.00  6.00  0.00
assi (resi 45	and name HE#  ) (resi 55   and name HN   )  6.00  6.00  0.00 
assi (resi 45   and name HE#  ) (resi 55   and name HA   )  6.00  6.00  0.00
assi (resi 45   and name HE#  ) (resi 55   and name HG2# )  5.00  5.00  0.00
assi (resi 45   and name HZ   ) (resi 55   and name HA   )  5.00  5.00  0.00
assi (resi 45   and name HZ   ) (resi 55   and name HG1# )  6.00  6.00  0.00
assi (resi 45   and name HZ   ) (resi 55   and name HG2# )  5.00  5.00  0.00
assi (resi 45   and name HD#  ) (resi 75   and name HB2  )  5.00  5.00  0.00
assi (resi 45   and name HD#  ) (resi 77   and name HB#  )  6.00  6.00  0.00
assi (resi 45   and name HE#  ) (resi 77   and name HA   )  6.00  6.00  0.00
assi (resi 45   and name HE#  ) (resi 77   and name HB#  )  5.00  5.00  0.00
assi (resi 45   and name HZ   ) (resi 77   and name HB#  )  6.00  6.00  0.00
! residue 46   Thr , NOEs forward in sequence
assi (resi 46   and name HN   ) (resi 47   and name HN   )  5.00  5.00  0.00
assi (resi 46   and name HA   ) (resi 47   and name HN   )  3.50  3.50  0.00 
assi (resi 46   and name HB   ) (resi 47   and name HN   )  5.00  5.00  0.00 
assi (resi 46   and name HG2# ) (resi 47   and name HN   )  5.00  5.00  0.00
assi (resi 46	and name HN   ) (resi 51   and name HG1# )  6.00  6.00  0.00 
assi (resi 46	and name HN   ) (resi 51   and name HG2# )  6.00  6.00  0.00 
assi (resi 46   and name HB   ) (resi 51   and name HG2# )  6.00  6.00  0.00 
! residue 47   Leu , NOEs forward in sequence
assi (resi 47   and name HN   ) (resi 48   and name HN   )  6.00  6.00  0.00 
assi (resi 47   and name HA   ) (resi 48   and name HN   )  3.50  3.50  0.00 
assi (resi 47   and name HB1  ) (resi 48   and name HN   )  5.00  5.00  0.00 
assi (resi 47   and name HB2  ) (resi 48   and name HN   )  5.00  5.00  0.00 
assi (resi 47   and name HD2# ) (resi 48   and name HN   )  6.00  6.00  0.00 
! residue 48   Gly , NOEs forward in sequence
assi (resi 48   and name HA2  ) (resi 49   and name HN   )  3.50  3.50  0.00
assi (resi 48   and name HN   ) (resi 51   and name HG1# )  6.00  6.00  0.00 
assi (resi 48   and name HN   ) (resi 51   and name HG2# )  6.00  6.00  0.00 
! residue 49   Thr , NOEs forward in sequence
assi (resi 49	and name HN   ) (resi 50   and name HN   )  6.00  6.00  0.00 
assi (resi 49	and name HA   ) (resi 50   and name HN   )  5.00  5.00  0.00 
assi (resi 49	and name HB   ) (resi 50   and name HN   )  6.00  6.00  0.00 
assi (resi 49   and name HN   ) (resi 51   and name HN   )  5.00  5.00  0.00 
assi (resi 49   and name HG2# ) (resi 51   and name HN   )  6.00  6.00  0.00
! residue 50   Gly , NOEs forward in sequence
assi (resi 50   and name HN   ) (resi 51   and name HN   )  5.00  5.00  0.00 
assi (resi 50   and name HA1  ) (resi 51   and name HN   )  3.50  3.50  0.00
assi (resi 50   and name HA2  ) (resi 51   and name HN   )  3.50  3.50  0.00
! residue 51   Val , NOEs forward in sequence
assi (resi 51   and name HA   ) (resi 52   and name HN   )  3.50  3.50  0.00 
assi (resi 51   and name HB   ) (resi 52   and name HN   )  5.00  5.00  0.00 
assi (resi 51   and name HG1# ) (resi 52   and name HN   )  5.00  5.00  0.00
assi (resi 51   and name HG2# ) (resi 52   and name HN   )  5.00  5.00  0.00
! residue 52   His , NOEs forward in sequence
assi (resi 52   and name HA   ) (resi 53   and name HG1  )  5.00  5.00  0.00 
assi (resi 52   and name HA   ) (resi 53   and name HG2  )  5.00  5.00  0.00
assi (resi 52   and name HA   ) (resi 53   and name HD1  )  2.50  2.50  0.00
assi (resi 52   and name HA   ) (resi 53   and name HD2  )  2.50  2.50  0.00
assi (resi 52   and name HB1  ) (resi 53   and name HD1  )  5.00  5.00  0.00 
assi (resi 52   and name HB1  ) (resi 53   and name HD2  )  5.00  5.00  0.00
assi (resi 52   and name HB2  ) (resi 53   and name HD1  )  5.00  5.00  0.00 
assi (resi 52   and name HB2  ) (resi 53   and name HD2  )  5.00  5.00  0.00
assi (resi 52	and name HB2  ) (resi 54   and name HD1# )  6.00  6.00  0.00 
! residue 53   Pro , NOEs forward in sequence
assi (resi 53   and name HA   ) (resi 54   and name HN   )  2.50  2.50  0.00
assi (resi 53   and name HB2  ) (resi 54   and name HN   )  5.00  5.00  0.00
assi (resi 53	and name HB2  ) (resi 54   and name HA   )  6.00  6.00  0.00 
assi (resi 53   and name HA   ) (resi 55   and name HG2# )  6.00  6.00  0.00
assi (resi 53   and name HA   ) (resi 77   and name HB#  )  6.00  6.00  0.00
assi (resi 53	and name HB1  ) (resi 77   and name HB#  )  5.00  5.00  0.00 
assi (resi 53   and name HB2  ) (resi 77   and name HB#  )  5.00  5.00  0.00
assi (resi 53   and name HG1  ) (resi 77   and name HA   )  5.00  5.00  0.00 
assi (resi 53   and name HG1  ) (resi 77   and name HA   )  5.00  5.00  0.00 
assi (resi 53   and name HG1  ) (resi 77   and name HB#  )  5.00  5.00  0.00 
assi (resi 53   and name HG2  ) (resi 77   and name HA   )  5.00  5.00  0.00 
assi (resi 53   and name HG2  ) (resi 77   and name HA   )  5.00  5.00  0.00
assi (resi 53   and name HG2  ) (resi 77   and name HB#  )  5.00  5.00  0.00 
assi (resi 53	and name HB2  ) (resi 78   and name HD1  )  6.00  6.00  0.00 
assi (resi 53	and name HG1  ) (resi 78   and name HD1  )  6.00  6.00  0.00 
assi (resi 53	and name HG2  ) (resi 78   and name HD1  )  6.00  6.00  0.00 
! residue 54   Ile , NOEs forward in sequence
assi (resi 54   and name HA   ) (resi 55   and name HN   )  2.50  2.50  0.00
assi (resi 54   and name HG2# ) (resi 55   and name HN   )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 55   and name HA   )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 55   and name HB   )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 56   and name HN   )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 56   and name HA   )  6.00  6.00  0.00
assi (resi 54   and name HA   ) (resi 78   and name HA   )  6.00  6.00  0.00 
assi (resi 54   and name HA   ) (resi 78   and name HB1  )  5.00  5.00  0.00 
assi (resi 54   and name HA   ) (resi 78   and name HB2  )  5.00  5.00  0.00 
assi (resi 54   and name HA   ) (resi 78   and name HG1  )  3.50  3.50  0.00
assi (resi 54   and name HA   ) (resi 78   and name HG2  )  3.50  3.50  0.00
assi (resi 54   and name HA   ) (resi 78   and name HD2  )  5.00  5.00  0.00 
assi (resi 54   and name HG2# ) (resi 78   and name HB2  )  6.00  6.00  0.00 
assi (resi 54   and name HG2# ) (resi 78   and name HG1  )  6.00  6.00  0.00 
assi (resi 54   and name HG2# ) (resi 78   and name HG2  )  6.00  6.00  0.00
assi (resi 54   and name HD1# ) (resi 78   and name HB2  )  6.00  6.00  0.00 
assi (resi 54   and name HD1# ) (resi 78   and name HG1  )  5.00  5.00  0.00
assi (resi 54   and name HD1# ) (resi 78   and name HG2  )  6.00  6.00  0.00
assi (resi 54   and name HD1# ) (resi 78   and name HD1  )  5.00  5.00  0.00
assi (resi 54   and name HD1# ) (resi 78   and name HD2  )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 79   and name HA   )  6.00  6.00  0.00
assi (resi 54   and name HA   ) (resi 80   and name HG2# )  6.00  6.00  0.00 
assi (resi 54   and name HG2# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 80   and name HG1# )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 54   and name HB   ) (resi 84   and name HZ3  )  6.00  6.00  0.00
assi (resi 54   and name HG11 ) (resi 84   and name HH2  )  3.50  3.50  0.00
assi (resi 54   and name HG11 ) (resi 84   and name HZ3  )  5.00  5.00  0.00
assi (resi 54   and name HG2# ) (resi 84   and name HE3  )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 84   and name HH2  )  5.00  5.00  0.00
assi (resi 54   and name HG2# ) (resi 84   and name HZ3  )  5.00  5.00  0.00
assi (resi 54   and name HD1# ) (resi 84   and name HH2  )  5.00  5.00  0.00
assi (resi 54   and name HD1# ) (resi 84   and name HZ2  )  6.00  6.00  0.00
assi (resi 54   and name HD1# ) (resi 84   and name HZ3  )  6.00  6.00  0.00 
assi (resi 54   and name HA   ) (resi 97   and name HD2# )  6.00  6.00  0.00
assi (resi 54   and name HG2# ) (resi 97   and name HD1# )  5.00  5.00  0.00
assi (resi 54   and name HG2# ) (resi 97   and name HD2# )  6.00  6.00  0.00
assi (resi 54   and name HD1# ) (resi 97   and name HD1# )  6.00  6.00  0.00
assi (resi 54   and name HD1# ) (resi 97   and name HD2# )  6.00  6.00  0.00
! residue 55   Val , NOEs forward in sequence
assi (resi 55   and name HN   ) (resi 56   and name HN   )  6.00  6.00  0.00
assi (resi 55   and name HA   ) (resi 56   and name HN   )  2.50  2.50  0.00
assi (resi 55   and name HA   ) (resi 56   and name HG2# )  6.00  6.00  0.00
assi (resi 55   and name HB   ) (resi 56   and name HN   )  5.00  5.00  0.00 
assi (resi 55   and name HG1# ) (resi 56   and name HN   )  6.00  6.00  0.00
assi (resi 55   and name HG1# ) (resi 56   and name HA   )  5.00  5.00  0.00
assi (resi 55   and name HG2# ) (resi 56   and name HN   )  6.00  6.00  0.00
assi (resi 55   and name HG1# ) (resi 57   and name HG2# )  6.00  6.00  0.00 
assi (resi 55   and name HB   ) (resi 71   and name HG2# )  5.00  5.00  0.00 
assi (resi 55   and name HG1# ) (resi 71   and name HG2# )  5.00  5.00  0.00 
assi (resi 55   and name HG2# ) (resi 71   and name HG2# )  5.00  5.00  0.00 
assi (resi 55   and name HN   ) (resi 77   and name HB#  )  3.50  3.50  0.00
assi (resi 55   and name HA   ) (resi 77   and name HB#  )  6.00  6.00  0.00
assi (resi 55   and name HG2# ) (resi 77   and name HN   )  6.00  6.00  0.00 
assi (resi 55   and name HN   ) (resi 79   and name HA   )  3.50  3.50  0.00
assi (resi 55   and name HA   ) (resi 79   and name HG2# )  6.00  6.00  0.00
assi (resi 55   and name HB   ) (resi 79   and name HA   )  3.50  3.50  0.00
assi (resi 55   and name HB   ) (resi 79   and name HG1# )  5.00  5.00  0.00
assi (resi 55   and name HB   ) (resi 79   and name HG2# )  5.00  5.00  0.00
assi (resi 55   and name HG1# ) (resi 79   and name HA   )  6.00  6.00  0.00
assi (resi 55   and name HG1# ) (resi 79   and name HB   )  6.00  6.00  0.00
assi (resi 55   and name HG1# ) (resi 79   and name HG1# )  6.00  6.00  0.00
assi (resi 55   and name HG1# ) (resi 79   and name HG2# )  6.00  6.00  0.00
assi (resi 55   and name HG2# ) (resi 79   and name HA   )  6.00  6.00  0.00
assi (resi 55   and name HG2# ) (resi 79   and name HG2# )  6.00  6.00  0.00
assi (resi 55   and name HN   ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 55   and name HN   ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 55   and name HB   ) (resi 80   and name HN   )  5.00  5.00  0.00 
assi (resi 55   and name HG1# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 55   and name HG2# ) (resi 80   and name HN   )  6.00  6.00  0.00
! residue 56   Val , NOEs forward in sequence
assi (resi 56   and name HN   ) (resi 57   and name HN   )  5.00  5.00  0.00
assi (resi 56   and name HA   ) (resi 57   and name HN   )  2.50  2.50  0.00
assi (resi 56   and name HA   ) (resi 57   and name HG1# )  6.00  6.00  0.00
assi (resi 56   and name HA   ) (resi 57   and name HG2# )  6.00  6.00  0.00
assi (resi 56   and name HB   ) (resi 57   and name HN   )  5.00  5.00  0.00
assi (resi 56   and name HG1# ) (resi 57   and name HN   )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 57   and name HN   )  6.00  6.00  0.00
assi (resi 56   and name HN   ) (resi 79   and name HG2# )  6.00  6.00  0.00
assi (resi 56   and name HG1# ) (resi 79   and name HA   )  6.00  6.00  0.00
assi (resi 56   and name HN   ) (resi 80   and name HN   )  5.00  5.00  0.00 
assi (resi 56   and name HN   ) (resi 80   and name HG2# )  6.00  6.00  0.00 
assi (resi 56   and name HA   ) (resi 80   and name HN   )  3.50  3.50  0.00 
assi (resi 56   and name HA   ) (resi 80   and name HG2# )  5.00  5.00  0.00 
assi (resi 56   and name HA   ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 56   and name HB   ) (resi 80   and name HN   )  5.00  5.00  0.00 
assi (resi 56   and name HB   ) (resi 80   and name HG2# )  6.00  6.00  0.00 
assi (resi 56   and name HG1# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 56   and name HG1# ) (resi 80   and name HG1# )  6.00  6.00  0.00
assi (resi 56   and name HG1# ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 80   and name HG1# )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 56   and name HA   ) (resi 82   and name HA   )  6.00  6.00  0.00
assi (resi 56   and name HB   ) (resi 82   and name HA   )  6.00  6.00  0.00 
assi (resi 56   and name HG1# ) (resi 82   and name HN   )  6.00  6.00  0.00
assi (resi 56   and name HG1# ) (resi 82   and name HA   )  3.50  3.50  0.00
assi (resi 56   and name HG1# ) (resi 82   and name HB1  )  5.00  5.00  0.00
assi (resi 56   and name HG1# ) (resi 82   and name HB2  )  5.00  5.00  0.00
assi (resi 56   and name HG1# ) (resi 82   and name HG1  )  5.00  5.00  0.00
assi (resi 56   and name HG1# ) (resi 82   and name HG2  )  5.00  5.00  0.00
assi (resi 56   and name HG1# ) (resi 82   and name HD2  )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 82   and name HN   )  6.00  6.00  0.00 
assi (resi 56   and name HG2# ) (resi 82   and name HB1  )  5.00  5.00  0.00
assi (resi 56   and name HG1# ) (resi 83   and name HN   )  6.00  6.00  0.00 
assi (resi 56   and name HG1# ) (resi 84   and name HZ3  )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 84   and name HZ3  )  6.00  6.00  0.00 
assi (resi 56   and name HN   ) (resi 85   and name HG2# )  6.00  6.00  0.00 
assi (resi 56   and name HG1# ) (resi 85   and name HN   )  6.00  6.00  0.00 
assi (resi 56   and name HG1# ) (resi 85   and name HG1# )  6.00  6.00  0.00
assi (resi 56   and name HG2# ) (resi 85   and name HN   )  6.00  6.00  0.00 
! residue 57   Val , NOEs forward in sequence
assi (resi 57   and name HA   ) (resi 58   and name HN   )  3.50  3.50  0.00
assi (resi 57   and name HB   ) (resi 58   and name HN   )  3.50  3.50  0.00
assi (resi 57   and name HG1# ) (resi 58   and name HN   )  6.00  6.00  0.00
assi (resi 57   and name HG2# ) (resi 58   and name HN   )  6.00  6.00  0.00
assi (resi 57	and name HG1# ) (resi 62   and name HE1  )  6.00  6.00  0.00 
assi (resi 57   and name HG1# ) (resi 62   and name HZ2  )  6.00  6.00  0.00
assi (resi 57   and name HG1# ) (resi 79   and name HG1# )  5.00  5.00  0.00 
assi (resi 57   and name HN   ) (resi 80   and name HN   )  5.00  5.00  0.00
assi (resi 57   and name HN   ) (resi 80   and name HA   )  5.00  5.00  0.00
assi (resi 57   and name HN   ) (resi 80   and name HG1# )  6.00  6.00  0.00
assi (resi 57   and name HN   ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 57   and name HG1# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 57   and name HN   ) (resi 81   and name HN   )  5.00  5.00  0.00
assi (resi 57   and name HN   ) (resi 81   and name HA   )  5.00  5.00  0.00
assi (resi 57   and name HN   ) (resi 81   and name HB   )  5.00  5.00  0.00 
assi (resi 57   and name HN   ) (resi 81   and name HG2# )  6.00  6.00  0.00
assi (resi 57   and name HB   ) (resi 81   and name HN   )  6.00  6.00  0.00 
assi (resi 57   and name HG2# ) (resi 81   and name HN   )  6.00  6.00  0.00
assi (resi 57   and name HG2# ) (resi 81   and name HA   )  6.00  6.00  0.00
assi (resi 57   and name HG2# ) (resi 81   and name HB   )  6.00  6.00  0.00
assi (resi 57   and name HG2# ) (resi 81   and name HG2# )  6.00  6.00  0.00 
assi (resi 57   and name HG2# ) (resi 102  and name HN   )  6.00  6.00  0.00 
! residue 58   Gln , NOEs forward in sequence
assi (resi 58   and name HN   ) (resi 81   and name HA   )  5.00  5.00  0.00
! residue 59   Pro , NOEs forward in sequence
assi (resi 59   and name HB1  ) (resi 60   and name HN   )  5.00  5.00  0.00 
assi (resi 59   and name HB2  ) (resi 60   and name HN   )  5.00  5.00  0.00 
assi (resi 59   and name HG#  ) (resi 60   and name HN   )  5.00  5.00  0.00 
assi (resi 59   and name HA   ) (resi 62   and name HD1  )  5.00  5.00  0.00
assi (resi 59   and name HB2  ) (resi 68   and name HD#  )  6.00  6.00  0.00 
assi (resi 59   and name HB2  ) (resi 68   and name HE#  )  6.00  6.00  0.00 
assi (resi 59	and name HG#  ) (resi 81   and name HG2# )  6.00  6.00  0.00 
assi (resi 59	and name HD2  ) (resi 81   and name HG2# )  6.00  6.00  0.00 
! residue 60   Asp , NOEs forward in sequence
assi (resi 60   and name HN   ) (resi 61   and name HN   )  3.50  3.50  0.00
assi (resi 60   and name HN   ) (resi 61   and name HB#  )  5.00  5.00  0.00
assi (resi 60   and name HA   ) (resi 61   and name HN   )  3.50  3.50  0.00
assi (resi 60   and name HN   ) (resi 62   and name HN   )  5.00  5.00  0.00 
! residue 61   Ala , NOEs forward in sequence
assi (resi 61   and name HN   ) (resi 62   and name HN   )  3.50  3.50  0.00 
assi (resi 61   and name HB#  ) (resi 62   and name HN   )  5.00  5.00  0.00
assi (resi 61   and name HB#  ) (resi 62   and name HA   )  5.00  5.00  0.00
assi (resi 61   and name HB#  ) (resi 62   and name HD1  )  6.00  6.00  0.00
! residue 62   Trp , NOEs forward in sequence
assi (resi 62   and name HA   ) (resi 63   and name HN   )  5.00  5.00  0.00
assi (resi 62   and name HE3  ) (resi 67   and name HA2  )  6.00  6.00  0.00 
assi (resi 62   and name HZ3  ) (resi 67   and name HA2  )  6.00  6.00  0.00 
assi (resi 62   and name HH2  ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 62   and name HZ2  ) (resi 71   and name HD1# )  5.00  5.00  0.00 
! residue 63   Thr , NOEs forward in sequence
assi (resi 63   and name HN   ) (resi 64   and name HN   )  5.00  5.00  0.00
assi (resi 63   and name HA   ) (resi 64   and name HN   )  3.50  3.50  0.00
assi (resi 63   and name HB   ) (resi 64   and name HN   )  3.50  3.50  0.00
assi (resi 63   and name HG2# ) (resi 64   and name HN   )  5.00  5.00  0.00
! residue 64   Glu , NOEs forward in sequence
assi (resi 64   and name HA   ) (resi 65   and name HN   )  5.00  5.00  0.00
assi (resi 64   and name HB1  ) (resi 65   and name HN   )  6.00  6.00  0.00 
assi (resi 64   and name HB2  ) (resi 65   and name HN   )  6.00  6.00  0.00 
! residue 65   Asp , NOEs forward in sequence
! residue 66   Asn , NOEs forward in sequence
! residue 67   Gly , NOEs forward in sequence
assi (resi 67   and name HN   ) (resi 68   and name HN   )  6.00  6.00  0.00
assi (resi 67   and name HA2  ) (resi 70   and name HB#  )  6.00  6.00  0.00 
! residue 68   Phe , NOEs forward in sequence
assi (resi 68   and name HN   ) (resi 69   and name HN   )  5.00  5.00  0.00
assi (resi 68   and name HN   ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 68   and name HA   ) (resi 71   and name HG12 )  5.00  5.00  0.00 
assi (resi 68   and name HA   ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 68   and name HB#  ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 68   and name HD#  ) (resi 71   and name HD1# )  5.00  5.00  0.00 
assi (resi 68   and name HE#  ) (resi 71   and name HA   )  6.00  6.00  0.00 
assi (resi 68   and name HE#  ) (resi 71   and name HB   )  6.00  6.00  0.00 
assi (resi 68   and name HZ   ) (resi 71   and name HA   )  6.00  6.00  0.00 
! residue 69   His , NOEs forward in sequence
assi (resi 69   and name HN   ) (resi 70   and name HN   )  3.50  3.50  0.00
! residue 70   Ala , NOEs forward in sequence
assi (resi 70   and name HN   ) (resi 71   and name HN   )  5.00  5.00  0.00 
assi (resi 70   and name HN   ) (resi 71   and name HG11 )  6.00  6.00  0.00 
assi (resi 70   and name HN   ) (resi 71   and name HD1# )  6.00  6.00  0.00 
assi (resi 70   and name HA   ) (resi 71   and name HN   )  3.50  3.50  0.00 
assi (resi 70   and name HB#  ) (resi 71   and name HN   )  5.00  5.00  0.00 
! residue 71   Ile , NOEs forward in sequence
assi (resi 71   and name HN   ) (resi 72   and name HN   )  5.00  5.00  0.00 
assi (resi 71   and name HB   ) (resi 72   and name HN   )  5.00  5.00  0.00 
assi (resi 71   and name HG2# ) (resi 72   and name HN   )  5.00  5.00  0.00 
assi (resi 71   and name HA   ) (resi 73   and name HN   )  6.00  6.00  0.00 
assi (resi 71   and name HA   ) (resi 74   and name HN   )  6.00  6.00  0.00 
assi (resi 71   and name HA   ) (resi 74   and name HG#  )  5.00  5.00  0.00 
assi (resi 71   and name HA   ) (resi 74   and name HE#  )  5.00  5.00  0.00 
assi (resi 71   and name HG2# ) (resi 74   and name HN   )  6.00  6.00  0.00 
assi (resi 71   and name HG2# ) (resi 74   and name HB1  )  6.00  6.00  0.00 
assi (resi 71   and name HG2# ) (resi 74   and name HB2  )  6.00  6.00  0.00 )
assi (resi 71   and name HG2# ) (resi 74   and name HG#  )  6.00  6.00  0.00 
assi (resi 71   and name HG2# ) (resi 74   and name HE#  )  5.00  5.00  0.00 
assi (resi 71   and name HD1# ) (resi 74   and name HG#  )  6.00  6.00  0.00 
assi (resi 71   and name HD1# ) (resi 74   and name HE#  )  5.00  5.00  0.00 
assi (resi 71   and name HG2# ) (resi 75   and name HN   )  6.00  6.00  0.00 
assi (resi 71   and name HG2# ) (resi 75   and name HB1  )  5.00  5.00  0.00 
assi (resi 71   and name HG2# ) (resi 75   and name HB2  )  5.00  5.00  0.00 
assi (resi 71   and name HN   ) (resi 79   and name HG1# )  6.00  6.00  0.00 
assi (resi 71   and name HN   ) (resi 79   and name HG2# )  5.00  5.00  0.00 
assi (resi 71   and name HA   ) (resi 79   and name HG2# )  6.00  6.00  0.00 
assi (resi 71   and name HB   ) (resi 79   and name HB   )  5.00  5.00  0.00 
assi (resi 71   and name HB   ) (resi 79   and name HG1# )  5.00  5.00  0.00 
assi (resi 71   and name HB   ) (resi 79   and name HG2# )  3.50  3.50  0.00 
assi (resi 71   and name HG11 ) (resi 79   and name HG2# )  5.00  5.00  0.00 
assi (resi 71   and name HG12 ) (resi 79   and name HG2# )  5.00  5.00  0.00 
assi (resi 71   and name HG2# ) (resi 79   and name HB   )  5.00  5.00  0.00 
! residue 72   Gly , NOEs forward in sequence
assi (resi 72   and name HN   ) (resi 73   and name HN   )  5.00  5.00  0.00
assi (resi 72   and name HA1  ) (resi 73   and name HN   )  5.00  5.00  0.00
assi (resi 72   and name HA2  ) (resi 73   and name HN   )  5.00  5.00  0.00
assi (resi 72   and name HA1  ) (resi 75   and name HN   )  5.00  5.00  0.00 
assi (resi 72   and name HA2  ) (resi 75   and name HN   )  5.00  5.00  0.00 
assi (resi 72   and name HN   ) (resi 79   and name HG2# )  6.00  6.00  0.00
! residue 73   Gln , NOEs forward in sequence
assi (resi 73   and name HN   ) (resi 74   and name HN   )  3.50  3.50  0.00 
assi (resi 73   and name HN   ) (resi 74   and name HG#  )  6.00  6.00  0.00 
assi (resi 73   and name HG1  ) (resi 74   and name HN   )  6.00  6.00  0.00 
assi (resi 73   and name HN   ) (resi 75   and name HN   )  5.00  5.00  0.00 
assi (resi 73   and name HN   ) (resi 75   and name HN   )  6.00  6.00  0.00 
! residue 74   Met , NOEs forward in sequence
assi (resi 74   and name HN   ) (resi 75   and name HN   )  3.50  3.50  0.00 
assi (resi 74   and name HB1  ) (resi 75   and name HN   )  5.00  5.00  0.00 
assi (resi 74   and name HB2  ) (resi 75   and name HN   )  5.00  5.00  0.00 
assi (resi 74   and name HG#  ) (resi 75   and name HN   )  6.00  6.00  0.00 
! residue 75   Cys , NOEs forward in sequence
assi (resi 75   and name HA   ) (resi 76   and name HN   )  3.50  3.50  0.00 
assi (resi 75   and name HB1  ) (resi 76   and name HN   )  5.00  5.00  0.00
assi (resi 75   and name HB2  ) (resi 76   and name HN   )  5.00  5.00  0.00
! residue 76   Glu , NOEs forward in sequence
assi (resi 76   and name HN   ) (resi 77   and name HN   )  3.50  3.50  0.00
assi (resi 76   and name HN   ) (resi 77   and name HB#  )  5.00  5.00  0.00
assi (resi 76   and name HA   ) (resi 77   and name HN   )  3.50  3.50  0.00 
assi (resi 76   and name HB1  ) (resi 77   and name HN   )  5.00  5.00  0.00
assi (resi 76   and name HB2  ) (resi 77   and name HN   )  5.00  5.00  0.00 
assi (resi 76   and name HG#  ) (resi 77   and name HN   )  5.00  5.00  0.00
! residue 77   Ala , NOEs forward in sequence
assi (resi 77   and name HA   ) (resi 78   and name HG1  )  5.00  5.00  0.00 
assi (resi 77   and name HA   ) (resi 78   and name HG2  )  5.00  5.00  0.00 
assi (resi 77   and name HA   ) (resi 78   and name HD1  )  3.50  3.50  0.00 
assi (resi 77   and name HA   ) (resi 78   and name HD2  )  3.50  3.50  0.00
assi (resi 77   and name HB#  ) (resi 78   and name HD1  )  3.50  3.50  0.00
assi (resi 77   and name HB#  ) (resi 78   and name HD2  )  5.00  5.00  0.00
! residue 78   Pro , NOEs forward in sequence
assi (resi 78   and name HA   ) (resi 79   and name HN   )  2.50  2.50  0.00
assi (resi 78   and name HA   ) (resi 79   and name HG2# )  6.00  6.00  6.00 
assi (resi 78   and name HB2  ) (resi 79   and name HN   )  5.00  5.00  0.00
assi (resi 78   and name HB1  ) (resi 80   and name HG1# )  6.00  6.00  0.00 
assi (resi 78   and name HB2  ) (resi 80   and name HG1# )  5.00  5.00  0.00 
assi (resi 78   and name HB1  ) (resi 97   and name HD1# )  6.00  6.00  0.00
assi (resi 78   and name HB1  ) (resi 97   and name HD2# )  5.00  5.00  0.00
assi (resi 78   and name HG1  ) (resi 97   and name HG   )  6.00  6.00  0.00 
assi (resi 78   and name HG1  ) (resi 97   and name HD2# )  5.00  5.00  0.00
assi (resi 78   and name HG2  ) (resi 97   and name HG   )  6.00  6.00  0.00 
assi (resi 78   and name HG2  ) (resi 97   and name HD2# )  5.00  5.00  0.00
assi (resi 78   and name HA   ) (resi 101  and name HD2# )  3.50  3.50  0.00
assi (resi 78   and name HB1  ) (resi 101  and name HD1# )  5.00  5.00  0.00 
assi (resi 78   and name HB1  ) (resi 101  and name HD2# )  3.50  3.50  0.00
assi (resi 78   and name HB2  ) (resi 101  and name HD1# )  5.00  5.00  0.00 
assi (resi 78   and name HB2  ) (resi 101  and name HD2# )  3.50  3.50  0.00 
! residue 79   Val , NOEs forward in sequence
assi (resi 79   and name HA   ) (resi 80   and name HN   )  2.50  2.50  0.00
assi (resi 79   and name HA   ) (resi 80   and name HG2# )  6.00  6.00  0.00
assi (resi 79   and name HB   ) (resi 80   and name HN   )  5.00  5.00  0.00 
assi (resi 79   and name HG1# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 79   and name HG2# ) (resi 80   and name HN   )  6.00  6.00  0.00
assi (resi 79   and name HB   ) (resi 102  and name HN   )  6.00  6.00  0.00
assi (resi 79   and name HG1# ) (resi 102  and name HN   )  5.00  5.00  0.00
assi (resi 79   and name HG2# ) (resi 102  and name HN   )  6.00  6.00  0.00
! residue 80   Val , NOEs forward in sequence
assi (resi 80   and name HA   ) (resi 81   and name HN   )  3.50  3.50  0.00
assi (resi 80   and name HA   ) (resi 81   and name HG2# )  6.00  6.00  0.00
assi (resi 80   and name HB   ) (resi 81   and name HN   )  3.50  3.50  0.00
assi (resi 80   and name HG1# ) (resi 81   and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 81   and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 81   and name HA   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 83   and name HN   )  6.00  6.00  0.00 
assi (resi 80   and name HB   ) (resi 84   and name HN   )  5.00  5.00  0.00 
assi (resi 80   and name HG1# ) (resi 84   and name HB1  )  6.00  6.00  0.00
assi (resi 80   and name HG1# ) (resi 84   and name HB2  )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 84   and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 84   and name HB1  )  5.00  5.00  0.00
assi (resi 80   and name HG2# ) (resi 84   and name HB2  )  5.00  5.00  0.00
assi (resi 80   and name HG2# ) (resi 84   and name HE3  )  5.00  5.00  0.00
assi (resi 80   and name HG2# ) (resi 84   and name HZ3  )  6.00  6.00  0.00 
assi (resi 80   and name HA   ) (resi 97   and name HG   )  6.00  6.00  0.00 
assi (resi 80   and name HG1# ) (resi 97   and name HA   )  5.00  5.00  0.00
assi (resi 80   and name HG1# ) (resi 97   and name HB1  )  6.00  6.00  0.00 
assi (resi 80   and name HG1# ) (resi 97   and name HB2  )  6.00  6.00  0.00 
assi (resi 80   and name HG1# ) (resi 97   and name HG   )  5.00  5.00  0.00 
assi (resi 80   and name HG1# ) (resi 97   and name HD1# )  6.00  6.00  0.00 
assi (resi 80   and name HG1# ) (resi 97   and name HD2# )  5.00  5.00  0.00 
assi (resi 80   and name HG2# ) (resi 97   and name HB1  )  6.00  6.00  0.00 
assi (resi 80   and name HG2# ) (resi 97   and name HB2  )  6.00  6.00  0.00 
assi (resi 80   and name HG2# ) (resi 97   and name HG   )  5.00  5.00  0.00 
assi (resi 80   and name HG2# ) (resi 97   and name HD1# )  6.00  6.00  0.00 
assi (resi 80   and name HA   ) (resi 100  and name HB1  )  5.00  5.00  0.00
assi (resi 80   and name HA   ) (resi 100  and name HB2  )  5.00  5.00  0.00
assi (resi 80   and name HB   ) (resi 100  and name HB1  )  3.50  3.50  0.00
assi (resi 80   and name HB   ) (resi 100  and name HB2  )  3.50  3.50  0.00 
assi (resi 80   and name HB   ) (resi 100  and name HD#  )  5.00  5.00  0.00
assi (resi 80   and name HG1# ) (resi 100  and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG1# ) (resi 100  and name HB1  )  5.00  5.00  0.00
assi (resi 80   and name HG1# ) (resi 100  and name HB2  )  5.00  5.00  0.00
assi (resi 80   and name HG1# ) (resi 100  and name HD#  )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 100  and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 100  and name HB1  )  6.00  6.00  0.00
assi (resi 80   and name HA   ) (resi 101  and name HA   )  3.50  3.50  0.00
assi (resi 80   and name HA   ) (resi 101  and name HB1  )  5.00  5.00  0.00
assi (resi 80   and name HG1# ) (resi 101  and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG1# ) (resi 101  and name HA   )  5.00  5.00  0.00
assi (resi 80   and name HG1# ) (resi 101  and name HD2# )  6.00  6.00  0.00 
assi (resi 80   and name HG2# ) (resi 101  and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 101  and name HA   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 101  and name HD2# )  5.00  5.00  0.00
assi (resi 80   and name HA   ) (resi 102  and name HN   )  5.00  5.00  0.00 
assi (resi 80   and name HG1# ) (resi 102  and name HN   )  6.00  6.00  0.00
assi (resi 80   and name HG2# ) (resi 102  and name HN   )  6.00  6.00  0.00 
! residue 81   Thr , NOEs forward in sequence
assi (resi 81   and name HA   ) (resi 82   and name HN   )  3.50  3.50  0.00
assi (resi 81   and name HB   ) (resi 82   and name HN   )  5.00  5.00  0.00
assi (resi 81   and name HG2# ) (resi 82   and name HN   )  5.00  5.00  0.00
assi (resi 81   and name HA   ) (resi 83   and name HN   )  5.00  5.00  0.00
assi (resi 81   and name HB   ) (resi 83   and name HN   )  3.50  3.50  0.00
assi (resi 81   and name HG2# ) (resi 83   and name HN   )  6.00  6.00  0.00
assi (resi 81   and name HA   ) (resi 84   and name HN   )  6.00  6.00  0.00 
assi (resi 81   and name HG2# ) (resi 84   and name HN   )  5.00  5.00  0.00
assi (resi 81   and name HN   ) (resi 100  and name HB1  )  5.00  5.00  0.00
assi (resi 81   and name HN   ) (resi 100  and name HB2  )  3.50  3.50  0.00
assi (resi 81   and name HG2# ) (resi 100  and name HN   )  6.00  6.00  0.00 
assi (resi 81   and name HG2# ) (resi 100  and name HA   )  6.00  6.00  0.00
assi (resi 81   and name HG2# ) (resi 100  and name HB1  )  6.00  6.00  0.00
assi (resi 81   and name HG2# ) (resi 100  and name HB2  )  5.00  5.00  0.00
assi (resi 81   and name HG2# ) (resi 100  and name HD#  )  6.00  6.00  0.00
assi (resi 81   and name HG2# ) (resi 101  and name HA   )  6.00  6.00  0.00 
assi (resi 81   and name HG2# ) (resi 102  and name HN   )  6.00  6.00  0.00
assi (resi 81   and name HG2# ) (resi 102  and name HA   )  6.00  6.00  0.00
! residue 82   Arg , NOEs forward in sequence
assi (resi 82   and name HN   ) (resi 83   and name HN   )  3.50  3.50  0.00
assi (resi 82   and name HA   ) (resi 83   and name HN   )  3.50  3.50  0.00
assi (resi 82   and name HB1  ) (resi 83   and name HN   )  5.00  5.00  0.00
assi (resi 82   and name HB2  ) (resi 83   and name HN   )  5.00  5.00  0.00
assi (resi 82   and name HG2  ) (resi 83   and name HN   )  5.00  5.00  0.00
assi (resi 82   and name HA   ) (resi 85   and name HN   )  3.50  3.50  0.00 
assi (resi 82   and name HA   ) (resi 85   and name HG1# )  5.00  5.00  0.00
assi (resi 82   and name HA   ) (resi 85   and name HG2# )  5.00  5.00  0.00
assi (resi 82   and name HB1  ) (resi 85   and name HG1# )  5.00  5.00  0.00 
! residue 83   Glu , NOEs forward in sequence
assi (resi 83   and name HN   ) (resi 84   and name HN   )  3.50  3.50  0.00
assi (resi 83   and name HN   ) (resi 84   and name HB2  )  6.00  6.00  0.00 
assi (resi 83   and name HA   ) (resi 84   and name HN   )  5.00  5.00  0.00 
assi (resi 83   and name HB1  ) (resi 84   and name HN   )  3.50  3.50  0.00
assi (resi 83   and name HB2  ) (resi 84   and name HN   )  3.50  3.50  0.00
assi (resi 83   and name HA   ) (resi 86   and name HN   )  3.50  3.50  0.00
assi (resi 83   and name HA   ) (resi 86   and name HB1  )  3.50  3.50  0.00
assi (resi 83   and name HA   ) (resi 86   and name HB2  )  3.50  3.50  0.00
assi (resi 83   and name HN   ) (resi 87   and name HN   )  6.00  6.00  0.00 
assi (resi 83   and name HA   ) (resi 87   and name HN   )  5.00  5.00  0.00
assi (resi 83   and name HA   ) (resi 88   and name HN   )  6.00  6.00  0.00 
assi (resi 83   and name HB1  ) (resi 100  and name HD#  )  5.00  5.00  0.00 
assi (resi 83   and name HB1  ) (resi 100  and name HE#  )  5.00  5.00  0.00 
assi (resi 83   and name HB2  ) (resi 100  and name HD#  )  5.00  5.00  0.00 
assi (resi 83   and name HB2  ) (resi 100  and name HE#  )  5.00  5.00  0.00 
assi (resi 83   and name HG1  ) (resi 100  and name HE#  )  6.00  6.00  0.00 
assi (resi 83   and name HG2  ) (resi 100  and name HE#  )  6.00  6.00  0.00 
! residue 84   Trp , NOEs forward in sequence
assi (resi 84   and name HN   ) (resi 85   and name HN   )  3.50  3.50  0.00
assi (resi 84   and name HN   ) (resi 85   and name HB   )  5.00  5.00  0.00 
assi (resi 84   and name HN   ) (resi 85   and name HG2# )  6.00  6.00  0.00
assi (resi 84   and name HA   ) (resi 85   and name HN   )  3.50  3.50  0.00
assi (resi 84   and name HB1  ) (resi 85   and name HN   )  5.00  5.00  0.00
assi (resi 84   and name HB2  ) (resi 85   and name HN   )  3.50  3.50  0.00
assi (resi 84   and name HE3  ) (resi 85   and name HA   )  5.00  5.00  0.00 
assi (resi 84   and name HE3  ) (resi 85   and name HG1# )  6.00  6.00  0.00
assi (resi 84   and name HE3  ) (resi 85   and name HG2# )  3.50  3.50  0.00
assi (resi 84   and name HH2  ) (resi 85   and name HG2# )  6.00  6.00  0.00
assi (resi 84   and name HZ3  ) (resi 85   and name HN   )  5.00  5.00  0.00 
assi (resi 84   and name HZ3  ) (resi 85   and name HA   )  6.00  6.00  0.00
assi (resi 84   and name HZ3  ) (resi 85   and name HG1# )  6.00  6.00  0.00
assi (resi 84   and name HZ3  ) (resi 85   and name HG2# )  5.00  5.00  0.00
assi (resi 84   and name HN   ) (resi 86   and name HN   )  5.00  5.00  0.00
assi (resi 84   and name HN   ) (resi 87   and name HB1  )  5.00  5.00  0.00 
assi (resi 84   and name HA   ) (resi 87   and name HN   )  5.00  5.00  0.00 
assi (resi 84   and name HB2  ) (resi 87   and name HN   )  6.00  6.00  0.00 
assi (resi 84   and name HA   ) (resi 88   and name HN   )  6.00  6.00  0.00 
assi (resi 84   and name HD1  ) (resi 95   and name HN   )  5.00  5.00  0.00
assi (resi 84   and name HD1  ) (resi 95   and name HA   )  6.00  6.00  0.00
assi (resi 84   and name HD1  ) (resi 95   and name HB1  )  5.00  5.00  0.00 
assi (resi 84   and name HD1  ) (resi 95   and name HB2  )  3.50  3.50  0.00
assi (resi 84   and name HD1  ) (resi 95   and name HG1  )  6.00  6.00  0.00
assi (resi 84   and name HD1  ) (resi 95   and name HG2  )  5.00  5.00  0.00
assi (resi 84   and name HE1  ) (resi 95   and name HN   )  5.00  5.00  0.00
assi (resi 84   and name HE1  ) (resi 95   and name HB1  )  5.00  5.00  0.00
assi (resi 84   and name HE1  ) (resi 95   and name HB2  )  5.00  5.00  0.00
assi (resi 84   and name HD1  ) (resi 97   and name HA   )  5.00  5.00  0.00
assi (resi 84   and name HD1  ) (resi 97   and name HD1# )  6.00  6.00  0.00
assi (resi 84   and name HD1  ) (resi 97   and name HD2# )  6.00  6.00  0.00
assi (resi 84   and name HE1  ) (resi 97   and name HA   )  5.00  5.00  0.00
assi (resi 84   and name HE1  ) (resi 97   and name HG   )  5.00  5.00  0.00
assi (resi 84   and name HE1  ) (resi 97   and name HD1# )  5.00  5.00  0.00
assi (resi 84   and name HE1  ) (resi 97   and name HD2# )  6.00  6.00  0.00
assi (resi 84   and name HZ2  ) (resi 97   and name HD1# )  6.00  6.00  0.00
assi (resi 84   and name HZ3  ) (resi 97   and name HD2# )  5.00  5.00  0.00
assi (resi 84   and name HN   ) (resi 100  and name HB1  )  5.00  5.00  0.00
assi (resi 84   and name HN   ) (resi 100  and name HB2  )  3.50  3.50  0.00
assi (resi 84   and name HN   ) (resi 100  and name HD#  )  5.00  5.00  0.00
assi (resi 84	and name HA   ) (resi 100  and name HD#  )  6.00  6.00  0.00 
assi (resi 84	and name HA   ) (resi 100  and name HE#  )  5.00  5.00  0.00 
assi (resi 84   and name HB2  ) (resi 100  and name HB2  )  3.50  3.50  0.00
assi (resi 84   and name HB2  ) (resi 100  and name HD#  )  3.50  3.50  0.00
assi (resi 84   and name HB2  ) (resi 100  and name HE#  )  5.00  5.00  0.00 
assi (resi 84   and name HD1  ) (resi 100  and name HB1  )  6.00  6.00  0.00 
assi (resi 84   and name HD1  ) (resi 100  and name HB2  )  6.00  6.00  0.00
assi (resi 84   and name HD1  ) (resi 100  and name HD#  )  3.50  3.50  0.00
assi (resi 84   and name HD1  ) (resi 100  and name HE#  )  3.50  3.50  0.00
! residue 85   Val , NOEs forward in sequence
assi (resi 85   and name HN   ) (resi 86   and name HN   )  3.50  3.50  0.00
assi (resi 85   and name HN   ) (resi 86   and name HB2  )  6.00  6.00  0.00 
assi (resi 85   and name HA   ) (resi 86   and name HN   )  3.50  3.50  0.00 
assi (resi 85   and name HB   ) (resi 86   and name HN   )  5.00  5.00  5.00 
assi (resi 85   and name HG1# ) (resi 86   and name HN   )  5.00  5.00  0.00
assi (resi 85   and name HG2# ) (resi 86   and name HN   )  6.00  6.00  0.00
assi (resi 85   and name HG1# ) (resi 87   and name HN   )  6.00  6.00  0.00 
assi (resi 85   and name HA   ) (resi 88   and name HN   )  5.00  5.00  0.00 
assi (resi 85   and name HA   ) (resi 88   and name HB1  )  5.00  5.00  0.00 
assi (resi 85   and name HA   ) (resi 88   and name HB2  )  5.00  5.00  0.00
assi (resi 85   and name HA   ) (resi 89   and name HN   )  5.00  5.00  0.00
assi (resi 85   and name HG1# ) (resi 89   and name HN   )  6.00  6.00  0.00
! residue 86   Leu , NOEs forward in sequence
assi (resi 86   and name HN   ) (resi 87   and name HN   )  3.50  3.50  0.00
assi (resi 86   and name HA   ) (resi 87   and name HN   )  5.00  5.00  0.00
assi (resi 86   and name HB1  ) (resi 87   and name HN   )  3.50  3.50  0.00
assi (resi 86   and name HB2  ) (resi 87   and name HN   )  5.00  5.00  0.00
assi (resi 86   and name HA   ) (resi 89   and name HN   )  3.50  3.50  0.00
assi (resi 86   and name HA   ) (resi 89   and name HB   )  3.50  3.50  0.00
assi (resi 86   and name HA   ) (resi 90   and name HN   )  5.00  5.00  0.00 
assi (resi 86   and name HB1  ) (resi 90   and name HN   )  6.00  6.00  0.00 
assi (resi 86   and name HB2  ) (resi 90   and name HN   )  6.00  6.00  0.00 
! residue 87   Asp , NOEs forward in sequence
assi (resi 87   and name HN   ) (resi 88   and name HN   )  3.50  3.50  0.00
assi (resi 87   and name HA   ) (resi 88   and name HN   )  5.00  5.00  0.00
assi (resi 87   and name HA   ) (resi 90   and name HN   )  5.00  5.00  0.00 
assi (resi 87   and name HA   ) (resi 90   and name HB#  )  3.50  3.50  0.00
! residue 88   Ser , NOEs forward in sequence
assi (resi 88   and name HN   ) (resi 89   and name HN   )  3.50  3.50  0.00
assi (resi 88   and name HB1  ) (resi 89   and name HN   )  5.00  5.00  0.00 
assi (resi 88   and name HB2  ) (resi 89   and name HN   )  5.00  5.00  0.00
assi (resi 88   and name HA   ) (resi 91   and name HN   )  5.00  5.00  0.00 
assi (resi 88   and name HA   ) (resi 91   and name HB1  )  5.00  5.00  0.00
assi (resi 88   and name HA   ) (resi 93   and name HN   )  3.50  3.50  0.00 
assi (resi 88   and name HA   ) (resi 94   and name HA   )  5.00  5.00  0.00
assi (resi 88   and name HB2  ) (resi 94   and name HA   )  5.00  5.00  0.00 
assi (resi 88   and name HA   ) (resi 95   and name HN   )  3.50  3.50  0.00
assi (resi 88   and name HA   ) (resi 95   and name HG1  )  5.00  5.00  0.00 
assi (resi 88   and name HA   ) (resi 95   and name HG2  )  5.00  5.00  0.00 
assi (resi 88	and name HA   ) (resi 95   and name HE21 )  6.00  6.00  0.00 
assi (resi 88   and name HB1  ) (resi 95   and name HN   )  5.00  5.00  0.00
assi (resi 88   and name HB2  ) (resi 95   and name HN   )  5.00  5.00  0.00
! residue 89   Val , NOEs forward in sequence
assi (resi 89   and name HN   ) (resi 90   and name HN   )  3.50  3.50  0.00 
assi (resi 89   and name HN   ) (resi 90   and name HB#  )  6.00  6.00  0.00 
assi (resi 89   and name HA   ) (resi 90   and name HN   )  5.00  5.00  0.00 
assi (resi 89   and name HB   ) (resi 90   and name HN   )  3.50  3.50  0.00
assi (resi 89   and name HG1# ) (resi 90   and name HN   )  5.00  5.00  0.00
assi (resi 89   and name HG2# ) (resi 90   and name HN   )  5.00  5.00  0.00
assi (resi 89   and name HA   ) (resi 92   and name HA   )  3.50  3.50  0.00
assi (resi 89   and name HG1# ) (resi 92   and name HE#  )  6.00  6.00  0.00
! residue 90   Ala , NOEs forward in sequence
assi (resi 90   and name HN   ) (resi 91   and name HN   )  3.50  3.50  0.00
assi (resi 90   and name HN   ) (resi 91   and name HB1  )  5.00  5.00  0.00 
assi (resi 90   and name HA   ) (resi 91   and name HN   )  5.00  5.00  0.00
assi (resi 90   and name HB#  ) (resi 91   and name HN   )  3.50  3.50  0.00
assi (resi 90   and name HN   ) (resi 92   and name HN   )  5.00  5.00  0.00 
assi (resi 90   and name HB#  ) (resi 92   and name HN   )  6.00  6.00  0.00
! residue 91   Leu , NOEs forward in sequence
assi (resi 91   and name HN   ) (resi 92   and name HN   )  2.50  2.50  0.00
assi (resi 91   and name HA   ) (resi 92   and name HN   )  3.50  3.50  0.00
assi (resi 91   and name HD1# ) (resi 92   and name HN   )  6.00  6.00  0.00 
assi (resi 91   and name HD2# ) (resi 92   and name HN   )  6.00  6.00  0.00 
assi (resi 91   and name HN   ) (resi 93   and name HN   )  5.00  5.00  0.00 
assi (resi 91	and name HD2# ) (resi 95   and name HE21 )  5.00  5.00  0.00 
assi (resi 91	and name HD2# ) (resi 95   and name HE22 )  5.00  5.00  0.00 
! residue 92   Tyr , NOEs forward in sequence
assi (resi 92   and name HN   ) (resi 93   and name HN   )  3.50  3.50  0.00 
assi (resi 92   and name HA   ) (resi 93   and name HN   )  3.50  3.50  0.00 
assi (resi 92   and name HB1  ) (resi 93   and name HN   )  5.00  5.00  0.00 
! residue 93   Gln , NOEs forward in sequence
assi (resi 93   and name HN   ) (resi 94   and name HN   )  6.00  6.00  0.00
assi (resi 93   and name HA   ) (resi 94   and name HN   )  3.50  3.50  0.00
assi (resi 93   and name HB1  ) (resi 94   and name HN   )  5.00  5.00  0.00 
assi (resi 93   and name HB1  ) (resi 94   and name HN   )  5.00  5.00  0.00
assi (resi 93   and name HB2  ) (resi 94   and name HN   )  5.00  5.00  0.00 
assi (resi 93   and name HG1  ) (resi 94   and name HN   )  5.00  5.00  0.00 
assi (resi 93   and name HG2  ) (resi 94   and name HN   )  5.00  5.00  0.00 
! residue 94   Cys , NOEs forward in sequence
assi (resi 94   and name HA   ) (resi 95   and name HN   )  2.50  2.50  0.00
! residue 95   Gln , NOEs forward in sequence
assi (resi 95   and name HA   ) (resi 96   and name HN   )  2.50  2.50  0.00
assi (resi 95   and name HB1  ) (resi 96   and name HN   )  3.50  3.50  0.00
assi (resi 95   and name HB2  ) (resi 96   and name HN   )  5.00  5.00  0.00
assi (resi 95   and name HG2  ) (resi 96   and name HN   )  5.00  5.00  0.00
assi (resi 95   and name HA   ) (resi 100  and name HE#  )  6.00  6.00  0.00
assi (resi 95   and name HB1  ) (resi 100  and name HE#  )  5.00  5.00  0.00 
assi (resi 95   and name HB2  ) (resi 100  and name HE#  )  5.00  5.00  0.00 
assi (resi 95   and name HG1  ) (resi 100  and name HE#  )  5.00  5.00  0.00
assi (resi 95   and name HE21 ) (resi 100  and name HE#  )  5.00  5.00  0.00
! residue 96   Glu , NOEs forward in sequence
assi (resi 96   and name HN   ) (resi 97   and name HN   )  5.00  5.00  0.00
assi (resi 96   and name HA   ) (resi 97   and name HN   )  3.50  3.50  0.00 
assi (resi 96   and name HA   ) (resi 97   and name HD1# )  6.00  6.00  0.00
assi (resi 96   and name HB1  ) (resi 97   and name HN   )  5.00  5.00  0.00
assi (resi 96   and name HB2  ) (resi 97   and name HN   )  3.50  3.50  0.00
assi (resi 96   and name HB1  ) (resi 98   and name HN   )  5.00  5.00  0.00 
assi (resi 96   and name HB2  ) (resi 98   and name HN   )  3.50  3.50  0.00 
assi (resi 96   and name HN   ) (resi 100  and name HE#  )  6.00  6.00  0.00
! residue 97   Leu , NOEs forward in sequence
assi (resi 97   and name HN   ) (resi 98   and name HN   )  3.50  3.50  0.00
assi (resi 97   and name HA   ) (resi 98   and name HN   )  3.50  3.50  0.00 
assi (resi 97   and name HB1  ) (resi 98   and name HN   )  5.00  5.00  0.00 
assi (resi 97   and name HB2  ) (resi 98   and name HN   )  5.00  5.00  0.00 
assi (resi 97   and name HG   ) (resi 98   and name HN   )  5.00  5.00  0.00 
assi (resi 97   and name HD1# ) (resi 98   and name HN   )  6.00  6.00  0.00 
assi (resi 97   and name HD2# ) (resi 98   and name HN   )  6.00  6.00  0.00 
assi (resi 97   and name HN   ) (resi 99   and name HN   )  5.00  5.00  0.00
assi (resi 97   and name HA   ) (resi 100  and name HN   )  5.00  5.00  0.00 
assi (resi 97   and name HA   ) (resi 100  and name HD#  )  5.00  5.00  0.00
assi (resi 97   and name HA   ) (resi 100  and name HE#  )  5.00  5.00  0.00
assi (resi 97   and name HD1# ) (resi 100  and name HD#  )  6.00  6.00  0.00
assi (resi 97	and name HB1  ) (resi 101  and name HD1# )  6.00  6.00  0.00 
assi (resi 97	and name HB2  ) (resi 101  and name HD1# )  6.00  6.00  0.00 
assi (resi 97   and name HG   ) (resi 101  and name HA   )  6.00  6.00  0.00 
assi (resi 97	and name HG   ) (resi 101  and name HD1# )  6.00  6.00  0.00 
! residue 98   Asp , NOEs forward in sequence
assi (resi 98   and name HN   ) (resi 99   and name HN   )  3.50  3.50  0.00
assi (resi 98   and name HA   ) (resi 99   and name HN   )  3.50  3.50  0.00
assi (resi 98   and name HB#  ) (resi 99   and name HN   )  3.50  3.50  0.00
assi (resi 98   and name HA   ) (resi 100  and name HN   )  5.00  5.00  0.00
assi (resi 98   and name HN   ) (resi 101  and name HD1# )  5.00  5.00  0.00
assi (resi 98   and name HA   ) (resi 101  and name HN   )  5.00  5.00  0.00 
assi (resi 98   and name HA   ) (resi 101  and name HB1  )  3.50  3.50  0.00 
assi (resi 98   and name HA   ) (resi 101  and name HB2  )  5.00  5.00  0.00 
assi (resi 98   and name HA   ) (resi 101  and name HD1# )  3.50  3.50  0.00
assi (resi 98   and name HA   ) (resi 101  and name HD2# )  5.00  5.00  0.00
! residue 99   Thr , NOEs forward in sequence
assi (resi 99   and name HN   ) (resi 100  and name HN   )  3.50  3.50  0.00
assi (resi 99   and name HN   ) (resi 100  and name HD#  )  6.00  6.00  0.00
assi (resi 99   and name HA   ) (resi 100  and name HN   )  5.00  5.00  0.00
assi (resi 99   and name HB   ) (resi 100  and name HN   )  5.00  5.00  0.00
assi (resi 99   and name HG2# ) (resi 100  and name HN   )  6.00  6.00  0.00
assi (resi 99   and name HN   ) (resi 101  and name HN   )  5.00  5.00  0.00
assi (resi 99   and name HG2# ) (resi 101  and name HN   )  6.00  6.00  0.00
! residue 100  Tyr , NOEs forward in sequence
assi (resi 100  and name HN   ) (resi 101  and name HN   )  3.50  3.50  0.00 
assi (resi 100  and name HN   ) (resi 101  and name HB1  )  5.00  5.00  0.00 
assi (resi 100  and name HN   ) (resi 101  and name HB2  )  5.00  5.00  0.00 
assi (resi 100  and name HN   ) (resi 101  and name HD1# )  6.00  6.00  0.00
assi (resi 100  and name HA   ) (resi 101  and name HN   )  5.00  5.00  0.00
assi (resi 100  and name HB1  ) (resi 101  and name HN   )  5.00  5.00  0.00 
! residue 101  Leu , NOEs forward in sequence
assi (resi 101  and name HN   ) (resi 102  and name HN   )  6.00  6.00  0.00
assi (resi 101  and name HA   ) (resi 102  and name HN   )  3.50  3.50  0.00 
assi (resi 101  and name HB1  ) (resi 102  and name HN   )  5.00  5.00  0.00 
assi (resi 101  and name HB2  ) (resi 102  and name HN   )  5.00  5.00  0.00
assi (resi 101  and name HD1# ) (resi 102  and name HN   )  6.00  6.00  0.00 
assi (resi 101  and name HD2# ) (resi 102  and name HN   )  5.00  5.00  0.00 
! residue 102  Ile , NOEs forward in sequence
assi (resi 102  and name HA   ) (resi 103  and name HD1  )  2.50  2.50  0.00
assi (resi 102  and name HA   ) (resi 103  and name HD2  )  3.50  3.50  0.00
! residue 103  Pro , NOEs forward in sequence
assi (resi 103  and name HA   ) (resi 104  and name HN   )  3.50  3.50  0.00 
assi (resi 103  and name HB1  ) (resi 104  and name HN   )  3.50  3.50  0.00
assi (resi 103  and name HG1  ) (resi 104  and name HN   )  5.00  5.00  0.00
assi (resi 103  and name HG2  ) (resi 104  and name HA   )  6.00  6.00  0.00 
! residue 104  Gln , NOEs forward in sequence
! residue 105  Ile , NOEs forward in sequence
assi (resi 105  and name HA   ) (resi 106  and name HD2  )  3.50  3.50  0.00
assi (resi 105  and name HB   ) (resi 106  and name HD1  )  5.00  5.00  0.00
assi (resi 105  and name HG2# ) (resi 106  and name HD1  )  5.00  5.00  0.00
assi (resi 105  and name HG2# ) (resi 106  and name HD2  )  6.00  6.00  0.00
assi (resi 105  and name HD1# ) (resi 106  and name HD2  )  6.00  6.00  0.00  
! residue 106  Pro , NOEs forward in sequence
! residue 107  His , NOEs forward in sequence
! residue 108  Ser , NOEs forward in sequence
! residue 109  His , NOEs forward in sequence
!Experimental restraints
assign ( resid 16 and name HN ) ( resid 56 and name O ) 2.2 2.2 0.3
assign ( resid 29 and name HN ) ( resid 25 and name O ) 2.2 2.2 0.3
assign ( resid 32 and name HN ) ( resid 28 and name O ) 2.2 2.2 0.3
assign ( resid 44 and name HN ) ( resid 41 and name O ) 2.2 2.2 0.3  
assign ( resid 45 and name HN ) ( resid 42 and name O ) 2.2 2.2 0.3  
assign ( resid 55 and name HN ) ( resid 78 and name O ) 2.2 2.2 0.3  
assign ( resid 61 and name HN ) ( resid 19 and name O ) 2.2 2.2 0.3
assign ( resid 87 and name HN ) ( resid 83 and name O ) 2.2 2.2 0.3  
assign ( resid 91 and name HN ) ( resid 87 and name O ) 2.2 2.2 0.3
assign ( resid 92 and name HN ) ( resid 88 and name O ) 2.2 2.2 0.3
assign ( resid 93 and name HN ) ( resid 88 and name O ) 2.2 2.2 0.3
assign ( resid 46 and name HN ) ( resid 12 and name OE1 ) 2.2 2.2 0.3

!Non-experimental restraints a-helix 
assign ( resid 28 and name HN ) ( resid 24 and name O ) 2.2 2.2 0.3
assign ( resid 30 and name HN ) ( resid 26 and name O ) 2.2 2.2 0.3
assign ( resid 31 and name HN ) ( resid 27 and name O ) 2.2 2.2 0.3
assign ( resid 33 and name HN ) ( resid 29 and name O ) 2.2 2.2 0.3
assign ( resid 34 and name HN ) ( resid 30 and name O ) 2.2 2.2 0.3
assign ( resid 74 and name HN ) ( resid 70 and name O ) 2.2 2.2 0.3
assign ( resid 75 and name HN ) ( resid 71 and name O ) 2.2 2.2 0.3
assign ( resid 86 and name HN ) ( resid 82 and name O ) 2.2 2.2 0.3
assign ( resid 88 and name HN ) ( resid 84 and name O ) 2.2 2.2 0.3
assign ( resid 89 and name HN ) ( resid 85 and name O ) 2.2 2.2 0.3
assign ( resid 90 and name HN ) ( resid 86 and name O ) 2.2 2.2 0.3

!Non-experimental restraints b-sheet
assign ( resid 37 and name HN ) ( resid 11 and name O ) 2.2 2.2 0.3
assign ( resid 39 and name HN ) ( resid 13 and name O ) 2.2 2.2 0.3
assign ( resid 13 and name HN ) ( resid 37 and name O ) 2.2 2.2 0.3
assign ( resid 12 and name HN ) ( resid 52 and name O ) 2.2 2.2 0.3
assign ( resid 14 and name HN ) ( resid 54 and name O ) 2.2 2.2 0.3
assign ( resid 52 and name HN ) ( resid 10 and name O ) 2.2 2.2 0.3  
assign ( resid 54 and name HN ) ( resid 12 and name O ) 2.2 2.2 0.3
assign ( resid 56 and name HN ) ( resid 14 and name O ) 2.2 2.2 0.3
assign ( resid 57 and name HN ) ( resid 80 and name O ) 2.2 2.2 0.3  
assign ( resid 80 and name HN ) ( resid 55 and name O ) 2.2 2.2 0.3

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1HT       GLY   1 -11.644 -24.913  -2.157
    2   2H    GLY   1          2HT       GLY   1 -12.201 -24.148  -3.559
    3   3H    GLY   1          3HT       GLY   1 -12.533 -25.787  -3.302
    4   1HA   GLY   1          1HA       GLY   1 -13.588 -24.730  -1.088
    5   2HA   GLY   1          2HA       GLY   1 -13.855 -23.435  -2.245
    6    H    SER   2           H        SER   2 -16.068 -23.653  -2.347
    7    HA   SER   2           HA       SER   2 -17.043 -26.172  -3.527
    8   1HB   SER   2          2HB       SER   2 -19.170 -25.820  -2.428
    9   2HB   SER   2          1HB       SER   2 -17.892 -25.724  -1.217
   10    HG   SER   2           HG       SER   2 -18.048 -23.467  -1.308
   11    H    GLN   3           H        GLN   3 -18.149 -22.794  -3.197
   12    HA   GLN   3           HA       GLN   3 -18.658 -22.780  -6.099
   13   1HB   GLN   3          2HB       GLN   3 -20.404 -21.866  -3.840
   14   2HB   GLN   3          1HB       GLN   3 -20.534 -21.095  -5.415
   15   1HG   GLN   3          2HG       GLN   3 -20.801 -23.483  -6.327
   16   2HG   GLN   3          1HG       GLN   3 -21.128 -23.925  -4.652
   17   1HE2  GLN   3          1HE2      GLN   3 -22.027 -21.200  -6.744
   18   2HE2  GLN   3          2HE2      GLN   3 -23.726 -21.311  -6.448
   19    H    ASP   4           H        ASP   4 -16.361 -21.826  -4.486
   20    HA   ASP   4           HA       ASP   4 -16.250 -19.144  -5.610
   21   1HB   ASP   4          2HB       ASP   4 -15.747 -19.708  -2.682
   22   2HB   ASP   4          1HB       ASP   4 -15.346 -18.197  -3.492
   23    H    ARG   5           H        ARG   5 -13.934 -18.217  -5.107
   24    HA   ARG   5           HA       ARG   5 -11.845 -20.148  -4.810
   25   1HB   ARG   5          2HB       ARG   5 -12.869 -20.169  -7.298
   26   2HB   ARG   5          1HB       ARG   5 -11.698 -18.869  -7.478
   27   1HG   ARG   5          2HG       ARG   5 -10.069 -20.587  -6.367
   28   2HG   ARG   5          1HG       ARG   5 -11.254 -21.764  -6.938
   29   1HD   ARG   5          2HD       ARG   5 -10.766 -19.949  -9.056
   30   2HD   ARG   5          1HD       ARG   5  -9.202 -20.428  -8.401
   31    HE   ARG   5           HE       ARG   5  -9.520 -22.508  -9.284
   32   1HH1  ARG   5          1HH1      ARG   5 -12.605 -20.882  -9.140
   33   2HH1  ARG   5          2HH1      ARG   5 -13.443 -22.129 -10.001
   34   1HH2  ARG   5          1HH2      ARG   5 -10.621 -24.149 -10.418
   35   2HH2  ARG   5          2HH2      ARG   5 -12.317 -23.983 -10.727
   36    H    LYS   6           H        LYS   6 -12.345 -17.083  -6.535
   37    HA   LYS   6           HA       LYS   6 -11.395 -15.028  -6.313
   38   1HB   LYS   6          2HB       LYS   6 -10.403 -15.769  -3.576
   39   2HB   LYS   6          1HB       LYS   6 -10.946 -14.211  -4.167
   40   1HG   LYS   6          2HG       LYS   6 -12.973 -16.345  -4.156
   41   2HG   LYS   6          1HG       LYS   6 -12.409 -15.795  -2.577
   42   1HD   LYS   6          2HD       LYS   6 -12.780 -13.418  -3.702
   43   2HD   LYS   6          1HD       LYS   6 -13.930 -14.338  -4.673
   44   1HE   LYS   6          2HE       LYS   6 -15.358 -13.914  -2.995
   45   2HE   LYS   6          1HE       LYS   6 -14.514 -15.221  -2.168
   46   1HZ   LYS   6          1HZ       LYS   6 -13.627 -12.407  -1.957
   47   2HZ   LYS   6          2HZ       LYS   6 -13.229 -13.710  -0.954
   48   3HZ   LYS   6          3HZ       LYS   6 -14.790 -13.058  -0.914
   49    H    ILE   7           H        ILE   7  -9.505 -14.183  -7.012
   50    HA   ILE   7           HA       ILE   7  -7.293 -15.964  -7.412
   51    HB   ILE   7           HB       ILE   7  -6.188 -13.875  -8.379
   52   1HG1  ILE   7          2HG1      ILE   7  -8.968 -12.742  -8.400
   53   2HG1  ILE   7          1HG1      ILE   7  -7.880 -12.398  -7.064
   54   1HG2  ILE   7          1HG2      ILE   7  -8.086 -13.902 -10.274
   55   2HG2  ILE   7          2HG2      ILE   7  -8.524 -15.362  -9.389
   56   3HG2  ILE   7          3HG2      ILE   7  -6.904 -15.192 -10.064
   57   1HD1  ILE   7          1HD1      ILE   7  -7.106 -10.707  -8.261
   58   2HD1  ILE   7          2HD1      ILE   7  -7.974 -11.248  -9.699
   59   3HD1  ILE   7          3HD1      ILE   7  -6.373 -11.895  -9.338
   60    H    PHE   8           H        PHE   8  -8.123 -13.631  -5.023
   61    HA   PHE   8           HA       PHE   8  -5.360 -13.370  -4.109
   62   1HB   PHE   8          2HB       PHE   8  -7.940 -12.032  -3.303
   63   2HB   PHE   8          1HB       PHE   8  -6.459 -11.845  -2.374
   64    HD1  PHE   8           1HD      PHE   8  -4.752 -11.957  -5.082
   65    HD2  PHE   8           2HD      PHE   8  -8.012  -9.614  -3.662
   66    HE1  PHE   8           1HE      PHE   8  -4.067 -10.116  -6.554
   67    HE2  PHE   8           2HE      PHE   8  -7.331  -7.770  -5.136
   68    HZ   PHE   8           HZ       PHE   8  -5.356  -8.018  -6.586
   69    H    ARG   9           H        ARG   9  -8.511 -14.492  -2.875
   70    HA   ARG   9           HA       ARG   9  -9.055 -15.787  -1.070
   71   1HB   ARG   9          2HB       ARG   9  -8.253 -17.457  -2.675
   72   2HB   ARG   9          1HB       ARG   9  -6.614 -17.268  -2.065
   73   1HG   ARG   9          2HG       ARG   9  -7.586 -17.969   0.201
   74   2HG   ARG   9          1HG       ARG   9  -8.982 -18.520  -0.727
   75   1HD   ARG   9          2HD       ARG   9  -7.881 -20.294  -1.560
   76   2HD   ARG   9          1HD       ARG   9  -6.394 -19.378  -1.803
   77    HE   ARG   9           HE       ARG   9  -6.955 -19.960   0.955
   78   1HH1  ARG   9          1HH1      ARG   9  -5.489 -21.153  -1.979
   79   2HH1  ARG   9          2HH1      ARG   9  -4.413 -22.229  -1.152
   80   1HH2  ARG   9          1HH2      ARG   9  -5.541 -21.374   2.045
   81   2HH2  ARG   9          2HH2      ARG   9  -4.443 -22.355   1.132
   82    H    GLY  10           H        GLY  10  -8.721 -14.425   0.666
   83   1HA   GLY  10          2HA       GLY  10  -7.837 -13.916   2.741
   84   2HA   GLY  10          1HA       GLY  10  -6.690 -15.230   2.511
   85    H    LEU  11           H        LEU  11  -7.380 -11.898   1.605
   86    HA   LEU  11           HA       LEU  11  -4.515 -11.326   1.655
   87   1HB   LEU  11          2HB       LEU  11  -5.670 -11.825  -0.707
   88   2HB   LEU  11          1HB       LEU  11  -6.059 -10.123  -0.572
   89    HG   LEU  11           HG       LEU  11  -3.237 -11.036  -0.193
   90   1HD1  LEU  11          1HD1      LEU  11  -4.224 -12.012  -2.320
   91   2HD1  LEU  11          2HD1      LEU  11  -2.783 -11.011  -2.495
   92   3HD1  LEU  11          3HD1      LEU  11  -4.370 -10.348  -2.886
   93   1HD2  LEU  11          1HD2      LEU  11  -3.037  -8.838   0.091
   94   2HD2  LEU  11          2HD2      LEU  11  -4.683  -8.544  -0.464
   95   3HD2  LEU  11          3HD2      LEU  11  -3.369  -8.671  -1.632
   96    H    GLU  12           H        GLU  12  -4.040  -9.022   1.783
   97    HA   GLU  12           HA       GLU  12  -6.296  -7.340   2.619
   98   1HB   GLU  12          2HB       GLU  12  -4.058  -8.283   4.276
   99   2HB   GLU  12          1HB       GLU  12  -4.330  -6.548   4.348
  100   1HG   GLU  12          2HG       GLU  12  -6.197  -6.772   5.548
  101   2HG   GLU  12          1HG       GLU  12  -6.776  -8.120   4.570
  102    H    ILE  13           H        ILE  13  -6.274  -5.643   1.287
  103    HA   ILE  13           HA       ILE  13  -3.674  -4.404   0.658
  104    HB   ILE  13           HB       ILE  13  -6.008  -4.475  -1.247
  105   1HG1  ILE  13          2HG1      ILE  13  -3.718  -6.005  -2.116
  106   2HG1  ILE  13          1HG1      ILE  13  -4.313  -6.620  -0.576
  107   1HG2  ILE  13          1HG2      ILE  13  -4.017  -2.720  -1.226
  108   2HG2  ILE  13          2HG2      ILE  13  -4.708  -3.341  -2.725
  109   3HG2  ILE  13          3HG2      ILE  13  -3.206  -4.020  -2.098
  110   1HD1  ILE  13          1HD1      ILE  13  -6.630  -6.518  -1.743
  111   2HD1  ILE  13          2HD1      ILE  13  -5.525  -7.848  -2.091
  112   3HD1  ILE  13          3HD1      ILE  13  -5.673  -6.506  -3.223
  113    H    CYS  14           H        CYS  14  -3.523  -2.305   1.117
  114    HA   CYS  14           HA       CYS  14  -6.013  -0.819   1.632
  115   1HB   CYS  14          2HB       CYS  14  -4.714   0.546   3.226
  116   2HB   CYS  14          1HB       CYS  14  -4.744  -1.152   3.676
  117    HG   CYS  14           HG       CYS  14  -2.254  -1.224   2.575
  118    H    CYS  15           H        CYS  15  -6.376   0.996   0.531
  119    HA   CYS  15           HA       CYS  15  -4.327   1.876  -1.364
  120   1HB   CYS  15          2HB       CYS  15  -6.183   3.101  -2.458
  121   2HB   CYS  15          1HB       CYS  15  -6.505   1.377  -2.324
  122    HG   CYS  15           HG       CYS  15  -7.790   3.214  -0.201
  123    H    TYR  16           H        TYR  16  -2.995   3.346  -0.502
  124    HA   TYR  16           HA       TYR  16  -4.039   5.341   1.353
  125   1HB   TYR  16          2HB       TYR  16  -1.656   3.942   1.260
  126   2HB   TYR  16          1HB       TYR  16  -1.202   5.537   0.668
  127    HD1  TYR  16           1HD      TYR  16  -3.730   4.600   3.241
  128    HD2  TYR  16           2HD      TYR  16  -0.019   6.514   2.421
  129    HE1  TYR  16           1HE      TYR  16  -3.651   5.427   5.556
  130    HE2  TYR  16           2HE      TYR  16   0.070   7.346   4.732
  131    HH   TYR  16           HH       TYR  16  -0.977   6.527   7.026
  132    H    GLY  17           H        GLY  17  -4.407   7.403   0.830
  133   1HA   GLY  17          2HA       GLY  17  -3.881   9.437  -0.301
  134   2HA   GLY  17          1HA       GLY  17  -3.184   8.492  -1.609
  135    HA   PRO  18           HA       PRO  18  -7.696   9.592  -2.513
  136   1HB   PRO  18          2HB       PRO  18  -7.491  11.865  -3.912
  137   2HB   PRO  18          1HB       PRO  18  -7.526  11.871  -2.144
  138   1HG   PRO  18          2HG       PRO  18  -5.186  12.116  -3.994
  139   2HG   PRO  18          1HG       PRO  18  -5.534  13.013  -2.506
  140   1HD   PRO  18          2HD       PRO  18  -3.818  10.867  -2.655
  141   2HD   PRO  18          1HD       PRO  18  -4.655  11.375  -1.175
  142    H    PHE  19           H        PHE  19  -4.754   9.394  -4.309
  143    HA   PHE  19           HA       PHE  19  -4.240   8.567  -6.358
  144   1HB   PHE  19          2HB       PHE  19  -7.033   7.476  -6.066
  145   2HB   PHE  19          1HB       PHE  19  -6.054   7.159  -7.495
  146    HD1  PHE  19           1HD      PHE  19  -5.130   5.063  -7.500
  147    HD2  PHE  19           2HD      PHE  19  -5.455   7.158  -3.810
  148    HE1  PHE  19           1HE      PHE  19  -4.052   3.181  -6.339
  149    HE2  PHE  19           2HE      PHE  19  -4.379   5.279  -2.642
  150    HZ   PHE  19           HZ       PHE  19  -3.676   3.287  -3.908
  151    H    THR  20           H        THR  20  -7.652   9.148  -7.069
  152    HA   THR  20           HA       THR  20  -7.066  11.605  -8.475
  153    HB   THR  20           HB       THR  20  -8.357  10.416 -10.519
  154    HG1  THR  20           1HG      THR  20  -8.254   8.346 -10.358
  155   1HG2  THR  20          1HG2      THR  20  -5.584  11.036  -9.964
  156   2HG2  THR  20          2HG2      THR  20  -6.526  11.261 -11.438
  157   3HG2  THR  20          3HG2      THR  20  -5.765   9.705 -11.107
  158    H    ASN  21           H        ASN  21  -9.648   9.222  -8.980
  159    HA   ASN  21           HA       ASN  21 -11.525  10.441  -7.258
  160   1HB   ASN  21          2HB       ASN  21 -11.209  12.140  -9.208
  161   2HB   ASN  21          1HB       ASN  21 -12.176  10.997 -10.135
  162   1HD2  ASN  21          1HD2      ASN  21 -14.304  11.153 -10.010
  163   2HD2  ASN  21          2HD2      ASN  21 -15.180  12.067  -8.834
  164    H    MET  22           H        MET  22 -10.893   7.871  -7.472
  165    HA   MET  22           HA       MET  22 -13.317   6.567  -7.877
  166   1HB   MET  22          2HB       MET  22 -12.209   7.095 -10.322
  167   2HB   MET  22          1HB       MET  22 -11.590   5.481  -9.996
  168   1HG   MET  22          2HG       MET  22 -13.722   4.548  -9.916
  169   2HG   MET  22          1HG       MET  22 -14.499   6.114  -9.694
  170   1HE   MET  22          1HE       MET  22 -14.722   7.798 -11.127
  171   2HE   MET  22          2HE       MET  22 -15.722   7.236 -12.468
  172   3HE   MET  22          3HE       MET  22 -14.136   7.941 -12.784
  173    HA   PRO  23           HA       PRO  23  -9.739   3.316  -7.281
  174   1HB   PRO  23          2HB       PRO  23  -7.367   5.032  -6.942
  175   2HB   PRO  23          1HB       PRO  23  -7.567   3.573  -7.917
  176   1HG   PRO  23          2HG       PRO  23  -7.359   5.995  -9.046
  177   2HG   PRO  23          1HG       PRO  23  -8.411   4.739  -9.725
  178   1HD   PRO  23          2HD       PRO  23  -9.134   7.111  -8.040
  179   2HD   PRO  23          1HD       PRO  23  -9.954   6.456  -9.474
  180    H    THR  24           H        THR  24 -11.305   4.122  -5.397
  181    HA   THR  24           HA       THR  24  -9.606   4.272  -3.026
  182    HB   THR  24           HB       THR  24 -11.885   5.835  -2.418
  183    HG1  THR  24           1HG      THR  24 -11.977   6.153  -4.737
  184   1HG2  THR  24          1HG2      THR  24  -9.506   7.396  -2.952
  185   2HG2  THR  24          2HG2      THR  24  -9.170   5.963  -1.981
  186   3HG2  THR  24          3HG2      THR  24 -10.377   7.131  -1.441
  187    H    ASP  25           H        ASP  25 -13.115   4.488  -3.600
  188    HA   ASP  25           HA       ASP  25 -13.540   2.327  -1.700
  189   1HB   ASP  25          2HB       ASP  25 -15.646   3.824  -3.270
  190   2HB   ASP  25          1HB       ASP  25 -15.863   2.905  -1.783
  191    H    GLN  26           H        GLN  26 -13.666   2.976  -5.106
  192    HA   GLN  26           HA       GLN  26 -14.988   0.525  -5.808
  193   1HB   GLN  26          2HB       GLN  26 -14.537   2.910  -7.092
  194   2HB   GLN  26          1HB       GLN  26 -13.371   1.852  -7.872
  195   1HG   GLN  26          2HG       GLN  26 -15.350   0.239  -8.167
  196   2HG   GLN  26          1HG       GLN  26 -16.352   1.644  -7.803
  197   1HE2  GLN  26          1HE2      GLN  26 -13.418   1.099  -9.728
  198   2HE2  GLN  26          2HE2      GLN  26 -14.026   1.824 -11.173
  199    H    LEU  27           H        LEU  27 -11.763   1.589  -5.196
  200    HA   LEU  27           HA       LEU  27 -10.414  -0.520  -6.571
  201   1HB   LEU  27          2HB       LEU  27  -9.481   1.765  -5.888
  202   2HB   LEU  27          1HB       LEU  27  -9.315   1.090  -4.278
  203    HG   LEU  27           HG       LEU  27  -7.857  -0.700  -5.262
  204   1HD1  LEU  27          1HD1      LEU  27  -7.319  -0.794  -7.447
  205   2HD1  LEU  27          2HD1      LEU  27  -7.329   0.959  -7.635
  206   3HD1  LEU  27          3HD1      LEU  27  -8.847   0.062  -7.649
  207   1HD2  LEU  27          1HD2      LEU  27  -7.202   1.718  -4.330
  208   2HD2  LEU  27          2HD2      LEU  27  -6.547   1.857  -5.961
  209   3HD2  LEU  27          3HD2      LEU  27  -6.006   0.554  -4.901
  210    H    GLU  28           H        GLU  28 -11.198   0.108  -3.144
  211    HA   GLU  28           HA       GLU  28 -10.084  -2.311  -2.191
  212   1HB   GLU  28          2HB       GLU  28 -11.568  -1.881  -0.182
  213   2HB   GLU  28          1HB       GLU  28 -10.433  -0.605  -0.597
  214   1HG   GLU  28          2HG       GLU  28 -12.059   0.871  -0.966
  215   2HG   GLU  28          1HG       GLU  28 -13.025  -0.288  -1.879
  216    H    TRP  29           H        TRP  29 -13.122  -1.520  -3.660
  217    HA   TRP  29           HA       TRP  29 -14.547  -3.841  -2.827
  218   1HB   TRP  29          2HB       TRP  29 -15.962  -2.152  -3.588
  219   2HB   TRP  29          1HB       TRP  29 -14.913  -1.743  -4.940
  220    HD1  TRP  29           HD       TRP  29 -17.165  -4.727  -3.901
  221    HE1  TRP  29           1HE      TRP  29 -18.300  -5.641  -6.025
  222    HE3  TRP  29           3HE      TRP  29 -14.979  -1.669  -7.360
  223    HZ2  TRP  29           2HZ      TRP  29 -18.267  -5.130  -8.802
  224    HZ3  TRP  29           3HZ      TRP  29 -15.583  -1.946  -9.729
  225    HH2  TRP  29           HH       TRP  29 -17.191  -3.643 -10.434
  226    H    MET  30           H        MET  30 -12.829  -2.946  -5.780
  227    HA   MET  30           HA       MET  30 -13.172  -5.280  -7.235
  228   1HB   MET  30          2HB       MET  30 -10.799  -3.407  -7.184
  229   2HB   MET  30          1HB       MET  30 -11.067  -4.642  -8.404
  230   1HG   MET  30          2HG       MET  30 -12.743  -3.489  -9.416
  231   2HG   MET  30          1HG       MET  30 -13.234  -2.681  -7.929
  232   1HE   MET  30          1HE       MET  30  -9.996  -3.299  -9.623
  233   2HE   MET  30          2HE       MET  30  -9.195  -1.731  -9.711
  234   3HE   MET  30          3HE       MET  30 -10.313  -2.221 -10.983
  235    H    VAL  31           H        VAL  31 -10.546  -4.461  -4.951
  236    HA   VAL  31           HA       VAL  31  -9.163  -6.905  -5.216
  237    HB   VAL  31           HB       VAL  31  -8.151  -6.377  -3.015
  238   1HG1  VAL  31          1HG1      VAL  31  -7.918  -4.950  -5.415
  239   2HG1  VAL  31          2HG1      VAL  31  -6.730  -5.073  -4.118
  240   3HG1  VAL  31          3HG1      VAL  31  -7.890  -3.742  -4.129
  241   1HG2  VAL  31          1HG2      VAL  31 -10.044  -5.394  -1.893
  242   2HG2  VAL  31          2HG2      VAL  31 -10.067  -4.061  -3.047
  243   3HG2  VAL  31          3HG2      VAL  31  -8.714  -4.237  -1.932
  244    H    GLN  32           H        GLN  32 -11.659  -5.814  -2.975
  245    HA   GLN  32           HA       GLN  32 -11.825  -8.086  -1.359
  246   1HB   GLN  32          2HB       GLN  32 -13.431  -5.716  -1.892
  247   2HB   GLN  32          1HB       GLN  32 -14.431  -7.116  -1.542
  248   1HG   GLN  32          2HG       GLN  32 -12.275  -6.998   0.328
  249   2HG   GLN  32          1HG       GLN  32 -13.092  -5.437   0.268
  250   1HE2  GLN  32          1HE2      GLN  32 -14.232  -5.443   2.102
  251   2HE2  GLN  32          2HE2      GLN  32 -15.409  -6.631   2.534
  252    H    LEU  33           H        LEU  33 -13.232  -7.331  -4.471
  253    HA   LEU  33           HA       LEU  33 -14.959  -9.584  -4.629
  254   1HB   LEU  33          2HB       LEU  33 -15.174  -7.475  -5.966
  255   2HB   LEU  33          1HB       LEU  33 -13.778  -7.983  -6.897
  256    HG   LEU  33           HG       LEU  33 -14.986  -9.918  -7.730
  257   1HD1  LEU  33          1HD1      LEU  33 -17.518  -9.928  -7.222
  258   2HD1  LEU  33          2HD1      LEU  33 -17.071  -8.996  -5.794
  259   3HD1  LEU  33          3HD1      LEU  33 -16.407 -10.612  -6.036
  260   1HD2  LEU  33          1HD2      LEU  33 -16.071  -8.761  -9.330
  261   2HD2  LEU  33          2HD2      LEU  33 -15.355  -7.369  -8.519
  262   3HD2  LEU  33          3HD2      LEU  33 -17.019  -7.834  -8.168
  263    H    CYS  34           H        CYS  34 -11.587  -9.131  -5.083
  264    HA   CYS  34           HA       CYS  34 -11.283 -11.546  -6.679
  265   1HB   CYS  34          2HB       CYS  34  -9.479  -9.304  -5.868
  266   2HB   CYS  34          1HB       CYS  34  -8.769 -10.837  -6.356
  267    HG   CYS  34           HG       CYS  34  -9.976 -10.507  -8.693
  268    H    GLY  35           H        GLY  35 -11.609 -10.892  -3.446
  269   1HA   GLY  35          2HA       GLY  35 -11.537 -12.871  -1.997
  270   2HA   GLY  35          1HA       GLY  35  -9.997 -13.263  -2.742
  271    H    ALA  36           H        ALA  36  -9.543 -10.165  -2.549
  272    HA   ALA  36           HA       ALA  36  -8.028 -10.319  -0.121
  273   1HB   ALA  36          1HB       ALA  36  -8.498  -8.102  -2.096
  274   2HB   ALA  36          2HB       ALA  36  -7.059  -9.103  -1.907
  275   3HB   ALA  36          3HB       ALA  36  -7.483  -7.927  -0.664
  276    H    SER  37           H        SER  37  -8.107  -8.165   1.236
  277    HA   SER  37           HA       SER  37 -10.897  -7.575   1.942
  278   1HB   SER  37          2HB       SER  37  -9.162  -9.156   3.484
  279   2HB   SER  37          1HB       SER  37  -9.197  -7.587   4.287
  280    HG   SER  37           HG       SER  37 -11.578  -7.799   4.045
  281    H    VAL  38           H        VAL  38 -11.309  -5.471   2.400
  282    HA   VAL  38           HA       VAL  38  -9.319  -3.533   1.763
  283    HB   VAL  38           HB       VAL  38 -11.701  -3.169   1.264
  284   1HG1  VAL  38          1HG1      VAL  38 -12.370  -4.202   3.557
  285   2HG1  VAL  38          2HG1      VAL  38 -13.359  -2.926   2.847
  286   3HG1  VAL  38          3HG1      VAL  38 -12.219  -2.544   4.138
  287   1HG2  VAL  38          1HG2      VAL  38 -11.836  -0.830   2.069
  288   2HG2  VAL  38          2HG2      VAL  38 -10.263  -1.238   1.382
  289   3HG2  VAL  38          3HG2      VAL  38 -10.465  -1.149   3.132
  290    H    VAL  39           H        VAL  39  -7.735  -2.944   3.081
  291    HA   VAL  39           HA       VAL  39  -8.090  -3.174   5.971
  292    HB   VAL  39           HB       VAL  39  -5.550  -2.414   4.550
  293   1HG1  VAL  39          1HG1      VAL  39  -4.463  -2.882   6.506
  294   2HG1  VAL  39          2HG1      VAL  39  -5.704  -4.011   7.052
  295   3HG1  VAL  39          3HG1      VAL  39  -5.996  -2.273   7.129
  296   1HG2  VAL  39          1HG2      VAL  39  -5.272  -5.070   5.150
  297   2HG2  VAL  39          2HG2      VAL  39  -5.608  -4.413   3.549
  298   3HG2  VAL  39          3HG2      VAL  39  -6.933  -4.983   4.565
  299    H    LYS  40           H        LYS  40  -8.530  -1.474   7.195
  300    HA   LYS  40           HA       LYS  40  -9.007   1.082   6.223
  301   1HB   LYS  40          2HB       LYS  40  -8.832  -0.181   8.870
  302   2HB   LYS  40          1HB       LYS  40  -8.510   1.547   8.868
  303   1HG   LYS  40          2HG       LYS  40 -10.729   1.725   9.074
  304   2HG   LYS  40          1HG       LYS  40 -10.736   1.443   7.332
  305   1HD   LYS  40          2HD       LYS  40 -11.094  -0.930   7.691
  306   2HD   LYS  40          1HD       LYS  40 -10.996  -0.703   9.439
  307   1HE   LYS  40          2HE       LYS  40 -13.231  -0.547   9.336
  308   2HE   LYS  40          1HE       LYS  40 -12.928   1.093   8.760
  309   1HZ   LYS  40          1HZ       LYS  40 -12.771  -0.234   6.479
  310   2HZ   LYS  40          2HZ       LYS  40 -14.227   0.382   7.076
  311   3HZ   LYS  40          3HZ       LYS  40 -13.847  -1.250   7.298
  312    H    GLU  41           H        GLU  41  -6.183  -0.092   8.020
  313    HA   GLU  41           HA       GLU  41  -4.597   2.039   6.795
  314   1HB   GLU  41          2HB       GLU  41  -5.098   1.661   9.704
  315   2HB   GLU  41          1HB       GLU  41  -3.475   2.124   9.212
  316   1HG   GLU  41          2HG       GLU  41  -5.033   3.862   7.787
  317   2HG   GLU  41          1HG       GLU  41  -5.932   3.689   9.295
  318    H    LEU  42           H        LEU  42  -2.185   1.684   7.763
  319    HA   LEU  42           HA       LEU  42  -1.366  -0.819   6.672
  320   1HB   LEU  42          2HB       LEU  42   0.362   1.048   8.280
  321   2HB   LEU  42          1HB       LEU  42   0.860  -0.079   7.033
  322    HG   LEU  42           HG       LEU  42  -0.811   2.384   6.530
  323   1HD1  LEU  42          1HD1      LEU  42   1.165   3.398   6.971
  324   2HD1  LEU  42          2HD1      LEU  42   1.498   2.915   5.307
  325   3HD1  LEU  42          3HD1      LEU  42   2.111   1.945   6.647
  326   1HD2  LEU  42          1HD2      LEU  42  -1.279   1.255   4.651
  327   2HD2  LEU  42          2HD2      LEU  42   0.036   0.104   4.896
  328   3HD2  LEU  42          3HD2      LEU  42   0.366   1.681   4.179
  329    H    SER  43           H        SER  43  -1.623   0.495   9.937
  330    HA   SER  43           HA       SER  43  -0.409  -1.773  11.191
  331   1HB   SER  43          2HB       SER  43  -1.611   0.773  12.049
  332   2HB   SER  43          1HB       SER  43  -1.830  -0.556  13.188
  333    HG   SER  43           HG       SER  43   0.685   0.070  12.055
  334    H    SER  44           H        SER  44  -3.389  -1.368   9.736
  335    HA   SER  44           HA       SER  44  -5.021  -2.833  11.566
  336   1HB   SER  44          2HB       SER  44  -5.323  -1.650   8.882
  337   2HB   SER  44          1HB       SER  44  -6.312  -3.079   9.176
  338    HG   SER  44           HG       SER  44  -6.984  -0.744   9.854
  339    H    PHE  45           H        PHE  45  -2.779  -3.698   9.078
  340    HA   PHE  45           HA       PHE  45  -3.693  -6.170   8.248
  341   1HB   PHE  45          2HB       PHE  45  -0.851  -5.275   8.760
  342   2HB   PHE  45          1HB       PHE  45  -1.284  -6.747   7.897
  343    HD1  PHE  45           1HD      PHE  45   0.019  -3.754   7.286
  344    HD2  PHE  45           2HD      PHE  45  -3.409  -6.002   6.144
  345    HE1  PHE  45           1HE      PHE  45  -0.117  -2.473   5.191
  346    HE2  PHE  45           2HE      PHE  45  -3.550  -4.725   4.043
  347    HZ   PHE  45           HZ       PHE  45  -1.902  -2.958   3.568
  348    H    THR  46           H        THR  46  -3.765  -8.189   9.076
  349    HA   THR  46           HA       THR  46  -2.549  -8.650  11.713
  350    HB   THR  46           HB       THR  46  -5.236  -9.805  11.036
  351    HG1  THR  46           1HG      THR  46  -4.682  -7.225  12.044
  352   1HG2  THR  46          1HG2      THR  46  -3.929 -10.594  13.028
  353   2HG2  THR  46          2HG2      THR  46  -5.550  -9.983  13.365
  354   3HG2  THR  46          3HG2      THR  46  -4.139  -8.979  13.704
  355    H    LEU  47           H        LEU  47  -1.422 -10.482  11.855
  356    HA   LEU  47           HA       LEU  47  -1.213 -12.194   9.556
  357   1HB   LEU  47          2HB       LEU  47   0.415 -13.445  11.047
  358   2HB   LEU  47          1HB       LEU  47   0.823 -11.788  10.646
  359    HG   LEU  47           HG       LEU  47  -0.679 -12.129  13.161
  360   1HD1  LEU  47          1HD1      LEU  47   0.579 -13.827  13.901
  361   2HD1  LEU  47          2HD1      LEU  47   1.843 -12.609  14.068
  362   3HD1  LEU  47          3HD1      LEU  47   1.781 -13.623  12.627
  363   1HD2  LEU  47          1HD2      LEU  47   0.471 -10.265  13.795
  364   2HD2  LEU  47          2HD2      LEU  47   0.538 -10.062  12.043
  365   3HD2  LEU  47          3HD2      LEU  47   1.926 -10.723  12.909
  366    H    GLY  48           H        GLY  48  -3.304 -13.118   9.432
  367   1HA   GLY  48          2HA       GLY  48  -4.335 -14.674  11.632
  368   2HA   GLY  48          1HA       GLY  48  -5.032 -14.548  10.024
  369    H    THR  49           H        THR  49  -4.767 -16.193   8.634
  370    HA   THR  49           HA       THR  49  -2.768 -18.249   9.303
  371    HB   THR  49           HB       THR  49  -4.579 -19.840   8.259
  372    HG1  THR  49           1HG      THR  49  -6.204 -17.781   9.331
  373   1HG2  THR  49          1HG2      THR  49  -5.003 -20.616  10.315
  374   2HG2  THR  49          2HG2      THR  49  -5.500 -19.037  10.926
  375   3HG2  THR  49          3HG2      THR  49  -3.786 -19.435  10.799
  376    H    GLY  50           H        GLY  50  -4.875 -16.917   6.773
  377   1HA   GLY  50          2HA       GLY  50  -2.741 -17.511   4.831
  378   2HA   GLY  50          1HA       GLY  50  -4.402 -17.959   4.472
  379    H    VAL  51           H        VAL  51  -3.570 -15.026   6.184
  380    HA   VAL  51           HA       VAL  51  -4.555 -13.486   3.881
  381    HB   VAL  51           HB       VAL  51  -4.826 -11.641   5.649
  382   1HG1  VAL  51          1HG1      VAL  51  -6.933 -13.030   6.561
  383   2HG1  VAL  51          2HG1      VAL  51  -6.488 -14.036   5.183
  384   3HG1  VAL  51          3HG1      VAL  51  -6.861 -12.328   4.945
  385   1HG2  VAL  51          1HG2      VAL  51  -4.760 -14.015   7.505
  386   2HG2  VAL  51          2HG2      VAL  51  -5.069 -12.333   7.935
  387   3HG2  VAL  51          3HG2      VAL  51  -3.471 -12.820   7.371
  388    H    HIS  52           H        HIS  52  -2.967 -12.640   2.706
  389    HA   HIS  52           HA       HIS  52  -0.444 -11.913   3.976
  390   1HB   HIS  52          2HB       HIS  52  -1.322 -12.360   1.146
  391   2HB   HIS  52          1HB       HIS  52   0.133 -11.422   1.467
  392    HD1  HIS  52           1HD      HIS  52  -0.442 -14.534   0.324
  393    HD2  HIS  52           2HD      HIS  52   1.511 -13.251   3.760
  394    HE1  HIS  52           1HE      HIS  52   1.078 -16.427   0.980
  395    HE2  HIS  52           2HE      HIS  52   2.307 -15.597   3.016
  396    HA   PRO  53           HA       PRO  53  -1.629  -7.624   3.906
  397   1HB   PRO  53          2HB       PRO  53   0.633  -6.556   4.845
  398   2HB   PRO  53          1HB       PRO  53  -0.398  -7.564   5.868
  399   1HG   PRO  53          2HG       PRO  53   2.137  -8.274   4.450
  400   2HG   PRO  53          1HG       PRO  53   1.603  -8.721   6.079
  401   1HD   PRO  53          2HD       PRO  53   1.401 -10.351   3.859
  402   2HD   PRO  53          1HD       PRO  53   0.402 -10.506   5.317
  403    H    ILE  54           H        ILE  54  -1.611  -6.050   2.420
  404    HA   ILE  54           HA       ILE  54   0.720  -5.659   0.700
  405    HB   ILE  54           HB       ILE  54  -2.018  -5.888  -0.530
  406   1HG1  ILE  54          2HG1      ILE  54  -1.308  -8.065   0.502
  407   2HG1  ILE  54          1HG1      ILE  54  -1.527  -8.123  -1.243
  408   1HG2  ILE  54          1HG2      ILE  54   0.696  -5.300  -1.467
  409   2HG2  ILE  54          2HG2      ILE  54  -0.867  -4.851  -2.149
  410   3HG2  ILE  54          3HG2      ILE  54  -0.196  -6.452  -2.461
  411   1HD1  ILE  54          1HD1      ILE  54   0.683  -8.455  -1.644
  412   2HD1  ILE  54          2HD1      ILE  54   0.549  -9.219  -0.060
  413   3HD1  ILE  54          3HD1      ILE  54   1.193  -7.583  -0.200
  414    H    VAL  55           H        VAL  55   0.762  -3.595  -0.331
  415    HA   VAL  55           HA       VAL  55  -1.233  -1.677   0.678
  416    HB   VAL  55           HB       VAL  55   1.731  -1.133   0.458
  417   1HG1  VAL  55          1HG1      VAL  55   0.913   0.869   1.926
  418   2HG1  VAL  55          2HG1      VAL  55  -0.642   0.530   1.168
  419   3HG1  VAL  55          3HG1      VAL  55   0.756   0.933   0.170
  420   1HG2  VAL  55          1HG2      VAL  55   1.781  -2.345   2.363
  421   2HG2  VAL  55          2HG2      VAL  55   0.055  -2.147   2.662
  422   3HG2  VAL  55          3HG2      VAL  55   1.177  -0.850   3.076
  423    H    VAL  56           H        VAL  56  -1.634   0.150  -0.635
  424    HA   VAL  56           HA       VAL  56  -0.577  -0.027  -3.377
  425    HB   VAL  56           HB       VAL  56  -3.443   0.523  -2.607
  426   1HG1  VAL  56          1HG1      VAL  56  -3.957   0.778  -4.899
  427   2HG1  VAL  56          2HG1      VAL  56  -2.354   0.239  -5.395
  428   3HG1  VAL  56          3HG1      VAL  56  -2.553   1.801  -4.603
  429   1HG2  VAL  56          1HG2      VAL  56  -2.496  -1.875  -2.539
  430   2HG2  VAL  56          2HG2      VAL  56  -2.500  -1.756  -4.299
  431   3HG2  VAL  56          3HG2      VAL  56  -4.008  -1.582  -3.400
  432    H    VAL  57           H        VAL  57  -0.320   1.917  -4.490
  433    HA   VAL  57           HA       VAL  57  -0.877   4.400  -3.028
  434    HB   VAL  57           HB       VAL  57   1.424   5.216  -3.832
  435   1HG1  VAL  57          1HG1      VAL  57   1.065   5.042  -1.520
  436   2HG1  VAL  57          2HG1      VAL  57   2.545   4.132  -1.821
  437   3HG1  VAL  57          3HG1      VAL  57   1.021   3.280  -1.574
  438   1HG2  VAL  57          1HG2      VAL  57   2.063   3.463  -5.298
  439   2HG2  VAL  57          2HG2      VAL  57   1.786   2.238  -4.060
  440   3HG2  VAL  57          3HG2      VAL  57   3.129   3.370  -3.896
  441    H    GLN  58           H        GLN  58   0.071   6.281  -4.617
  442    HA   GLN  58           HA       GLN  58  -0.134   5.890  -7.391
  443   1HB   GLN  58          2HB       GLN  58  -2.608   5.743  -6.201
  444   2HB   GLN  58          1HB       GLN  58  -2.526   7.428  -6.695
  445   1HG   GLN  58          2HG       GLN  58  -1.647   6.225  -8.939
  446   2HG   GLN  58          1HG       GLN  58  -2.731   4.984  -8.315
  447   1HE2  GLN  58          1HE2      GLN  58  -2.839   8.530  -8.321
  448   2HE2  GLN  58          2HE2      GLN  58  -4.388   8.654  -9.075
  449    HA   PRO  59           HA       PRO  59   1.703   9.901  -6.172
  450   1HB   PRO  59          2HB       PRO  59   3.584   9.925  -8.119
  451   2HB   PRO  59          1HB       PRO  59   3.788   9.030  -6.609
  452   1HG   PRO  59          2HG       PRO  59   2.941   8.031  -9.301
  453   2HG   PRO  59          1HG       PRO  59   4.076   7.309  -8.147
  454   1HD   PRO  59          2HD       PRO  59   1.510   6.468  -8.403
  455   2HD   PRO  59          1HD       PRO  59   2.391   6.404  -6.865
  456    H    ASP  60           H        ASP  60  -0.661  10.214  -7.233
  457    HA   ASP  60           HA       ASP  60  -0.241  11.788  -9.686
  458   1HB   ASP  60          2HB       ASP  60  -1.792   9.617  -9.630
  459   2HB   ASP  60          1HB       ASP  60  -2.964  10.785  -9.025
  460    H    ALA  61           H        ALA  61  -2.752  11.495  -7.195
  461    HA   ALA  61           HA       ALA  61  -3.139  14.363  -7.195
  462   1HB   ALA  61          1HB       ALA  61  -4.553  12.029  -6.018
  463   2HB   ALA  61          2HB       ALA  61  -5.183  13.371  -6.974
  464   3HB   ALA  61          3HB       ALA  61  -4.787  13.610  -5.271
  465    H    TRP  62           H        TRP  62  -1.458  11.994  -5.321
  466    HA   TRP  62           HA       TRP  62  -1.300  13.231  -2.833
  467   1HB   TRP  62          2HB       TRP  62  -0.017  11.062  -4.178
  468   2HB   TRP  62          1HB       TRP  62   1.223  12.035  -3.393
  469    HD1  TRP  62           HD       TRP  62  -1.799   9.827  -2.601
  470    HE1  TRP  62           1HE      TRP  62  -1.730   9.205  -0.104
  471    HE3  TRP  62           3HE      TRP  62   2.067  12.829  -1.121
  472    HZ2  TRP  62           2HZ      TRP  62  -0.234   9.894   2.188
  473    HZ3  TRP  62           3HZ      TRP  62   2.755  12.787   1.240
  474    HH2  TRP  62           HH       TRP  62   1.628  11.349   2.860
  475    H    THR  63           H        THR  63   0.341  13.951  -5.823
  476    HA   THR  63           HA       THR  63   1.929  15.483  -6.406
  477    HB   THR  63           HB       THR  63  -0.084  16.878  -5.983
  478    HG1  THR  63           1HG      THR  63   1.107  18.503  -6.519
  479   1HG2  THR  63          1HG2      THR  63   1.135  17.173  -3.261
  480   2HG2  THR  63          2HG2      THR  63  -0.520  16.742  -3.690
  481   3HG2  THR  63          3HG2      THR  63   0.058  18.388  -3.953
  482    H    GLU  64           H        GLU  64   3.251  17.495  -5.109
  483    HA   GLU  64           HA       GLU  64   4.835  16.005  -3.123
  484   1HB   GLU  64          2HB       GLU  64   5.618  18.091  -5.149
  485   2HB   GLU  64          1HB       GLU  64   6.659  17.671  -3.796
  486   1HG   GLU  64          2HG       GLU  64   7.484  16.002  -4.980
  487   2HG   GLU  64          1HG       GLU  64   5.891  15.248  -4.999
  488    H    ASP  65           H        ASP  65   4.920  16.754  -1.110
  489    HA   ASP  65           HA       ASP  65   5.054  19.456  -0.378
  490   1HB   ASP  65          2HB       ASP  65   2.795  19.636   0.736
  491   2HB   ASP  65          1HB       ASP  65   2.765  19.694  -1.024
  492    H    ASN  66           H        ASN  66   3.886  16.261   0.605
  493    HA   ASN  66           HA       ASN  66   4.894  16.718   3.314
  494   1HB   ASN  66          2HB       ASN  66   2.656  15.359   2.310
  495   2HB   ASN  66          1HB       ASN  66   3.740  14.097   2.883
  496   1HD2  ASN  66          1HD2      ASN  66   1.373  14.399   4.109
  497   2HD2  ASN  66          2HD2      ASN  66   1.580  15.081   5.682
  498    H    GLY  67           H        GLY  67   5.159  14.316   0.697
  499   1HA   GLY  67          2HA       GLY  67   7.566  13.759   0.173
  500   2HA   GLY  67          1HA       GLY  67   7.715  13.445   1.896
  501    H    PHE  68           H        PHE  68   7.244  12.040  -1.063
  502    HA   PHE  68           HA       PHE  68   5.736   9.772   0.023
  503   1HB   PHE  68          2HB       PHE  68   5.025  10.865  -2.143
  504   2HB   PHE  68          1HB       PHE  68   6.509  10.242  -2.859
  505    HD1  PHE  68           1HD      PHE  68   6.718   7.963  -3.477
  506    HD2  PHE  68           2HD      PHE  68   3.280   9.307  -1.359
  507    HE1  PHE  68           1HE      PHE  68   5.594   5.827  -3.953
  508    HE2  PHE  68           2HE      PHE  68   2.150   7.174  -1.831
  509    HZ   PHE  68           HZ       PHE  68   3.310   5.430  -3.126
  510    H    HIS  69           H        HIS  69   8.827  10.617   0.025
  511    HA   HIS  69           HA       HIS  69   9.943   8.127  -0.991
  512   1HB   HIS  69          2HB       HIS  69  11.089  10.284  -1.439
  513   2HB   HIS  69          1HB       HIS  69  11.347  10.480   0.291
  514    HD1  HIS  69           1HD      HIS  69  13.910  10.554  -0.832
  515    HD2  HIS  69           2HD      HIS  69  12.013   6.876  -0.461
  516    HE1  HIS  69           1HE      HIS  69  15.743   8.837  -0.954
  517    HE2  HIS  69           2HE      HIS  69  14.580   6.624  -0.639
  518    H    ALA  70           H        ALA  70   8.357   7.356   0.938
  519    HA   ALA  70           HA       ALA  70  10.035   6.093   2.807
  520   1HB   ALA  70          1HB       ALA  70   9.845   7.266   4.749
  521   2HB   ALA  70          2HB       ALA  70   8.291   7.972   4.302
  522   3HB   ALA  70          3HB       ALA  70   9.782   8.607   3.606
  523    H    ILE  71           H        ILE  71   7.908   5.423   1.013
  524    HA   ILE  71           HA       ILE  71   5.499   4.942   2.457
  525    HB   ILE  71           HB       ILE  71   6.441   3.508  -0.024
  526   1HG1  ILE  71          2HG1      ILE  71   6.543   5.954  -0.329
  527   2HG1  ILE  71          1HG1      ILE  71   5.266   5.230  -1.300
  528   1HG2  ILE  71          1HG2      ILE  71   4.431   2.688   1.354
  529   2HG2  ILE  71          2HG2      ILE  71   4.220   2.908  -0.382
  530   3HG2  ILE  71          3HG2      ILE  71   3.610   4.123   0.741
  531   1HD1  ILE  71          1HD1      ILE  71   3.596   6.177  -0.049
  532   2HD1  ILE  71          2HD1      ILE  71   4.840   7.425   0.038
  533   3HD1  ILE  71          3HD1      ILE  71   4.604   6.318   1.391
  534    H    GLY  72           H        GLY  72   7.882   2.616   1.159
  535   1HA   GLY  72          2HA       GLY  72   6.953   0.408   2.604
  536   2HA   GLY  72          1HA       GLY  72   8.571   0.570   1.938
  537    H    GLN  73           H        GLN  73   8.976   3.048   3.594
  538    HA   GLN  73           HA       GLN  73  10.074   1.716   5.886
  539   1HB   GLN  73          2HB       GLN  73  10.921   3.827   4.526
  540   2HB   GLN  73          1HB       GLN  73   9.948   4.691   5.708
  541   1HG   GLN  73          2HG       GLN  73  11.406   4.322   7.364
  542   2HG   GLN  73          1HG       GLN  73  11.730   2.669   6.850
  543   1HE2  GLN  73          1HE2      GLN  73  12.872   5.840   6.954
  544   2HE2  GLN  73          2HE2      GLN  73  14.269   5.635   5.957
  545    H    MET  74           H        MET  74   7.185   3.487   5.182
  546    HA   MET  74           HA       MET  74   6.569   3.865   8.010
  547   1HB   MET  74          2HB       MET  74   5.860   5.206   5.596
  548   2HB   MET  74          1HB       MET  74   4.382   4.606   6.335
  549   1HG   MET  74          2HG       MET  74   5.231   5.671   8.489
  550   2HG   MET  74          1HG       MET  74   6.397   6.510   7.468
  551   1HE   MET  74          1HE       MET  74   2.412   6.108   6.034
  552   2HE   MET  74          2HE       MET  74   1.896   6.811   7.567
  553   3HE   MET  74          3HE       MET  74   2.883   5.349   7.555
  554    H    CYS  75           H        CYS  75   5.658   1.900   5.270
  555    HA   CYS  75           HA       CYS  75   3.605   0.567   6.901
  556   1HB   CYS  75          2HB       CYS  75   2.703  -0.306   4.814
  557   2HB   CYS  75          1HB       CYS  75   2.854   1.446   4.716
  558    HG   CYS  75           HG       CYS  75   3.870  -0.244   2.657
  559    H    GLU  76           H        GLU  76   3.558  -1.709   7.032
  560    HA   GLU  76           HA       GLU  76   6.199  -2.939   6.687
  561   1HB   GLU  76          2HB       GLU  76   4.666  -2.866   8.900
  562   2HB   GLU  76          1HB       GLU  76   4.071  -4.359   8.187
  563   1HG   GLU  76          2HG       GLU  76   6.553  -5.005   7.996
  564   2HG   GLU  76          1HG       GLU  76   6.825  -3.699   9.149
  565    H    ALA  77           H        ALA  77   4.340  -2.584   4.481
  566    HA   ALA  77           HA       ALA  77   4.190  -5.378   3.645
  567   1HB   ALA  77          1HB       ALA  77   1.884  -3.718   4.231
  568   2HB   ALA  77          2HB       ALA  77   1.983  -5.453   3.931
  569   3HB   ALA  77          3HB       ALA  77   1.864  -4.331   2.577
  570    HA   PRO  78           HA       PRO  78   5.463  -3.841  -0.287
  571   1HB   PRO  78          2HB       PRO  78   4.110  -5.335  -2.072
  572   2HB   PRO  78          1HB       PRO  78   5.349  -6.029  -1.019
  573   1HG   PRO  78          2HG       PRO  78   2.369  -6.072  -0.719
  574   2HG   PRO  78          1HG       PRO  78   3.532  -7.390  -0.489
  575   1HD   PRO  78          2HD       PRO  78   2.487  -5.959   1.573
  576   2HD   PRO  78          1HD       PRO  78   4.109  -6.678   1.621
  577    H    VAL  79           H        VAL  79   5.004  -1.904  -1.109
  578    HA   VAL  79           HA       VAL  79   2.226  -1.092  -1.475
  579    HB   VAL  79           HB       VAL  79   4.671   0.609  -1.939
  580   1HG1  VAL  79          1HG1      VAL  79   3.264   2.324  -2.231
  581   2HG1  VAL  79          2HG1      VAL  79   2.208   1.809  -0.916
  582   3HG1  VAL  79          3HG1      VAL  79   2.046   1.080  -2.513
  583   1HG2  VAL  79          1HG2      VAL  79   4.137  -0.545   0.467
  584   2HG2  VAL  79          2HG2      VAL  79   3.230   0.961   0.593
  585   3HG2  VAL  79          3HG2      VAL  79   4.960   1.000   0.256
  586    H    VAL  80           H        VAL  80   1.248  -1.157  -3.409
  587    HA   VAL  80           HA       VAL  80   2.908  -0.947  -5.829
  588    HB   VAL  80           HB       VAL  80   1.369  -2.690  -6.883
  589   1HG1  VAL  80          1HG1      VAL  80   3.173  -3.774  -4.735
  590   2HG1  VAL  80          2HG1      VAL  80   3.782  -2.995  -6.195
  591   3HG1  VAL  80          3HG1      VAL  80   2.818  -4.464  -6.319
  592   1HG2  VAL  80          1HG2      VAL  80   0.403  -4.339  -5.346
  593   2HG2  VAL  80          2HG2      VAL  80  -0.322  -2.746  -5.137
  594   3HG2  VAL  80          3HG2      VAL  80   0.871  -3.330  -3.977
  595    H    THR  81           H        THR  81   2.069   0.373  -7.344
  596    HA   THR  81           HA       THR  81  -0.055   2.070  -6.880
  597    HB   THR  81           HB       THR  81   0.116   2.759  -9.145
  598    HG1  THR  81           1HG      THR  81   0.903   1.453 -10.755
  599   1HG2  THR  81          1HG2      THR  81   2.854   1.644  -8.894
  600   2HG2  THR  81          2HG2      THR  81   2.290   2.797  -7.684
  601   3HG2  THR  81          3HG2      THR  81   2.325   3.252  -9.388
  602    H    ARG  82           H        ARG  82  -2.164   2.229  -7.899
  603    HA   ARG  82           HA       ARG  82  -3.798   0.055  -7.493
  604   1HB   ARG  82          2HB       ARG  82  -5.398   1.267  -9.126
  605   2HB   ARG  82          1HB       ARG  82  -4.940   2.069  -7.634
  606   1HG   ARG  82          2HG       ARG  82  -4.752   3.752  -9.202
  607   2HG   ARG  82          1HG       ARG  82  -3.093   3.173  -9.073
  608   1HD   ARG  82          2HD       ARG  82  -3.100   2.853 -11.269
  609   2HD   ARG  82          1HD       ARG  82  -4.294   1.578 -11.030
  610    HE   ARG  82           HE       ARG  82  -5.912   2.980 -11.848
  611   1HH1  ARG  82          1HH1      ARG  82  -3.051   4.844 -11.125
  612   2HH1  ARG  82          2HH1      ARG  82  -3.647   6.284 -11.879
  613   1HH2  ARG  82          1HH2      ARG  82  -6.698   4.874 -12.841
  614   2HH2  ARG  82          2HH2      ARG  82  -5.717   6.301 -12.854
  615    H    GLU  83           H        GLU  83  -1.810   0.730 -10.248
  616    HA   GLU  83           HA       GLU  83  -2.999  -0.580 -12.324
  617   1HB   GLU  83          2HB       GLU  83  -0.525   0.443 -11.905
  618   2HB   GLU  83          1HB       GLU  83  -0.150  -1.275 -11.937
  619   1HG   GLU  83          2HG       GLU  83   0.079  -0.819 -14.140
  620   2HG   GLU  83          1HG       GLU  83  -1.645  -1.186 -14.117
  621    H    TRP  84           H        TRP  84  -1.322  -2.026  -9.580
  622    HA   TRP  84           HA       TRP  84  -1.334  -4.700 -10.445
  623   1HB   TRP  84          2HB       TRP  84  -0.046  -3.927  -8.502
  624   2HB   TRP  84          1HB       TRP  84  -1.533  -3.586  -7.638
  625    HD1  TRP  84           HD       TRP  84   0.401  -6.626  -9.058
  626    HE1  TRP  84           1HE      TRP  84  -0.194  -8.682  -7.625
  627    HE3  TRP  84           3HE      TRP  84  -3.127  -4.508  -6.025
  628    HZ2  TRP  84           2HZ      TRP  84  -1.932  -9.319  -5.490
  629    HZ3  TRP  84           3HZ      TRP  84  -4.208  -5.909  -4.315
  630    HH2  TRP  84           HH       TRP  84  -3.625  -8.261  -4.053
  631    H    VAL  85           H        VAL  85  -3.510  -3.030  -8.233
  632    HA   VAL  85           HA       VAL  85  -5.413  -5.014  -7.893
  633    HB   VAL  85           HB       VAL  85  -5.868  -2.028  -7.936
  634   1HG1  VAL  85          1HG1      VAL  85  -8.024  -2.670  -7.832
  635   2HG1  VAL  85          2HG1      VAL  85  -7.640  -2.992  -6.142
  636   3HG1  VAL  85          3HG1      VAL  85  -7.623  -4.308  -7.317
  637   1HG2  VAL  85          1HG2      VAL  85  -5.197  -3.880  -5.651
  638   2HG2  VAL  85          2HG2      VAL  85  -5.568  -2.162  -5.509
  639   3HG2  VAL  85          3HG2      VAL  85  -4.121  -2.683  -6.370
  640    H    LEU  86           H        LEU  86  -5.201  -2.537 -10.406
  641    HA   LEU  86           HA       LEU  86  -7.681  -3.224 -11.635
  642   1HB   LEU  86          2HB       LEU  86  -5.761  -1.192 -11.901
  643   2HB   LEU  86          1HB       LEU  86  -5.816  -1.993 -13.460
  644    HG   LEU  86           HG       LEU  86  -8.429  -1.701 -13.130
  645   1HD1  LEU  86          1HD1      LEU  86  -9.136  -0.065 -11.734
  646   2HD1  LEU  86          2HD1      LEU  86  -7.642   0.859 -11.880
  647   3HD1  LEU  86          3HD1      LEU  86  -7.704  -0.556 -10.830
  648   1HD2  LEU  86          1HD2      LEU  86  -7.143  -0.823 -14.993
  649   2HD2  LEU  86          2HD2      LEU  86  -6.557   0.503 -13.988
  650   3HD2  LEU  86          3HD2      LEU  86  -8.270   0.396 -14.395
  651    H    ASP  87           H        ASP  87  -4.287  -3.866 -12.485
  652    HA   ASP  87           HA       ASP  87  -4.786  -5.399 -14.772
  653   1HB   ASP  87          2HB       ASP  87  -2.567  -4.487 -14.172
  654   2HB   ASP  87          1HB       ASP  87  -2.465  -5.639 -12.844
  655    H    SER  88           H        SER  88  -4.772  -6.241 -11.373
  656    HA   SER  88           HA       SER  88  -4.856  -9.074 -11.825
  657   1HB   SER  88          2HB       SER  88  -5.487  -7.472  -9.335
  658   2HB   SER  88          1HB       SER  88  -5.306  -9.226  -9.403
  659    HG   SER  88           HG       SER  88  -3.293  -8.747  -8.983
  660    H    VAL  89           H        VAL  89  -7.244  -6.617 -10.870
  661    HA   VAL  89           HA       VAL  89  -9.420  -8.452 -10.779
  662    HB   VAL  89           HB       VAL  89  -9.502  -5.445 -11.068
  663   1HG1  VAL  89          1HG1      VAL  89 -11.756  -5.873  -9.865
  664   2HG1  VAL  89          2HG1      VAL  89 -11.588  -7.513 -10.491
  665   3HG1  VAL  89          3HG1      VAL  89 -11.649  -6.146 -11.604
  666   1HG2  VAL  89          1HG2      VAL  89  -8.386  -6.775  -9.005
  667   2HG2  VAL  89          2HG2      VAL  89 -10.067  -6.721  -8.473
  668   3HG2  VAL  89          3HG2      VAL  89  -9.210  -5.225  -8.842
  669    H    ALA  90           H        ALA  90  -7.916  -6.617 -13.316
  670    HA   ALA  90           HA       ALA  90 -10.079  -6.612 -15.145
  671   1HB   ALA  90          1HB       ALA  90  -7.137  -6.175 -15.360
  672   2HB   ALA  90          2HB       ALA  90  -8.468  -5.071 -15.707
  673   3HB   ALA  90          3HB       ALA  90  -8.092  -6.379 -16.829
  674    H    LEU  91           H        LEU  91  -7.132  -8.621 -15.083
  675    HA   LEU  91           HA       LEU  91  -8.389 -10.533 -16.883
  676   1HB   LEU  91          2HB       LEU  91  -6.108  -9.917 -17.361
  677   2HB   LEU  91          1HB       LEU  91  -5.606 -10.345 -15.737
  678    HG   LEU  91           HG       LEU  91  -6.174 -12.721 -16.239
  679   1HD1  LEU  91          1HD1      LEU  91  -7.804 -12.264 -18.026
  680   2HD1  LEU  91          2HD1      LEU  91  -6.552 -13.402 -18.526
  681   3HD1  LEU  91          3HD1      LEU  91  -6.486 -11.723 -19.066
  682   1HD2  LEU  91          1HD2      LEU  91  -4.098 -13.112 -17.041
  683   2HD2  LEU  91          2HD2      LEU  91  -3.908 -11.384 -16.749
  684   3HD2  LEU  91          3HD2      LEU  91  -4.276 -11.970 -18.372
  685    H    TYR  92           H        TYR  92  -8.022 -10.082 -13.546
  686    HA   TYR  92           HA       TYR  92  -8.635 -11.340 -11.754
  687   1HB   TYR  92          2HB       TYR  92 -10.148 -12.408 -13.873
  688   2HB   TYR  92          1HB       TYR  92  -9.470 -13.794 -13.027
  689    HD1  TYR  92           1HD      TYR  92  -9.430 -12.473 -10.246
  690    HD2  TYR  92           2HD      TYR  92 -12.422 -12.747 -13.261
  691    HE1  TYR  92           1HE      TYR  92 -11.174 -12.274  -8.526
  692    HE2  TYR  92           2HE      TYR  92 -14.173 -12.546 -11.547
  693    HH   TYR  92           HH       TYR  92 -13.564 -12.887  -8.247
  694    H    GLN  93           H        GLN  93  -6.362 -11.456 -11.310
  695    HA   GLN  93           HA       GLN  93  -5.443 -14.016 -10.712
  696   1HB   GLN  93          2HB       GLN  93  -4.962 -13.279 -13.431
  697   2HB   GLN  93          1HB       GLN  93  -3.418 -13.332 -12.592
  698   1HG   GLN  93          2HG       GLN  93  -4.128 -15.615 -11.744
  699   2HG   GLN  93          1HG       GLN  93  -5.428 -15.532 -12.932
  700   1HE2  GLN  93          1HE2      GLN  93  -1.915 -15.241 -12.620
  701   2HE2  GLN  93          2HE2      GLN  93  -1.545 -15.924 -14.163
  702    H    CYS  94           H        CYS  94  -4.015 -13.807  -9.110
  703    HA   CYS  94           HA       CYS  94  -3.190 -11.299  -8.169
  704   1HB   CYS  94          2HB       CYS  94  -3.413 -13.491  -6.871
  705   2HB   CYS  94          1HB       CYS  94  -1.817 -13.898  -7.494
  706    HG   CYS  94           HG       CYS  94  -1.434 -11.320  -6.201
  707    H    GLN  95           H        GLN  95  -2.167 -10.229  -9.911
  708    HA   GLN  95           HA       GLN  95   0.110 -11.269 -11.249
  709   1HB   GLN  95          2HB       GLN  95  -0.637  -8.360 -10.929
  710   2HB   GLN  95          1HB       GLN  95   0.362  -9.068 -12.191
  711   1HG   GLN  95          2HG       GLN  95  -2.570  -9.600 -11.776
  712   2HG   GLN  95          1HG       GLN  95  -1.880  -8.520 -12.986
  713   1HE2  GLN  95          1HE2      GLN  95  -0.821  -9.385 -14.763
  714   2HE2  GLN  95          2HE2      GLN  95  -0.976 -11.046 -15.213
  715    H    GLU  96           H        GLU  96   2.294 -10.390 -11.140
  716    HA   GLU  96           HA       GLU  96   3.309 -10.421  -8.498
  717   1HB   GLU  96          2HB       GLU  96   5.471  -9.669  -9.691
  718   2HB   GLU  96          1HB       GLU  96   4.801 -11.245 -10.089
  719   1HG   GLU  96          2HG       GLU  96   3.961 -10.478 -12.153
  720   2HG   GLU  96          1HG       GLU  96   4.226  -8.791 -11.717
  721    H    LEU  97           H        LEU  97   3.554  -8.842  -7.078
  722    HA   LEU  97           HA       LEU  97   2.626  -6.222  -7.569
  723   1HB   LEU  97          2HB       LEU  97   3.958  -7.630  -5.313
  724   2HB   LEU  97          1HB       LEU  97   3.954  -5.876  -5.290
  725    HG   LEU  97           HG       LEU  97   1.363  -6.255  -5.763
  726   1HD1  LEU  97          1HD1      LEU  97   1.758  -8.525  -3.903
  727   2HD1  LEU  97          2HD1      LEU  97   2.018  -8.827  -5.621
  728   3HD1  LEU  97          3HD1      LEU  97   0.462  -8.215  -5.058
  729   1HD2  LEU  97          1HD2      LEU  97   1.127  -5.367  -3.726
  730   2HD2  LEU  97          2HD2      LEU  97   2.888  -5.415  -3.649
  731   3HD2  LEU  97          3HD2      LEU  97   1.938  -6.721  -2.940
  732    H    ASP  98           H        ASP  98   5.804  -7.667  -7.638
  733    HA   ASP  98           HA       ASP  98   7.430  -5.432  -7.468
  734   1HB   ASP  98          2HB       ASP  98   7.690  -8.088  -8.810
  735   2HB   ASP  98          1HB       ASP  98   8.897  -6.851  -9.149
  736    H    THR  99           H        THR  99   5.310  -6.372 -10.032
  737    HA   THR  99           HA       THR  99   6.595  -4.861 -12.093
  738    HB   THR  99           HB       THR  99   3.779  -5.946 -11.931
  739    HG1  THR  99           1HG      THR  99   5.671  -7.425 -11.885
  740   1HG2  THR  99          1HG2      THR  99   3.432  -4.739 -13.771
  741   2HG2  THR  99          2HG2      THR  99   4.449  -5.942 -14.563
  742   3HG2  THR  99          3HG2      THR  99   5.150  -4.422 -14.008
  743    H    TYR 100           H        TYR 100   4.470  -4.063  -9.510
  744    HA   TYR 100           HA       TYR 100   4.219  -1.350 -10.606
  745   1HB   TYR 100          2HB       TYR 100   1.979  -2.672  -9.081
  746   2HB   TYR 100          1HB       TYR 100   1.933  -1.166  -9.991
  747    HD1  TYR 100           1HD      TYR 100   2.512  -1.437 -12.568
  748    HD2  TYR 100           2HD      TYR 100   1.088  -4.563 -10.059
  749    HE1  TYR 100           1HE      TYR 100   1.715  -2.655 -14.550
  750    HE2  TYR 100           2HE      TYR 100   0.287  -5.791 -12.033
  751    HH   TYR 100           HH       TYR 100  -0.405  -4.738 -14.699
  752    H    LEU 101           H        LEU 101   5.867  -2.799  -8.479
  753    HA   LEU 101           HA       LEU 101   5.012  -1.493  -6.037
  754   1HB   LEU 101          2HB       LEU 101   6.543  -3.764  -6.667
  755   2HB   LEU 101          1HB       LEU 101   7.650  -2.639  -5.909
  756    HG   LEU 101           HG       LEU 101   5.058  -3.074  -4.540
  757   1HD1  LEU 101          1HD1      LEU 101   5.955  -5.335  -5.366
  758   2HD1  LEU 101          2HD1      LEU 101   5.569  -5.164  -3.654
  759   3HD1  LEU 101          3HD1      LEU 101   7.247  -5.088  -4.193
  760   1HD2  LEU 101          1HD2      LEU 101   6.907  -3.222  -2.647
  761   2HD2  LEU 101          2HD2      LEU 101   6.354  -1.678  -3.294
  762   3HD2  LEU 101          3HD2      LEU 101   7.864  -2.385  -3.869
  763    H    ILE 102           H        ILE 102   6.882  -0.417  -4.743
  764    HA   ILE 102           HA       ILE 102   7.553   1.977  -6.023
  765    HB   ILE 102           HB       ILE 102   8.942   0.815  -3.608
  766   1HG1  ILE 102          2HG1      ILE 102   6.782   2.780  -3.217
  767   2HG1  ILE 102          1HG1      ILE 102   6.245   1.215  -3.817
  768   1HG2  ILE 102          1HG2      ILE 102   9.921   2.843  -4.777
  769   2HG2  ILE 102          2HG2      ILE 102   9.561   3.022  -3.060
  770   3HG2  ILE 102          3HG2      ILE 102   8.474   3.710  -4.266
  771   1HD1  ILE 102          1HD1      ILE 102   8.132   1.134  -1.564
  772   2HD1  ILE 102          2HD1      ILE 102   6.682   0.179  -1.872
  773   3HD1  ILE 102          3HD1      ILE 102   6.541   1.810  -1.217
  774    HA   PRO 103           HA       PRO 103  10.934   0.326  -8.539
  775   1HB   PRO 103          2HB       PRO 103  11.255   3.221  -9.107
  776   2HB   PRO 103          1HB       PRO 103  11.116   1.862 -10.228
  777   1HG   PRO 103          2HG       PRO 103   9.080   3.543  -9.861
  778   2HG   PRO 103          1HG       PRO 103   8.804   1.805 -10.081
  779   1HD   PRO 103          2HD       PRO 103   8.734   3.434  -7.575
  780   2HD   PRO 103          1HD       PRO 103   7.695   2.083  -8.073
  781    H    GLN 104           H        GLN 104  11.528   3.558  -7.194
  782    HA   GLN 104           HA       GLN 104  13.277   4.433  -6.028
  783   1HB   GLN 104          2HB       GLN 104  12.349   2.331  -4.578
  784   2HB   GLN 104          1HB       GLN 104  14.033   1.868  -4.779
  785   1HG   GLN 104          2HG       GLN 104  13.818   4.641  -4.036
  786   2HG   GLN 104          1HG       GLN 104  12.964   3.611  -2.888
  787   1HE2  GLN 104          1HE2      GLN 104  14.698   4.493  -1.483
  788   2HE2  GLN 104          2HE2      GLN 104  16.193   3.629  -1.412
  789    H    ILE 105           H        ILE 105  14.611   4.814  -7.813
  790    HA   ILE 105           HA       ILE 105  16.971   3.085  -7.915
  791    HB   ILE 105           HB       ILE 105  17.015   3.410 -10.437
  792   1HG1  ILE 105          2HG1      ILE 105  14.064   3.564 -10.450
  793   2HG1  ILE 105          1HG1      ILE 105  14.891   5.056 -10.018
  794   1HG2  ILE 105          1HG2      ILE 105  15.336   1.571  -8.865
  795   2HG2  ILE 105          2HG2      ILE 105  16.635   1.231 -10.008
  796   3HG2  ILE 105          3HG2      ILE 105  15.018   1.611 -10.599
  797   1HD1  ILE 105          1HD1      ILE 105  14.731   3.656 -12.595
  798   2HD1  ILE 105          2HD1      ILE 105  16.302   4.348 -12.193
  799   3HD1  ILE 105          3HD1      ILE 105  14.872   5.378 -12.237
  800    HA   PRO 106           HA       PRO 106  19.304   6.819  -7.910
  801   1HB   PRO 106          2HB       PRO 106  21.278   6.246  -9.738
  802   2HB   PRO 106          1HB       PRO 106  21.269   5.665  -8.069
  803   1HG   PRO 106          2HG       PRO 106  20.430   4.258 -10.572
  804   2HG   PRO 106          1HG       PRO 106  21.345   3.633  -9.187
  805   1HD   PRO 106          2HD       PRO 106  18.733   3.101  -9.504
  806   2HD   PRO 106          1HD       PRO 106  19.441   3.355  -7.896
  807    H    HIS 107           H        HIS 107  19.723   8.723  -9.084
  808    HA   HIS 107           HA       HIS 107  19.325  10.328 -10.645
  809   1HB   HIS 107          2HB       HIS 107  20.032   7.945 -12.158
  810   2HB   HIS 107          1HB       HIS 107  18.965   9.007 -13.070
  811    HD1  HIS 107           1HD      HIS 107  20.575  10.049 -14.675
  812    HD2  HIS 107           2HD      HIS 107  21.911  10.230 -10.745
  813    HE1  HIS 107           1HE      HIS 107  22.633  11.493 -14.731
  814    HE2  HIS 107           2HE      HIS 107  23.373  11.660 -12.328
  815    H    SER 108           H        SER 108  17.734  10.660 -12.749
  816    HA   SER 108           HA       SER 108  15.144   9.444 -12.288
  817   1HB   SER 108          2HB       SER 108  15.262  11.325 -10.644
  818   2HB   SER 108          1HB       SER 108  15.467  12.439 -11.995
  819    HG   SER 108           HG       SER 108  13.426  11.677 -12.781
  820    H    HIS 109           H        HIS 109  16.629  12.281 -13.865
  821    HA   HIS 109           HA       HIS 109  15.328  11.437 -16.372
  822   1HB   HIS 109          2HB       HIS 109  15.905  14.190 -15.288
  823   2HB   HIS 109          1HB       HIS 109  15.571  13.911 -16.994
  824    HD1  HIS 109           1HD      HIS 109  13.932  13.655 -13.607
  825    HD2  HIS 109           2HD      HIS 109  12.911  13.598 -17.634
  826    HE1  HIS 109           1HE      HIS 109  11.420  13.750 -13.665
  827    HE2  HIS 109           2HE      HIS 109  10.828  13.800 -16.113
  828    H    TYR 110           H        TYR 110  16.721  10.630 -17.780
  829    HA   TYR 110           HA       TYR 110  19.208  12.014 -18.327
  830   1HB   TYR 110          2HB       TYR 110  20.617  10.035 -18.049
  831   2HB   TYR 110          1HB       TYR 110  19.841  10.460 -16.526
  832    HD1  TYR 110           1HD      TYR 110  20.593   7.822 -18.709
  833    HD2  TYR 110           2HD      TYR 110  17.547   9.211 -16.084
  834    HE1  TYR 110           1HE      TYR 110  19.716   5.532 -18.524
  835    HE2  TYR 110           2HE      TYR 110  16.663   6.924 -15.890
  836    HH   TYR 110           HH       TYR 110  17.480   4.604 -16.166
  Start of MODEL    2
    1   1H    GLY   1          1HT       GLY   1 -25.458 -16.736  -1.037
    2   2H    GLY   1          2HT       GLY   1 -24.278 -17.585  -0.172
    3   3H    GLY   1          3HT       GLY   1 -25.261 -18.399  -1.282
    4   1HA   GLY   1          1HA       GLY   1 -24.302 -17.098  -3.100
    5   2HA   GLY   1          2HA       GLY   1 -23.245 -16.319  -1.932
    6    H    SER   2           H        SER   2 -23.717 -19.014  -3.963
    7    HA   SER   2           HA       SER   2 -21.420 -20.412  -2.771
    8   1HB   SER   2          2HB       SER   2 -22.196 -22.336  -4.242
    9   2HB   SER   2          1HB       SER   2 -23.283 -21.892  -2.926
   10    HG   SER   2           HG       SER   2 -24.529 -22.082  -4.737
   11    H    GLN   3           H        GLN   3 -19.815 -21.315  -4.219
   12    HA   GLN   3           HA       GLN   3 -18.252 -21.117  -5.861
   13   1HB   GLN   3          2HB       GLN   3 -20.489 -20.148  -7.637
   14   2HB   GLN   3          1HB       GLN   3 -19.009 -20.969  -8.118
   15   1HG   GLN   3          2HG       GLN   3 -19.836 -22.959  -6.808
   16   2HG   GLN   3          1HG       GLN   3 -21.382 -22.122  -6.683
   17   1HE2  GLN   3          1HE2      GLN   3 -22.727 -23.132  -7.998
   18   2HE2  GLN   3          2HE2      GLN   3 -22.417 -23.534  -9.650
   19    H    ASP   4           H        ASP   4 -16.953 -19.485  -5.164
   20    HA   ASP   4           HA       ASP   4 -17.658 -16.758  -6.019
   21   1HB   ASP   4          2HB       ASP   4 -15.837 -17.593  -3.754
   22   2HB   ASP   4          1HB       ASP   4 -16.242 -15.938  -4.198
   23    H    ARG   5           H        ARG   5 -14.884 -18.901  -5.479
   24    HA   ARG   5           HA       ARG   5 -12.849 -19.058  -6.490
   25   1HB   ARG   5          2HB       ARG   5 -14.769 -18.457  -8.622
   26   2HB   ARG   5          1HB       ARG   5 -13.116 -18.013  -9.026
   27   1HG   ARG   5          2HG       ARG   5 -13.929 -20.733  -8.030
   28   2HG   ARG   5          1HG       ARG   5 -13.780 -20.303  -9.736
   29   1HD   ARG   5          2HD       ARG   5 -11.447 -19.877  -9.502
   30   2HD   ARG   5          1HD       ARG   5 -11.542 -19.989  -7.746
   31    HE   ARG   5           HE       ARG   5 -11.376 -22.260  -7.924
   32   1HH1  ARG   5          1HH1      ARG   5 -12.281 -20.963 -11.035
   33   2HH1  ARG   5          2HH1      ARG   5 -12.122 -22.481 -11.853
   34   1HH2  ARG   5          1HH2      ARG   5 -11.165 -24.257  -8.999
   35   2HH2  ARG   5          2HH2      ARG   5 -11.489 -24.351 -10.698
   36    H    LYS   6           H        LYS   6 -11.662 -17.622  -5.288
   37    HA   LYS   6           HA       LYS   6 -11.421 -14.893  -6.377
   38   1HB   LYS   6          2HB       LYS   6 -10.690 -15.699  -3.567
   39   2HB   LYS   6          1HB       LYS   6 -10.930 -14.083  -4.204
   40   1HG   LYS   6          2HG       LYS   6 -13.242 -15.921  -4.330
   41   2HG   LYS   6          1HG       LYS   6 -12.753 -15.340  -2.736
   42   1HD   LYS   6          2HD       LYS   6 -12.860 -13.019  -3.601
   43   2HD   LYS   6          1HD       LYS   6 -13.459 -13.651  -5.135
   44   1HE   LYS   6          2HE       LYS   6 -15.060 -14.777  -3.105
   45   2HE   LYS   6          1HE       LYS   6 -14.901 -13.061  -2.735
   46   1HZ   LYS   6          1HZ       LYS   6 -16.775 -13.323  -4.137
   47   2HZ   LYS   6          2HZ       LYS   6 -15.918 -14.273  -5.243
   48   3HZ   LYS   6          3HZ       LYS   6 -15.559 -12.627  -5.086
   49    H    ILE   7           H        ILE   7  -9.427 -14.108  -6.875
   50    HA   ILE   7           HA       ILE   7  -7.292 -16.035  -7.148
   51    HB   ILE   7           HB       ILE   7  -6.065 -14.159  -8.235
   52   1HG1  ILE   7          2HG1      ILE   7  -8.261 -12.400  -8.688
   53   2HG1  ILE   7          1HG1      ILE   7  -8.096 -12.615  -6.949
   54   1HG2  ILE   7          1HG2      ILE   7  -8.098 -13.892 -10.013
   55   2HG2  ILE   7          2HG2      ILE   7  -8.595 -15.332  -9.127
   56   3HG2  ILE   7          3HG2      ILE   7  -7.020 -15.285  -9.920
   57   1HD1  ILE   7          1HD1      ILE   7  -6.100 -11.530  -8.899
   58   2HD1  ILE   7          2HD1      ILE   7  -5.628 -12.093  -7.294
   59   3HD1  ILE   7          3HD1      ILE   7  -6.776 -10.765  -7.462
   60    H    PHE   8           H        PHE   8  -8.182 -13.641  -4.868
   61    HA   PHE   8           HA       PHE   8  -5.460 -13.339  -3.860
   62   1HB   PHE   8          2HB       PHE   8  -8.080 -12.013  -3.178
   63   2HB   PHE   8          1HB       PHE   8  -6.633 -11.779  -2.211
   64    HD1  PHE   8           1HD      PHE   8  -8.108  -9.566  -3.530
   65    HD2  PHE   8           2HD      PHE   8  -4.906 -11.991  -4.939
   66    HE1  PHE   8           1HE      PHE   8  -7.400  -7.756  -5.036
   67    HE2  PHE   8           2HE      PHE   8  -4.197 -10.185  -6.446
   68    HZ   PHE   8           HZ       PHE   8  -5.445  -8.064  -6.496
   69    H    ARG   9           H        ARG   9  -8.607 -14.604  -2.834
   70    HA   ARG   9           HA       ARG   9  -9.219 -15.765  -0.938
   71   1HB   ARG   9          2HB       ARG   9  -7.976 -17.958  -0.835
   72   2HB   ARG   9          1HB       ARG   9  -8.658 -17.544  -2.402
   73   1HG   ARG   9          2HG       ARG   9  -6.594 -17.151  -3.349
   74   2HG   ARG   9          1HG       ARG   9  -5.822 -16.847  -1.793
   75   1HD   ARG   9          2HD       ARG   9  -6.927 -19.549  -2.468
   76   2HD   ARG   9          1HD       ARG   9  -5.322 -19.060  -3.012
   77    HE   ARG   9           HE       ARG   9  -5.857 -18.754  -0.176
   78   1HH1  ARG   9          1HH1      ARG   9  -4.497 -20.750  -2.702
   79   2HH1  ARG   9          2HH1      ARG   9  -3.473 -21.634  -1.621
   80   1HH2  ARG   9          1HH2      ARG   9  -4.513 -19.917   1.240
   81   2HH2  ARG   9          2HH2      ARG   9  -3.484 -21.164   0.615
   82    H    GLY  10           H        GLY  10  -8.700 -14.240   0.691
   83   1HA   GLY  10          2HA       GLY  10  -7.851 -13.928   2.842
   84   2HA   GLY  10          1HA       GLY  10  -6.716 -15.235   2.550
   85    H    LEU  11           H        LEU  11  -7.404 -11.952   1.421
   86    HA   LEU  11           HA       LEU  11  -4.558 -11.317   1.695
   87   1HB   LEU  11          2HB       LEU  11  -5.479 -11.914  -0.720
   88   2HB   LEU  11          1HB       LEU  11  -6.013 -10.246  -0.670
   89    HG   LEU  11           HG       LEU  11  -3.163 -10.948  -0.073
   90   1HD1  LEU  11          1HD1      LEU  11  -4.224 -11.796  -2.379
   91   2HD1  LEU  11          2HD1      LEU  11  -2.571 -11.201  -2.234
   92   3HD1  LEU  11          3HD1      LEU  11  -3.844 -10.132  -2.824
   93   1HD2  LEU  11          1HD2      LEU  11  -4.735  -8.561  -0.327
   94   2HD2  LEU  11          2HD2      LEU  11  -3.440  -8.565  -1.524
   95   3HD2  LEU  11          3HD2      LEU  11  -3.060  -8.747   0.188
   96    H    GLU  12           H        GLU  12  -4.105  -9.079   1.983
   97    HA   GLU  12           HA       GLU  12  -6.449  -7.397   2.564
   98   1HB   GLU  12          2HB       GLU  12  -4.422  -8.355   4.407
   99   2HB   GLU  12          1HB       GLU  12  -4.476  -6.598   4.371
  100   1HG   GLU  12          2HG       GLU  12  -6.508  -6.502   5.339
  101   2HG   GLU  12          1HG       GLU  12  -7.078  -7.966   4.543
  102    H    ILE  13           H        ILE  13  -6.392  -5.603   1.385
  103    HA   ILE  13           HA       ILE  13  -3.776  -4.393   0.790
  104    HB   ILE  13           HB       ILE  13  -6.068  -4.493  -1.168
  105   1HG1  ILE  13          2HG1      ILE  13  -3.693  -5.918  -1.999
  106   2HG1  ILE  13          1HG1      ILE  13  -4.311  -6.580  -0.490
  107   1HG2  ILE  13          1HG2      ILE  13  -3.198  -3.626  -1.489
  108   2HG2  ILE  13          2HG2      ILE  13  -4.604  -2.563  -1.408
  109   3HG2  ILE  13          3HG2      ILE  13  -4.413  -3.674  -2.767
  110   1HD1  ILE  13          1HD1      ILE  13  -6.597  -6.497  -1.763
  111   2HD1  ILE  13          2HD1      ILE  13  -5.465  -7.827  -2.008
  112   3HD1  ILE  13          3HD1      ILE  13  -5.554  -6.517  -3.184
  113    H    CYS  14           H        CYS  14  -3.639  -2.353   1.432
  114    HA   CYS  14           HA       CYS  14  -6.123  -0.845   1.879
  115   1HB   CYS  14          2HB       CYS  14  -4.872   0.507   3.471
  116   2HB   CYS  14          1HB       CYS  14  -4.720  -1.197   3.877
  117    HG   CYS  14           HG       CYS  14  -2.308  -0.824   2.457
  118    H    CYS  15           H        CYS  15  -6.481   1.046   0.860
  119    HA   CYS  15           HA       CYS  15  -4.567   1.820  -1.206
  120   1HB   CYS  15          2HB       CYS  15  -6.441   3.221  -2.064
  121   2HB   CYS  15          1HB       CYS  15  -6.842   1.511  -1.962
  122    HG   CYS  15           HG       CYS  15  -8.860   2.681  -0.969
  123    H    TYR  16           H        TYR  16  -3.007   3.049  -0.275
  124    HA   TYR  16           HA       TYR  16  -3.773   5.209   1.532
  125   1HB   TYR  16          2HB       TYR  16  -1.756   3.570   1.829
  126   2HB   TYR  16          1HB       TYR  16  -0.948   4.649   0.695
  127    HD1  TYR  16           1HD      TYR  16  -2.184   4.238   4.090
  128    HD2  TYR  16           2HD      TYR  16  -0.505   6.995   1.318
  129    HE1  TYR  16           1HE      TYR  16  -1.622   5.752   5.945
  130    HE2  TYR  16           2HE      TYR  16   0.063   8.515   3.165
  131    HH   TYR  16           HH       TYR  16  -1.107   8.750   5.782
  132    H    GLY  17           H        GLY  17  -4.331   7.084   0.651
  133   1HA   GLY  17          2HA       GLY  17  -3.404   9.087  -0.439
  134   2HA   GLY  17          1HA       GLY  17  -2.804   8.022  -1.701
  135    HA   PRO  18           HA       PRO  18  -7.206   9.482  -2.653
  136   1HB   PRO  18          2HB       PRO  18  -6.879  11.810  -3.920
  137   2HB   PRO  18          1HB       PRO  18  -6.924  11.728  -2.155
  138   1HG   PRO  18          2HG       PRO  18  -4.567  11.964  -3.982
  139   2HG   PRO  18          1HG       PRO  18  -4.876  12.784  -2.442
  140   1HD   PRO  18          2HD       PRO  18  -3.274  10.553  -2.739
  141   2HD   PRO  18          1HD       PRO  18  -4.050  11.042  -1.220
  142    H    PHE  19           H        PHE  19  -4.257   9.150  -4.386
  143    HA   PHE  19           HA       PHE  19  -3.755   8.384  -6.463
  144   1HB   PHE  19          2HB       PHE  19  -6.664   7.590  -6.374
  145   2HB   PHE  19          1HB       PHE  19  -5.619   7.216  -7.739
  146    HD1  PHE  19           1HD      PHE  19  -5.387   6.991  -4.021
  147    HD2  PHE  19           2HD      PHE  19  -4.858   5.062  -7.775
  148    HE1  PHE  19           1HE      PHE  19  -4.618   4.960  -2.863
  149    HE2  PHE  19           2HE      PHE  19  -4.087   3.027  -6.626
  150    HZ   PHE  19           HZ       PHE  19  -3.967   2.974  -4.168
  151    H    THR  20           H        THR  20  -7.065   9.385  -7.198
  152    HA   THR  20           HA       THR  20  -5.986  11.615  -8.784
  153    HB   THR  20           HB       THR  20  -8.107  10.947 -10.292
  154    HG1  THR  20           1HG      THR  20  -7.118   8.472  -9.326
  155   1HG2  THR  20          1HG2      THR  20  -5.937   9.190 -11.029
  156   2HG2  THR  20          2HG2      THR  20  -5.369  10.809 -10.619
  157   3HG2  THR  20          3HG2      THR  20  -6.595  10.594 -11.869
  158    H    ASN  21           H        ASN  21  -9.274  10.365  -8.283
  159    HA   ASN  21           HA       ASN  21 -10.082  12.214  -6.344
  160   1HB   ASN  21          2HB       ASN  21  -9.728  13.449  -8.817
  161   2HB   ASN  21          1HB       ASN  21 -11.466  13.181  -8.714
  162   1HD2  ASN  21          1HD2      ASN  21  -9.622  15.586  -8.487
  163   2HD2  ASN  21          2HD2      ASN  21 -10.164  16.386  -7.056
  164    H    MET  22           H        MET  22 -10.475   9.493  -6.891
  165    HA   MET  22           HA       MET  22 -13.185   9.176  -6.363
  166   1HB   MET  22          2HB       MET  22 -12.851   9.723  -9.047
  167   2HB   MET  22          1HB       MET  22 -12.922   7.966  -9.017
  168   1HG   MET  22          2HG       MET  22 -15.057   8.030  -7.899
  169   2HG   MET  22          1HG       MET  22 -14.976   9.787  -7.781
  170   1HE   MET  22          1HE       MET  22 -16.901   7.262 -10.643
  171   2HE   MET  22          2HE       MET  22 -17.794   8.483  -9.736
  172   3HE   MET  22          3HE       MET  22 -16.731   7.357  -8.890
  173    HA   PRO  23           HA       PRO  23 -11.140   4.850  -7.535
  174   1HB   PRO  23          2HB       PRO  23  -8.320   5.779  -7.691
  175   2HB   PRO  23          1HB       PRO  23  -9.157   4.552  -8.648
  176   1HG   PRO  23          2HG       PRO  23  -8.592   6.931  -9.696
  177   2HG   PRO  23          1HG       PRO  23 -10.128   6.120 -10.054
  178   1HD   PRO  23          2HD       PRO  23  -9.573   8.392  -8.193
  179   2HD   PRO  23          1HD       PRO  23 -10.961   8.129  -9.267
  180    H    THR  24           H        THR  24 -11.833   4.949  -5.283
  181    HA   THR  24           HA       THR  24  -9.583   4.505  -3.487
  182    HB   THR  24           HB       THR  24 -11.607   5.984  -2.055
  183    HG1  THR  24           1HG      THR  24 -10.391   7.335  -4.230
  184   1HG2  THR  24          1HG2      THR  24  -9.699   6.221  -0.923
  185   2HG2  THR  24          2HG2      THR  24  -9.406   7.565  -2.027
  186   3HG2  THR  24          3HG2      THR  24  -8.700   5.982  -2.357
  187    H    ASP  25           H        ASP  25 -13.143   4.698  -3.611
  188    HA   ASP  25           HA       ASP  25 -13.372   2.454  -1.783
  189   1HB   ASP  25          2HB       ASP  25 -15.398   4.225  -3.156
  190   2HB   ASP  25          1HB       ASP  25 -15.867   2.814  -2.211
  191    H    GLN  26           H        GLN  26 -13.522   3.146  -5.163
  192    HA   GLN  26           HA       GLN  26 -14.799   0.704  -5.938
  193   1HB   GLN  26          2HB       GLN  26 -14.326   3.098  -7.171
  194   2HB   GLN  26          1HB       GLN  26 -13.102   2.080  -7.914
  195   1HG   GLN  26          2HG       GLN  26 -15.224   0.459  -8.132
  196   2HG   GLN  26          1HG       GLN  26 -16.036   2.024  -8.166
  197   1HE2  GLN  26          1HE2      GLN  26 -16.054   0.285 -10.322
  198   2HE2  GLN  26          2HE2      GLN  26 -15.155   0.986 -11.619
  199    H    LEU  27           H        LEU  27 -11.562   1.788  -5.315
  200    HA   LEU  27           HA       LEU  27 -10.212  -0.345  -6.641
  201   1HB   LEU  27          2HB       LEU  27  -9.118   1.793  -6.154
  202   2HB   LEU  27          1HB       LEU  27  -9.285   1.497  -4.433
  203    HG   LEU  27           HG       LEU  27  -7.876  -0.639  -4.913
  204   1HD1  LEU  27          1HD1      LEU  27  -8.112   0.030  -7.470
  205   2HD1  LEU  27          2HD1      LEU  27  -6.680  -0.784  -6.839
  206   3HD1  LEU  27          3HD1      LEU  27  -6.661   0.961  -7.094
  207   1HD2  LEU  27          1HD2      LEU  27  -6.167   1.736  -5.239
  208   2HD2  LEU  27          2HD2      LEU  27  -6.138   0.472  -4.009
  209   3HD2  LEU  27          3HD2      LEU  27  -7.302   1.792  -3.889
  210    H    GLU  28           H        GLU  28 -10.968   0.317  -3.212
  211    HA   GLU  28           HA       GLU  28  -9.912  -2.116  -2.246
  212   1HB   GLU  28          2HB       GLU  28 -11.470  -1.647  -0.264
  213   2HB   GLU  28          1HB       GLU  28 -10.223  -0.460  -0.623
  214   1HG   GLU  28          2HG       GLU  28 -11.713   1.141  -1.039
  215   2HG   GLU  28          1HG       GLU  28 -12.733   0.068  -1.995
  216    H    TRP  29           H        TRP  29 -12.937  -1.296  -3.733
  217    HA   TRP  29           HA       TRP  29 -14.385  -3.600  -2.886
  218   1HB   TRP  29          2HB       TRP  29 -15.783  -1.896  -3.652
  219   2HB   TRP  29          1HB       TRP  29 -14.734  -1.510  -5.011
  220    HD1  TRP  29           HD       TRP  29 -17.013  -4.463  -3.942
  221    HE1  TRP  29           1HE      TRP  29 -18.164  -5.381  -6.054
  222    HE3  TRP  29           3HE      TRP  29 -14.813  -1.450  -7.432
  223    HZ2  TRP  29           2HZ      TRP  29 -18.137  -4.892  -8.835
  224    HZ3  TRP  29           3HZ      TRP  29 -15.427  -1.739  -9.796
  225    HH2  TRP  29           HH       TRP  29 -17.053  -3.426 -10.482
  226    H    MET  30           H        MET  30 -12.672  -2.731  -5.850
  227    HA   MET  30           HA       MET  30 -13.033  -5.064  -7.295
  228   1HB   MET  30          2HB       MET  30 -10.648  -3.208  -7.250
  229   2HB   MET  30          1HB       MET  30 -10.920  -4.447  -8.466
  230   1HG   MET  30          2HG       MET  30 -12.583  -3.288  -9.488
  231   2HG   MET  30          1HG       MET  30 -13.083  -2.480  -8.003
  232   1HE   MET  30          1HE       MET  30  -9.172  -1.510 -10.123
  233   2HE   MET  30          2HE       MET  30 -10.477  -1.956 -11.220
  234   3HE   MET  30          3HE       MET  30  -9.961  -3.079  -9.961
  235    H    VAL  31           H        VAL  31 -10.401  -4.266  -5.010
  236    HA   VAL  31           HA       VAL  31  -9.029  -6.712  -5.281
  237    HB   VAL  31           HB       VAL  31  -8.041  -6.212  -3.057
  238   1HG1  VAL  31          1HG1      VAL  31  -6.586  -4.853  -4.061
  239   2HG1  VAL  31          2HG1      VAL  31  -7.792  -3.578  -4.250
  240   3HG1  VAL  31          3HG1      VAL  31  -7.678  -4.870  -5.447
  241   1HG2  VAL  31          1HG2      VAL  31  -9.937  -5.199  -1.965
  242   2HG2  VAL  31          2HG2      VAL  31  -9.920  -3.865  -3.118
  243   3HG2  VAL  31          3HG2      VAL  31  -8.589  -4.063  -1.981
  244    H    GLN  32           H        GLN  32 -11.540  -5.636  -3.056
  245    HA   GLN  32           HA       GLN  32 -11.715  -7.917  -1.453
  246   1HB   GLN  32          2HB       GLN  32 -13.272  -5.523  -1.942
  247   2HB   GLN  32          1HB       GLN  32 -14.322  -6.908  -1.689
  248   1HG   GLN  32          2HG       GLN  32 -13.579  -7.243   0.470
  249   2HG   GLN  32          1HG       GLN  32 -12.069  -6.375   0.196
  250   1HE2  GLN  32          1HE2      GLN  32 -14.562  -6.173   2.047
  251   2HE2  GLN  32          2HE2      GLN  32 -14.886  -4.476   2.055
  252    H    LEU  33           H        LEU  33 -13.066  -7.156  -4.580
  253    HA   LEU  33           HA       LEU  33 -14.823  -9.383  -4.758
  254   1HB   LEU  33          2HB       LEU  33 -14.946  -7.253  -6.101
  255   2HB   LEU  33          1HB       LEU  33 -13.584  -7.842  -7.033
  256    HG   LEU  33           HG       LEU  33 -14.873  -9.685  -7.884
  257   1HD1  LEU  33          1HD1      LEU  33 -17.336  -9.801  -7.294
  258   2HD1  LEU  33          2HD1      LEU  33 -16.953  -8.757  -5.924
  259   3HD1  LEU  33          3HD1      LEU  33 -16.202 -10.348  -6.058
  260   1HD2  LEU  33          1HD2      LEU  33 -16.859  -7.499  -8.144
  261   2HD2  LEU  33          2HD2      LEU  33 -16.098  -8.496  -9.384
  262   3HD2  LEU  33          3HD2      LEU  33 -15.205  -7.163  -8.655
  263    H    CYS  34           H        CYS  34 -11.433  -8.990  -5.158
  264    HA   CYS  34           HA       CYS  34 -11.154 -11.416  -6.744
  265   1HB   CYS  34          2HB       CYS  34  -9.287  -9.236  -5.882
  266   2HB   CYS  34          1HB       CYS  34  -8.640 -10.778  -6.430
  267    HG   CYS  34           HG       CYS  34 -10.299  -8.865  -8.238
  268    H    GLY  35           H        GLY  35 -11.508 -10.751  -3.512
  269   1HA   GLY  35          2HA       GLY  35 -11.497 -12.727  -2.060
  270   2HA   GLY  35          1HA       GLY  35  -9.965 -13.166  -2.796
  271    H    ALA  36           H        ALA  36  -9.734  -9.941  -2.474
  272    HA   ALA  36           HA       ALA  36  -8.133 -10.191  -0.069
  273   1HB   ALA  36          1HB       ALA  36  -8.507  -7.995  -2.082
  274   2HB   ALA  36          2HB       ALA  36  -7.075  -8.984  -1.788
  275   3HB   ALA  36          3HB       ALA  36  -7.573  -7.777  -0.602
  276    H    SER  37           H        SER  37  -8.200  -8.023   1.275
  277    HA   SER  37           HA       SER  37 -10.989  -7.381   1.928
  278   1HB   SER  37          2HB       SER  37  -9.400  -9.048   3.489
  279   2HB   SER  37          1HB       SER  37  -9.278  -7.481   4.290
  280    HG   SER  37           HG       SER  37 -11.674  -7.472   4.071
  281    H    VAL  38           H        VAL  38 -11.354  -5.264   2.325
  282    HA   VAL  38           HA       VAL  38  -9.278  -3.389   1.783
  283    HB   VAL  38           HB       VAL  38 -11.619  -2.960   1.162
  284   1HG1  VAL  38          1HG1      VAL  38 -13.328  -2.527   2.714
  285   2HG1  VAL  38          2HG1      VAL  38 -12.194  -2.418   4.060
  286   3HG1  VAL  38          3HG1      VAL  38 -12.526  -3.979   3.312
  287   1HG2  VAL  38          1HG2      VAL  38 -10.386  -0.976   3.068
  288   2HG2  VAL  38          2HG2      VAL  38 -11.733  -0.611   1.988
  289   3HG2  VAL  38          3HG2      VAL  38 -10.164  -1.063   1.321
  290    H    VAL  39           H        VAL  39  -7.747  -2.842   3.173
  291    HA   VAL  39           HA       VAL  39  -8.230  -3.069   6.044
  292    HB   VAL  39           HB       VAL  39  -5.600  -2.194   4.949
  293   1HG1  VAL  39          1HG1      VAL  39  -6.247  -2.540   7.418
  294   2HG1  VAL  39          2HG1      VAL  39  -4.711  -3.185   6.838
  295   3HG1  VAL  39          3HG1      VAL  39  -6.094  -4.258   7.049
  296   1HG2  VAL  39          1HG2      VAL  39  -5.232  -4.857   4.928
  297   2HG2  VAL  39          2HG2      VAL  39  -5.628  -3.918   3.488
  298   3HG2  VAL  39          3HG2      VAL  39  -6.900  -4.773   4.360
  299    H    LYS  40           H        LYS  40  -8.372  -1.380   7.409
  300    HA   LYS  40           HA       LYS  40  -8.677   1.252   6.284
  301   1HB   LYS  40          2HB       LYS  40  -9.254   1.896   8.622
  302   2HB   LYS  40          1HB       LYS  40 -10.231   0.578   7.988
  303   1HG   LYS  40          2HG       LYS  40  -9.024  -1.032   9.264
  304   2HG   LYS  40          1HG       LYS  40  -7.824   0.169   9.745
  305   1HD   LYS  40          2HD       LYS  40  -9.725   1.431  10.843
  306   2HD   LYS  40          1HD       LYS  40 -10.714  -0.007  10.573
  307   1HE   LYS  40          2HE       LYS  40  -8.096  -0.477  11.840
  308   2HE   LYS  40          1HE       LYS  40  -9.253   0.439  12.805
  309   1HZ   LYS  40          1HZ       LYS  40  -9.249  -2.106  12.978
  310   2HZ   LYS  40          2HZ       LYS  40 -10.055  -2.078  11.492
  311   3HZ   LYS  40          3HZ       LYS  40 -10.739  -1.316  12.839
  312    H    GLU  41           H        GLU  41  -6.342  -0.415   8.316
  313    HA   GLU  41           HA       GLU  41  -4.552   1.899   8.017
  314   1HB   GLU  41          2HB       GLU  41  -4.763   0.225  10.523
  315   2HB   GLU  41          1HB       GLU  41  -3.746   1.638  10.280
  316   1HG   GLU  41          2HG       GLU  41  -6.039   2.813   9.799
  317   2HG   GLU  41          1HG       GLU  41  -6.677   1.466  10.738
  318    H    LEU  42           H        LEU  42  -2.242   1.325   8.400
  319    HA   LEU  42           HA       LEU  42  -1.560  -0.968   6.841
  320   1HB   LEU  42          2HB       LEU  42   0.297   0.777   8.456
  321   2HB   LEU  42          1HB       LEU  42   0.726  -0.255   7.105
  322    HG   LEU  42           HG       LEU  42  -1.052   2.176   6.894
  323   1HD1  LEU  42          1HD1      LEU  42   1.879   1.836   6.763
  324   2HD1  LEU  42          2HD1      LEU  42   0.915   3.238   7.226
  325   3HD1  LEU  42          3HD1      LEU  42   1.141   2.847   5.521
  326   1HD2  LEU  42          1HD2      LEU  42   0.276   1.205   4.497
  327   2HD2  LEU  42          2HD2      LEU  42  -1.419   1.616   4.767
  328   3HD2  LEU  42          3HD2      LEU  42  -0.822   0.012   5.195
  329    H    SER  43           H        SER  43  -1.456  -0.155  10.263
  330    HA   SER  43           HA       SER  43  -0.045  -2.526  11.028
  331   1HB   SER  43          2HB       SER  43  -1.624  -0.527  12.662
  332   2HB   SER  43          1HB       SER  43  -0.650  -1.830  13.344
  333    HG   SER  43           HG       SER  43   1.129  -0.852  12.090
  334    H    SER  44           H        SER  44  -3.167  -2.054   9.967
  335    HA   SER  44           HA       SER  44  -4.464  -3.931  11.737
  336   1HB   SER  44          2HB       SER  44  -5.285  -2.158   9.516
  337   2HB   SER  44          1HB       SER  44  -6.222  -3.641   9.696
  338    HG   SER  44           HG       SER  44  -6.565  -1.469  11.038
  339    H    PHE  45           H        PHE  45  -2.259  -4.392   9.379
  340    HA   PHE  45           HA       PHE  45  -3.437  -6.420   7.790
  341   1HB   PHE  45          2HB       PHE  45  -0.583  -5.655   8.379
  342   2HB   PHE  45          1HB       PHE  45  -0.981  -7.029   7.352
  343    HD1  PHE  45           1HD      PHE  45  -3.297  -6.021   5.865
  344    HD2  PHE  45           2HD      PHE  45   0.329  -4.078   6.955
  345    HE1  PHE  45           1HE      PHE  45  -3.532  -4.512   3.937
  346    HE2  PHE  45           2HE      PHE  45   0.101  -2.564   5.030
  347    HZ   PHE  45           HZ       PHE  45  -1.833  -2.779   3.518
  348    H    THR  46           H        THR  46  -2.912  -8.699   7.810
  349    HA   THR  46           HA       THR  46  -2.822 -10.746   8.797
  350    HB   THR  46           HB       THR  46  -1.260  -9.712  11.112
  351    HG1  THR  46           1HG      THR  46   0.503  -9.289   9.891
  352   1HG2  THR  46          1HG2      THR  46  -1.508 -12.190   9.647
  353   2HG2  THR  46          2HG2      THR  46  -0.835 -11.881  11.247
  354   3HG2  THR  46          3HG2      THR  46   0.172 -11.680   9.813
  355    H    LEU  47           H        LEU  47  -4.936 -11.018   9.383
  356    HA   LEU  47           HA       LEU  47  -5.777 -10.023  12.010
  357   1HB   LEU  47          2HB       LEU  47  -7.071 -10.194   9.520
  358   2HB   LEU  47          1HB       LEU  47  -7.852 -11.385  10.543
  359    HG   LEU  47           HG       LEU  47  -9.069  -9.324  10.694
  360   1HD1  LEU  47          1HD1      LEU  47  -7.533  -9.297  13.247
  361   2HD1  LEU  47          2HD1      LEU  47  -8.433 -10.745  12.797
  362   3HD1  LEU  47          3HD1      LEU  47  -9.273  -9.205  12.976
  363   1HD2  LEU  47          1HD2      LEU  47  -8.177  -7.252  10.915
  364   2HD2  LEU  47          2HD2      LEU  47  -6.795  -8.040  10.154
  365   3HD2  LEU  47          3HD2      LEU  47  -6.829  -7.815  11.904
  366    H    GLY  48           H        GLY  48  -5.241 -12.953  10.174
  367   1HA   GLY  48          2HA       GLY  48  -5.603 -14.485  12.665
  368   2HA   GLY  48          1HA       GLY  48  -6.346 -15.044  11.174
  369    H    THR  49           H        THR  49  -5.131 -16.112   9.672
  370    HA   THR  49           HA       THR  49  -2.243 -16.307  10.107
  371    HB   THR  49           HB       THR  49  -3.814 -18.808   9.578
  372    HG1  THR  49           1HG      THR  49  -4.667 -18.538  11.478
  373   1HG2  THR  49          1HG2      THR  49  -1.710 -19.353  11.274
  374   2HG2  THR  49          2HG2      THR  49  -1.058 -18.157  10.156
  375   3HG2  THR  49          3HG2      THR  49  -1.767 -19.648   9.536
  376    H    GLY  50           H        GLY  50  -4.986 -17.221   8.041
  377   1HA   GLY  50          2HA       GLY  50  -3.208 -17.350   5.724
  378   2HA   GLY  50          1HA       GLY  50  -4.895 -17.835   5.765
  379    H    VAL  51           H        VAL  51  -2.857 -14.953   6.052
  380    HA   VAL  51           HA       VAL  51  -4.646 -13.539   4.233
  381    HB   VAL  51           HB       VAL  51  -3.852 -12.298   6.867
  382   1HG1  VAL  51          1HG1      VAL  51  -4.242 -10.488   5.557
  383   2HG1  VAL  51          2HG1      VAL  51  -5.911 -10.839   6.005
  384   3HG1  VAL  51          3HG1      VAL  51  -5.285 -11.376   4.447
  385   1HG2  VAL  51          1HG2      VAL  51  -6.414 -12.480   7.242
  386   2HG2  VAL  51          2HG2      VAL  51  -5.392 -13.880   7.565
  387   3HG2  VAL  51          3HG2      VAL  51  -6.317 -13.791   6.066
  388    H    HIS  52           H        HIS  52  -3.464 -12.526   2.748
  389    HA   HIS  52           HA       HIS  52  -0.621 -12.103   3.245
  390   1HB   HIS  52          2HB       HIS  52  -2.269 -12.647   0.909
  391   2HB   HIS  52          1HB       HIS  52  -1.156 -11.311   0.629
  392    HD1  HIS  52           1HD      HIS  52  -0.548 -14.514   2.584
  393    HD2  HIS  52           2HD      HIS  52   0.849 -12.494  -0.768
  394    HE1  HIS  52           1HE      HIS  52   1.428 -15.842   1.774
  395    HE2  HIS  52           2HE      HIS  52   2.195 -14.655  -0.311
  396    HA   PRO  53           HA       PRO  53  -1.533  -7.757   3.865
  397   1HB   PRO  53          2HB       PRO  53   0.906  -6.989   4.650
  398   2HB   PRO  53          1HB       PRO  53  -0.121  -7.988   5.686
  399   1HG   PRO  53          2HG       PRO  53   2.179  -8.797   3.951
  400   2HG   PRO  53          1HG       PRO  53   1.773  -9.332   5.591
  401   1HD   PRO  53          2HD       PRO  53   1.188 -10.752   3.306
  402   2HD   PRO  53          1HD       PRO  53   0.304 -10.912   4.836
  403    H    ILE  54           H        ILE  54  -1.697  -6.276   2.313
  404    HA   ILE  54           HA       ILE  54   0.582  -5.739   0.557
  405    HB   ILE  54           HB       ILE  54  -2.194  -6.096  -0.569
  406   1HG1  ILE  54          2HG1      ILE  54  -1.206  -8.244   0.299
  407   2HG1  ILE  54          1HG1      ILE  54  -1.541  -8.236  -1.428
  408   1HG2  ILE  54          1HG2      ILE  54   0.471  -5.385  -1.678
  409   2HG2  ILE  54          2HG2      ILE  54  -1.123  -4.737  -2.062
  410   3HG2  ILE  54          3HG2      ILE  54  -0.640  -6.316  -2.682
  411   1HD1  ILE  54          1HD1      ILE  54   1.126  -7.346  -1.020
  412   2HD1  ILE  54          2HD1      ILE  54   0.551  -8.797  -1.842
  413   3HD1  ILE  54          3HD1      ILE  54   0.874  -8.834  -0.109
  414    H    VAL  55           H        VAL  55   0.352  -3.691  -0.624
  415    HA   VAL  55           HA       VAL  55  -1.648  -1.844   0.448
  416    HB   VAL  55           HB       VAL  55   1.256  -1.047   0.384
  417   1HG1  VAL  55          1HG1      VAL  55  -0.077   0.482   2.244
  418   2HG1  VAL  55          2HG1      VAL  55  -1.274   0.269   0.967
  419   3HG1  VAL  55          3HG1      VAL  55   0.302   0.962   0.589
  420   1HG2  VAL  55          1HG2      VAL  55   0.793  -2.934   2.005
  421   2HG2  VAL  55          2HG2      VAL  55  -0.252  -1.810   2.871
  422   3HG2  VAL  55          3HG2      VAL  55   1.468  -1.461   2.700
  423    H    VAL  56           H        VAL  56  -2.003   0.013  -0.853
  424    HA   VAL  56           HA       VAL  56  -0.851  -0.204  -3.559
  425    HB   VAL  56           HB       VAL  56  -3.503   1.075  -3.009
  426   1HG1  VAL  56          1HG1      VAL  56  -2.262  -0.169  -5.454
  427   2HG1  VAL  56          2HG1      VAL  56  -2.539   1.548  -5.158
  428   3HG1  VAL  56          3HG1      VAL  56  -3.908   0.458  -5.369
  429   1HG2  VAL  56          1HG2      VAL  56  -2.876  -1.745  -2.816
  430   2HG2  VAL  56          2HG2      VAL  56  -4.079  -1.419  -4.065
  431   3HG2  VAL  56          3HG2      VAL  56  -4.361  -0.888  -2.406
  432    H    VAL  57           H        VAL  57  -0.643   1.801  -4.758
  433    HA   VAL  57           HA       VAL  57  -0.680   4.271  -3.212
  434    HB   VAL  57           HB       VAL  57   1.659   4.806  -4.064
  435   1HG1  VAL  57          1HG1      VAL  57   1.105   2.789  -1.915
  436   2HG1  VAL  57          2HG1      VAL  57   1.432   4.515  -1.757
  437   3HG1  VAL  57          3HG1      VAL  57   2.730   3.409  -2.207
  438   1HG2  VAL  57          1HG2      VAL  57   2.115   1.857  -4.129
  439   2HG2  VAL  57          2HG2      VAL  57   3.072   3.159  -4.836
  440   3HG2  VAL  57          3HG2      VAL  57   1.544   2.685  -5.578
  441    H    GLN  58           H        GLN  58   0.357   6.063  -4.822
  442    HA   GLN  58           HA       GLN  58   0.167   5.835  -7.563
  443   1HB   GLN  58          2HB       GLN  58  -2.401   5.643  -6.376
  444   2HB   GLN  58          1HB       GLN  58  -2.314   7.214  -7.159
  445   1HG   GLN  58          2HG       GLN  58  -1.269   5.027  -8.786
  446   2HG   GLN  58          1HG       GLN  58  -2.976   4.867  -8.377
  447   1HE2  GLN  58          1HE2      GLN  58  -4.416   6.009  -9.493
  448   2HE2  GLN  58          2HE2      GLN  58  -4.037   7.256 -10.628
  449    HA   PRO  59           HA       PRO  59   1.583   9.929  -6.107
  450   1HB   PRO  59          2HB       PRO  59   3.699  10.114  -7.759
  451   2HB   PRO  59          1HB       PRO  59   3.753   9.153  -6.277
  452   1HG   PRO  59          2HG       PRO  59   3.336   8.256  -9.101
  453   2HG   PRO  59          1HG       PRO  59   4.340   7.529  -7.833
  454   1HD   PRO  59          2HD       PRO  59   1.851   6.616  -8.499
  455   2HD   PRO  59          1HD       PRO  59   2.561   6.437  -6.882
  456    H    ASP  60           H        ASP  60  -0.653  10.024  -7.520
  457    HA   ASP  60           HA       ASP  60  -0.026  11.595  -9.930
  458   1HB   ASP  60          2HB       ASP  60  -1.864   9.455  -9.522
  459   2HB   ASP  60          1HB       ASP  60  -2.796  10.914  -9.844
  460    H    ALA  61           H        ALA  61  -2.068  11.426  -7.059
  461    HA   ALA  61           HA       ALA  61  -2.565  14.320  -7.326
  462   1HB   ALA  61          1HB       ALA  61  -4.361  12.261  -6.049
  463   2HB   ALA  61          2HB       ALA  61  -4.614  13.018  -7.622
  464   3HB   ALA  61          3HB       ALA  61  -4.679  13.992  -6.153
  465    H    TRP  62           H        TRP  62  -0.322  12.969  -6.015
  466    HA   TRP  62           HA       TRP  62  -0.847  13.464  -3.179
  467   1HB   TRP  62          2HB       TRP  62   0.860  11.666  -4.639
  468   2HB   TRP  62          1HB       TRP  62   1.834  12.648  -3.549
  469    HD1  TRP  62           HD       TRP  62  -1.164  10.212  -3.449
  470    HE1  TRP  62           1HE      TRP  62  -1.243   9.138  -1.111
  471    HE3  TRP  62           3HE      TRP  62   2.579  12.875  -1.205
  472    HZ2  TRP  62           2HZ      TRP  62   0.102   9.388   1.358
  473    HZ3  TRP  62           3HZ      TRP  62   3.120  12.396   1.147
  474    HH2  TRP  62           HH       TRP  62   1.907  10.689   2.401
  475    H    THR  63           H        THR  63   1.472  14.383  -5.716
  476    HA   THR  63           HA       THR  63   2.763  16.233  -6.003
  477    HB   THR  63           HB       THR  63   1.108  17.713  -3.986
  478    HG1  THR  63           1HG      THR  63  -0.501  16.779  -5.089
  479   1HG2  THR  63          1HG2      THR  63   2.538  18.406  -6.506
  480   2HG2  THR  63          2HG2      THR  63   2.587  19.195  -4.929
  481   3HG2  THR  63          3HG2      THR  63   1.172  19.381  -5.965
  482    H    GLU  64           H        GLU  64   4.434  17.500  -5.019
  483    HA   GLU  64           HA       GLU  64   5.515  16.234  -2.668
  484   1HB   GLU  64          2HB       GLU  64   6.514  17.822  -4.859
  485   2HB   GLU  64          1HB       GLU  64   7.096  18.468  -3.332
  486   1HG   GLU  64          2HG       GLU  64   7.761  16.059  -2.783
  487   2HG   GLU  64          1HG       GLU  64   7.533  15.749  -4.503
  488    H    ASP  65           H        ASP  65   4.029  16.835  -1.045
  489    HA   ASP  65           HA       ASP  65   4.393  19.594  -0.101
  490   1HB   ASP  65          2HB       ASP  65   1.791  18.050  -0.096
  491   2HB   ASP  65          1HB       ASP  65   2.039  19.623   0.657
  492    H    ASN  66           H        ASN  66   2.912  16.520   0.948
  493    HA   ASN  66           HA       ASN  66   3.785  16.974   3.666
  494   1HB   ASN  66          2HB       ASN  66   1.632  15.686   2.612
  495   2HB   ASN  66          1HB       ASN  66   2.696  14.325   2.956
  496   1HD2  ASN  66          1HD2      ASN  66   3.970  15.202   5.220
  497   2HD2  ASN  66          2HD2      ASN  66   2.827  15.346   6.506
  498    H    GLY  67           H        GLY  67   4.464  14.631   1.081
  499   1HA   GLY  67          2HA       GLY  67   6.915  14.125   0.870
  500   2HA   GLY  67          1HA       GLY  67   6.863  13.806   2.598
  501    H    PHE  68           H        PHE  68   6.476  12.505  -0.513
  502    HA   PHE  68           HA       PHE  68   5.148  10.103   0.515
  503   1HB   PHE  68          2HB       PHE  68   4.310  11.262  -1.577
  504   2HB   PHE  68          1HB       PHE  68   5.793  10.734  -2.367
  505    HD1  PHE  68           1HD      PHE  68   6.070   8.498  -3.099
  506    HD2  PHE  68           2HD      PHE  68   2.670   9.591  -0.784
  507    HE1  PHE  68           1HE      PHE  68   5.024   6.333  -3.621
  508    HE2  PHE  68           2HE      PHE  68   1.619   7.428  -1.301
  509    HZ   PHE  68           HZ       PHE  68   2.797   5.796  -2.716
  510    H    HIS  69           H        HIS  69   8.184  11.125   0.454
  511    HA   HIS  69           HA       HIS  69   9.401   8.752  -0.714
  512   1HB   HIS  69          2HB       HIS  69  10.219  11.431  -0.364
  513   2HB   HIS  69          1HB       HIS  69  11.286  10.457   0.642
  514    HD1  HIS  69           1HD      HIS  69  12.737   8.645  -0.601
  515    HD2  HIS  69           2HD      HIS  69  10.641  11.232  -3.086
  516    HE1  HIS  69           1HE      HIS  69  13.761   8.363  -2.880
  517    HE2  HIS  69           2HE      HIS  69  12.419   9.876  -4.385
  518    H    ALA  70           H        ALA  70   7.854   7.961   1.328
  519    HA   ALA  70           HA       ALA  70   9.696   6.676   3.062
  520   1HB   ALA  70          1HB       ALA  70   9.188   9.168   3.944
  521   2HB   ALA  70          2HB       ALA  70   9.546   7.808   5.009
  522   3HB   ALA  70          3HB       ALA  70   7.873   8.290   4.726
  523    H    ILE  71           H        ILE  71   7.594   5.928   1.281
  524    HA   ILE  71           HA       ILE  71   5.257   5.211   2.754
  525    HB   ILE  71           HB       ILE  71   6.225   3.990   0.172
  526   1HG1  ILE  71          2HG1      ILE  71   6.136   6.455   0.021
  527   2HG1  ILE  71          1HG1      ILE  71   4.899   5.690  -0.972
  528   1HG2  ILE  71          1HG2      ILE  71   3.668   3.960   1.694
  529   2HG2  ILE  71          2HG2      ILE  71   4.473   2.662   0.813
  530   3HG2  ILE  71          3HG2      ILE  71   3.607   3.920  -0.069
  531   1HD1  ILE  71          1HD1      ILE  71   3.187   6.424   0.357
  532   2HD1  ILE  71          2HD1      ILE  71   4.331   7.757   0.509
  533   3HD1  ILE  71          3HD1      ILE  71   4.207   6.552   1.790
  534    H    GLY  72           H        GLY  72   7.808   3.166   1.305
  535   1HA   GLY  72          2HA       GLY  72   7.065   0.800   2.602
  536   2HA   GLY  72          1HA       GLY  72   8.662   1.137   1.951
  537    H    GLN  73           H        GLN  73   8.927   3.509   3.741
  538    HA   GLN  73           HA       GLN  73  10.073   2.108   5.974
  539   1HB   GLN  73          2HB       GLN  73   9.960   4.991   5.133
  540   2HB   GLN  73          1HB       GLN  73  10.575   4.535   6.716
  541   1HG   GLN  73          2HG       GLN  73  11.653   3.507   4.102
  542   2HG   GLN  73          1HG       GLN  73  12.336   4.850   5.016
  543   1HE2  GLN  73          1HE2      GLN  73  14.196   3.259   4.754
  544   2HE2  GLN  73          2HE2      GLN  73  14.421   2.134   6.045
  545    H    MET  74           H        MET  74   7.115   3.763   5.322
  546    HA   MET  74           HA       MET  74   6.474   4.039   8.154
  547   1HB   MET  74          2HB       MET  74   5.939   5.748   6.239
  548   2HB   MET  74          1HB       MET  74   4.561   4.696   5.947
  549   1HG   MET  74          2HG       MET  74   5.090   5.682   8.707
  550   2HG   MET  74          1HG       MET  74   4.353   6.761   7.523
  551   1HE   MET  74          1HE       MET  74   2.199   7.103   7.319
  552   2HE   MET  74          2HE       MET  74   0.825   6.049   7.653
  553   3HE   MET  74          3HE       MET  74   1.782   5.814   6.190
  554    H    CYS  75           H        CYS  75   5.722   2.063   5.387
  555    HA   CYS  75           HA       CYS  75   3.795   0.545   7.021
  556   1HB   CYS  75          2HB       CYS  75   2.764  -0.204   4.944
  557   2HB   CYS  75          1HB       CYS  75   2.801   1.554   5.001
  558    HG   CYS  75           HG       CYS  75   3.870  -0.022   2.781
  559    H    GLU  76           H        GLU  76   3.866  -1.741   6.926
  560    HA   GLU  76           HA       GLU  76   6.550  -2.770   6.417
  561   1HB   GLU  76          2HB       GLU  76   4.205  -4.114   7.772
  562   2HB   GLU  76          1HB       GLU  76   5.859  -4.706   7.727
  563   1HG   GLU  76          2HG       GLU  76   6.493  -3.411   9.423
  564   2HG   GLU  76          1HG       GLU  76   5.635  -2.006   8.793
  565    H    ALA  77           H        ALA  77   3.316  -2.961   5.187
  566    HA   ALA  77           HA       ALA  77   3.806  -5.346   3.625
  567   1HB   ALA  77          1HB       ALA  77   1.521  -4.678   2.640
  568   2HB   ALA  77          2HB       ALA  77   1.485  -3.478   3.932
  569   3HB   ALA  77          3HB       ALA  77   1.592  -5.194   4.326
  570    HA   PRO  78           HA       PRO  78   5.298  -3.477  -0.076
  571   1HB   PRO  78          2HB       PRO  78   3.993  -4.856  -2.021
  572   2HB   PRO  78          1HB       PRO  78   5.300  -5.554  -1.056
  573   1HG   PRO  78          2HG       PRO  78   2.336  -5.836  -0.714
  574   2HG   PRO  78          1HG       PRO  78   3.593  -7.084  -0.629
  575   1HD   PRO  78          2HD       PRO  78   2.519  -5.994   1.585
  576   2HD   PRO  78          1HD       PRO  78   4.225  -6.481   1.512
  577    H    VAL  79           H        VAL  79   4.848  -1.886  -1.566
  578    HA   VAL  79           HA       VAL  79   2.047  -0.972  -1.692
  579    HB   VAL  79           HB       VAL  79   3.624   1.233  -2.350
  580   1HG1  VAL  79          1HG1      VAL  79   1.481   1.042  -1.025
  581   2HG1  VAL  79          2HG1      VAL  79   2.645   2.241  -0.464
  582   3HG1  VAL  79          3HG1      VAL  79   2.491   0.701   0.380
  583   1HG2  VAL  79          1HG2      VAL  79   5.559  -0.037  -1.385
  584   2HG2  VAL  79          2HG2      VAL  79   4.731   0.011   0.172
  585   3HG2  VAL  79          3HG2      VAL  79   5.228   1.513  -0.609
  586    H    VAL  80           H        VAL  80   1.150  -0.809  -3.669
  587    HA   VAL  80           HA       VAL  80   2.917  -0.525  -5.998
  588    HB   VAL  80           HB       VAL  80   1.642  -2.235  -7.244
  589   1HG1  VAL  80          1HG1      VAL  80   3.014  -3.172  -4.732
  590   2HG1  VAL  80          2HG1      VAL  80   3.746  -2.895  -6.312
  591   3HG1  VAL  80          3HG1      VAL  80   2.602  -4.218  -6.091
  592   1HG2  VAL  80          1HG2      VAL  80   0.350  -3.895  -5.787
  593   2HG2  VAL  80          2HG2      VAL  80  -0.436  -2.364  -6.172
  594   3HG2  VAL  80          3HG2      VAL  80   0.297  -2.605  -4.586
  595    H    THR  81           H        THR  81   1.807   0.209  -7.930
  596    HA   THR  81           HA       THR  81  -0.178   2.168  -7.361
  597    HB   THR  81           HB       THR  81  -0.001   2.814  -9.617
  598    HG1  THR  81           1HG      THR  81   0.719   0.132 -10.076
  599   1HG2  THR  81          1HG2      THR  81   2.627   1.823  -9.957
  600   2HG2  THR  81          2HG2      THR  81   2.396   2.198  -8.249
  601   3HG2  THR  81          3HG2      THR  81   2.109   3.437  -9.471
  602    H    ARG  82           H        ARG  82  -2.304   2.295  -8.411
  603    HA   ARG  82           HA       ARG  82  -3.921   0.127  -7.862
  604   1HB   ARG  82          2HB       ARG  82  -5.542   1.271  -9.553
  605   2HB   ARG  82          1HB       ARG  82  -5.117   2.085  -8.056
  606   1HG   ARG  82          2HG       ARG  82  -4.456   3.841  -9.229
  607   2HG   ARG  82          1HG       ARG  82  -3.201   2.860  -9.978
  608   1HD   ARG  82          2HD       ARG  82  -5.753   2.311 -11.185
  609   2HD   ARG  82          1HD       ARG  82  -5.422   4.042 -11.213
  610    HE   ARG  82           HE       ARG  82  -3.217   2.412 -12.087
  611   1HH1  ARG  82          1HH1      ARG  82  -6.140   4.052 -13.061
  612   2HH1  ARG  82          2HH1      ARG  82  -5.659   4.190 -14.719
  613   1HH2  ARG  82          1HH2      ARG  82  -2.582   2.593 -14.267
  614   2HH2  ARG  82          2HH2      ARG  82  -3.639   3.362 -15.405
  615    H    GLU  83           H        GLU  83  -1.942   0.649 -10.641
  616    HA   GLU  83           HA       GLU  83  -3.175  -0.738 -12.653
  617   1HB   GLU  83          2HB       GLU  83  -0.294  -0.524 -11.843
  618   2HB   GLU  83          1HB       GLU  83  -0.753  -1.544 -13.199
  619   1HG   GLU  83          2HG       GLU  83  -1.579   1.332 -13.038
  620   2HG   GLU  83          1HG       GLU  83  -0.019   0.843 -13.698
  621    H    TRP  84           H        TRP  84  -1.352  -2.089  -9.935
  622    HA   TRP  84           HA       TRP  84  -1.384  -4.781 -10.643
  623   1HB   TRP  84          2HB       TRP  84  -0.137  -3.874  -8.719
  624   2HB   TRP  84          1HB       TRP  84  -1.649  -3.570  -7.882
  625    HD1  TRP  84           HD       TRP  84   0.467  -6.551  -9.144
  626    HE1  TRP  84           1HE      TRP  84  -0.075  -8.589  -7.664
  627    HE3  TRP  84           3HE      TRP  84  -3.275  -4.527  -6.310
  628    HZ2  TRP  84           2HZ      TRP  84  -1.856  -9.248  -5.571
  629    HZ3  TRP  84           3HZ      TRP  84  -4.345  -5.926  -4.593
  630    HH2  TRP  84           HH       TRP  84  -3.651  -8.235  -4.231
  631    H    VAL  85           H        VAL  85  -3.618  -3.053  -8.531
  632    HA   VAL  85           HA       VAL  85  -5.489  -5.048  -8.119
  633    HB   VAL  85           HB       VAL  85  -5.973  -2.073  -8.318
  634   1HG1  VAL  85          1HG1      VAL  85  -7.695  -4.325  -7.351
  635   2HG1  VAL  85          2HG1      VAL  85  -8.109  -2.981  -8.415
  636   3HG1  VAL  85          3HG1      VAL  85  -7.871  -2.698  -6.690
  637   1HG2  VAL  85          1HG2      VAL  85  -5.897  -2.300  -5.780
  638   2HG2  VAL  85          2HG2      VAL  85  -4.364  -2.403  -6.644
  639   3HG2  VAL  85          3HG2      VAL  85  -5.147  -3.871  -6.060
  640    H    LEU  86           H        LEU  86  -5.413  -2.601 -10.685
  641    HA   LEU  86           HA       LEU  86  -7.813  -3.420 -11.938
  642   1HB   LEU  86          2HB       LEU  86  -6.118  -1.308 -12.224
  643   2HB   LEU  86          1HB       LEU  86  -5.737  -2.238 -13.661
  644    HG   LEU  86           HG       LEU  86  -8.610  -1.738 -13.087
  645   1HD1  LEU  86          1HD1      LEU  86  -6.657   0.372 -13.960
  646   2HD1  LEU  86          2HD1      LEU  86  -7.842   0.447 -12.655
  647   3HD1  LEU  86          3HD1      LEU  86  -8.378   0.451 -14.335
  648   1HD2  LEU  86          1HD2      LEU  86  -6.852  -2.008 -15.503
  649   2HD2  LEU  86          2HD2      LEU  86  -8.494  -1.378 -15.618
  650   3HD2  LEU  86          3HD2      LEU  86  -8.217  -3.009 -15.009
  651    H    ASP  87           H        ASP  87  -4.406  -4.102 -12.687
  652    HA   ASP  87           HA       ASP  87  -4.883  -5.771 -14.894
  653   1HB   ASP  87          2HB       ASP  87  -2.676  -4.770 -14.315
  654   2HB   ASP  87          1HB       ASP  87  -2.554  -5.893 -12.965
  655    H    SER  88           H        SER  88  -4.854  -6.382 -11.448
  656    HA   SER  88           HA       SER  88  -4.894  -9.241 -11.703
  657   1HB   SER  88          2HB       SER  88  -5.528  -7.463  -9.336
  658   2HB   SER  88          1HB       SER  88  -5.365  -9.219  -9.270
  659    HG   SER  88           HG       SER  88  -3.367  -7.320  -9.938
  660    H    VAL  89           H        VAL  89  -7.322  -6.753 -10.939
  661    HA   VAL  89           HA       VAL  89  -9.472  -8.606 -10.700
  662    HB   VAL  89           HB       VAL  89  -9.629  -5.640 -11.259
  663   1HG1  VAL  89          1HG1      VAL  89 -11.648  -7.503 -11.315
  664   2HG1  VAL  89          2HG1      VAL  89 -11.850  -5.773 -11.037
  665   3HG1  VAL  89          3HG1      VAL  89 -11.736  -6.879  -9.668
  666   1HG2  VAL  89          1HG2      VAL  89  -8.458  -6.795  -9.077
  667   2HG2  VAL  89          2HG2      VAL  89 -10.121  -6.579  -8.531
  668   3HG2  VAL  89          3HG2      VAL  89  -9.194  -5.193  -9.106
  669    H    ALA  90           H        ALA  90  -8.081  -6.806 -13.358
  670    HA   ALA  90           HA       ALA  90 -10.230  -7.098 -15.176
  671   1HB   ALA  90          1HB       ALA  90  -8.291  -6.767 -16.884
  672   2HB   ALA  90          2HB       ALA  90  -7.330  -6.435 -15.443
  673   3HB   ALA  90          3HB       ALA  90  -8.746  -5.448 -15.804
  674    H    LEU  91           H        LEU  91  -7.100  -8.809 -15.079
  675    HA   LEU  91           HA       LEU  91  -8.106 -10.884 -16.816
  676   1HB   LEU  91          2HB       LEU  91  -5.807 -10.118 -17.038
  677   2HB   LEU  91          1HB       LEU  91  -5.472 -10.574 -15.379
  678    HG   LEU  91           HG       LEU  91  -6.123 -12.970 -16.164
  679   1HD1  LEU  91          1HD1      LEU  91  -5.930 -11.457 -18.700
  680   2HD1  LEU  91          2HD1      LEU  91  -6.905 -12.867 -18.290
  681   3HD1  LEU  91          3HD1      LEU  91  -5.191 -13.056 -18.655
  682   1HD2  LEU  91          1HD2      LEU  91  -3.781 -11.747 -15.699
  683   2HD2  LEU  91          2HD2      LEU  91  -3.562 -12.177 -17.395
  684   3HD2  LEU  91          3HD2      LEU  91  -3.913 -13.430 -16.206
  685    H    TYR  92           H        TYR  92  -7.900 -10.335 -13.435
  686    HA   TYR  92           HA       TYR  92  -8.631 -11.556 -11.658
  687   1HB   TYR  92          2HB       TYR  92 -10.010 -12.696 -13.843
  688   2HB   TYR  92          1HB       TYR  92  -9.391 -14.044 -12.897
  689    HD1  TYR  92           1HD      TYR  92  -9.538 -12.603 -10.174
  690    HD2  TYR  92           2HD      TYR  92 -12.319 -13.019 -13.369
  691    HE1  TYR  92           1HE      TYR  92 -11.393 -12.338  -8.585
  692    HE2  TYR  92           2HE      TYR  92 -14.183 -12.753 -11.786
  693    HH   TYR  92           HH       TYR  92 -13.790 -12.931  -8.431
  694    H    GLN  93           H        GLN  93  -6.320 -11.601 -11.216
  695    HA   GLN  93           HA       GLN  93  -5.421 -14.146 -10.468
  696   1HB   GLN  93          2HB       GLN  93  -5.032 -14.470 -12.865
  697   2HB   GLN  93          1HB       GLN  93  -4.046 -13.015 -12.913
  698   1HG   GLN  93          2HG       GLN  93  -2.288 -14.003 -11.803
  699   2HG   GLN  93          1HG       GLN  93  -3.311 -15.230 -11.058
  700   1HE2  GLN  93          1HE2      GLN  93  -1.262 -14.464 -13.646
  701   2HE2  GLN  93          2HE2      GLN  93  -1.459 -15.923 -14.550
  702    H    CYS  94           H        CYS  94  -3.961 -13.917  -8.879
  703    HA   CYS  94           HA       CYS  94  -3.234 -11.354  -7.963
  704   1HB   CYS  94          2HB       CYS  94  -1.778 -12.611  -6.355
  705   2HB   CYS  94          1HB       CYS  94  -3.455 -13.146  -6.384
  706    HG   CYS  94           HG       CYS  94  -1.518 -14.819  -8.080
  707    H    GLN  95           H        GLN  95  -2.196 -10.372  -9.776
  708    HA   GLN  95           HA       GLN  95   0.140 -11.396 -10.984
  709   1HB   GLN  95          2HB       GLN  95  -0.629  -8.487 -10.740
  710   2HB   GLN  95          1HB       GLN  95   0.408  -9.211 -11.960
  711   1HG   GLN  95          2HG       GLN  95  -2.544  -9.683 -11.618
  712   2HG   GLN  95          1HG       GLN  95  -1.772  -8.718 -12.875
  713   1HE2  GLN  95          1HE2      GLN  95  -0.308  -9.852 -14.335
  714   2HE2  GLN  95          2HE2      GLN  95  -0.649 -11.494 -14.749
  715    H    GLU  96           H        GLU  96   2.277 -10.175 -10.896
  716    HA   GLU  96           HA       GLU  96   3.220 -10.254  -8.185
  717   1HB   GLU  96          2HB       GLU  96   5.422  -9.596  -9.281
  718   2HB   GLU  96          1HB       GLU  96   4.721 -11.130  -9.778
  719   1HG   GLU  96          2HG       GLU  96   3.959  -8.801 -11.404
  720   2HG   GLU  96          1HG       GLU  96   5.658  -9.268 -11.479
  721    H    LEU  97           H        LEU  97   3.672  -8.608  -6.847
  722    HA   LEU  97           HA       LEU  97   2.666  -6.006  -7.470
  723   1HB   LEU  97          2HB       LEU  97   3.909  -7.312  -5.099
  724   2HB   LEU  97          1HB       LEU  97   3.875  -5.560  -5.156
  725    HG   LEU  97           HG       LEU  97   1.296  -6.083  -5.748
  726   1HD1  LEU  97          1HD1      LEU  97   1.997  -8.576  -5.332
  727   2HD1  LEU  97          2HD1      LEU  97   0.444  -7.965  -4.760
  728   3HD1  LEU  97          3HD1      LEU  97   1.796  -8.124  -3.639
  729   1HD2  LEU  97          1HD2      LEU  97   2.637  -4.857  -3.749
  730   2HD2  LEU  97          2HD2      LEU  97   1.871  -6.176  -2.864
  731   3HD2  LEU  97          3HD2      LEU  97   0.884  -5.047  -3.792
  732    H    ASP  98           H        ASP  98   5.832  -7.481  -7.350
  733    HA   ASP  98           HA       ASP  98   7.449  -5.221  -7.228
  734   1HB   ASP  98          2HB       ASP  98   8.047  -7.690  -8.863
  735   2HB   ASP  98          1HB       ASP  98   9.206  -6.582  -8.134
  736    H    THR  99           H        THR  99   5.458  -6.353  -9.810
  737    HA   THR  99           HA       THR  99   6.839  -5.032 -11.931
  738    HB   THR  99           HB       THR  99   3.982  -6.012 -11.777
  739    HG1  THR  99           1HG      THR  99   6.392  -7.216 -12.632
  740   1HG2  THR  99          1HG2      THR  99   3.912  -5.985 -14.145
  741   2HG2  THR  99          2HG2      THR  99   5.608  -5.512 -14.253
  742   3HG2  THR  99          3HG2      THR  99   4.414  -4.379 -13.617
  743    H    TYR 100           H        TYR 100   4.635  -3.988  -9.498
  744    HA   TYR 100           HA       TYR 100   4.600  -1.327 -10.722
  745   1HB   TYR 100          2HB       TYR 100   2.108  -2.435  -9.444
  746   2HB   TYR 100          1HB       TYR 100   2.277  -1.017 -10.472
  747    HD1  TYR 100           1HD      TYR 100   1.997  -4.665 -10.398
  748    HD2  TYR 100           2HD      TYR 100   2.396  -1.241 -12.891
  749    HE1  TYR 100           1HE      TYR 100   1.375  -6.022 -12.353
  750    HE2  TYR 100           2HE      TYR 100   1.773  -2.587 -14.853
  751    HH   TYR 100           HH       TYR 100   1.893  -5.107 -15.469
  752    H    LEU 101           H        LEU 101   6.054  -2.580  -8.481
  753    HA   LEU 101           HA       LEU 101   4.909  -1.346  -6.113
  754   1HB   LEU 101          2HB       LEU 101   6.568  -3.544  -6.588
  755   2HB   LEU 101          1HB       LEU 101   7.599  -2.366  -5.802
  756    HG   LEU 101           HG       LEU 101   4.956  -2.870  -4.556
  757   1HD1  LEU 101          1HD1      LEU 101   7.159  -4.772  -3.929
  758   2HD1  LEU 101          2HD1      LEU 101   6.106  -5.099  -5.304
  759   3HD1  LEU 101          3HD1      LEU 101   5.420  -4.939  -3.688
  760   1HD2  LEU 101          1HD2      LEU 101   7.757  -2.354  -3.585
  761   2HD2  LEU 101          2HD2      LEU 101   6.406  -2.718  -2.511
  762   3HD2  LEU 101          3HD2      LEU 101   6.369  -1.268  -3.514
  763    H    ILE 102           H        ILE 102   6.004   0.234  -4.847
  764    HA   ILE 102           HA       ILE 102   7.097   2.362  -6.314
  765    HB   ILE 102           HB       ILE 102   7.627   3.392  -4.154
  766   1HG1  ILE 102          2HG1      ILE 102   6.490   1.483  -2.364
  767   2HG1  ILE 102          1HG1      ILE 102   7.753   0.676  -3.286
  768   1HG2  ILE 102          1HG2      ILE 102   5.443   3.770  -3.539
  769   2HG2  ILE 102          2HG2      ILE 102   4.978   2.081  -3.747
  770   3HG2  ILE 102          3HG2      ILE 102   5.237   3.105  -5.160
  771   1HD1  ILE 102          1HD1      ILE 102   7.973   3.022  -1.448
  772   2HD1  ILE 102          2HD1      ILE 102   9.207   2.695  -2.664
  773   3HD1  ILE 102          3HD1      ILE 102   8.855   1.495  -1.421
  774    HA   PRO 103           HA       PRO 103  11.377   1.299  -6.602
  775   1HB   PRO 103          2HB       PRO 103  12.493   3.744  -6.839
  776   2HB   PRO 103          1HB       PRO 103  11.517   3.023  -8.125
  777   1HG   PRO 103          2HG       PRO 103  10.741   5.057  -6.069
  778   2HG   PRO 103          1HG       PRO 103  10.362   5.017  -7.801
  779   1HD   PRO 103          2HD       PRO 103   8.606   4.229  -5.877
  780   2HD   PRO 103          1HD       PRO 103   8.623   3.542  -7.513
  781    H    GLN 104           H        GLN 104  13.590   2.116  -5.675
  782    HA   GLN 104           HA       GLN 104  13.618   3.325  -3.108
  783   1HB   GLN 104          2HB       GLN 104  12.589   1.165  -2.489
  784   2HB   GLN 104          1HB       GLN 104  13.977   0.322  -3.163
  785   1HG   GLN 104          2HG       GLN 104  14.517   0.338  -0.946
  786   2HG   GLN 104          1HG       GLN 104  15.319   1.812  -1.488
  787   1HE2  GLN 104          1HE2      GLN 104  14.103   3.831  -1.211
  788   2HE2  GLN 104          2HE2      GLN 104  13.092   3.997   0.180
  789    H    ILE 105           H        ILE 105  15.300   4.489  -4.049
  790    HA   ILE 105           HA       ILE 105  17.595   3.209  -5.178
  791    HB   ILE 105           HB       ILE 105  18.614   5.529  -5.000
  792   1HG1  ILE 105          2HG1      ILE 105  15.846   6.540  -4.505
  793   2HG1  ILE 105          1HG1      ILE 105  16.821   6.058  -3.121
  794   1HG2  ILE 105          1HG2      ILE 105  16.021   5.697  -6.456
  795   2HG2  ILE 105          2HG2      ILE 105  17.187   4.456  -6.916
  796   3HG2  ILE 105          3HG2      ILE 105  17.642   6.158  -6.979
  797   1HD1  ILE 105          1HD1      ILE 105  16.962   8.459  -3.601
  798   2HD1  ILE 105          2HD1      ILE 105  17.643   8.086  -5.185
  799   3HD1  ILE 105          3HD1      ILE 105  18.526   7.654  -3.721
  800    HA   PRO 106           HA       PRO 106  19.498   2.408  -1.195
  801   1HB   PRO 106          2HB       PRO 106  21.732   1.210  -2.118
  802   2HB   PRO 106          1HB       PRO 106  20.162   0.398  -2.108
  803   1HG   PRO 106          2HG       PRO 106  21.576   1.757  -4.369
  804   2HG   PRO 106          1HG       PRO 106  20.702   0.215  -4.362
  805   1HD   PRO 106          2HD       PRO 106  19.619   2.533  -5.289
  806   2HD   PRO 106          1HD       PRO 106  18.652   1.233  -4.564
  807    H    HIS 107           H        HIS 107  21.082   4.025  -3.890
  808    HA   HIS 107           HA       HIS 107  23.050   5.222  -2.092
  809   1HB   HIS 107          2HB       HIS 107  23.210   4.340  -4.719
  810   2HB   HIS 107          1HB       HIS 107  23.153   6.093  -4.874
  811    HD1  HIS 107           1HD      HIS 107  25.630   6.122  -5.657
  812    HD2  HIS 107           2HD      HIS 107  25.058   4.629  -1.821
  813    HE1  HIS 107           1HE      HIS 107  27.917   6.056  -4.614
  814    HE2  HIS 107           2HE      HIS 107  27.558   5.067  -2.324
  815    H    SER 108           H        SER 108  23.215   7.419  -1.728
  816    HA   SER 108           HA       SER 108  20.870   9.004  -2.546
  817   1HB   SER 108          2HB       SER 108  20.934   8.649  -0.137
  818   2HB   SER 108          1HB       SER 108  22.590   9.252  -0.066
  819    HG   SER 108           HG       SER 108  21.888  11.274  -0.432
  820    H    HIS 109           H        HIS 109  21.920   9.635  -4.502
  821    HA   HIS 109           HA       HIS 109  23.797  11.845  -4.085
  822   1HB   HIS 109          2HB       HIS 109  24.359   9.348  -5.486
  823   2HB   HIS 109          1HB       HIS 109  24.622  10.761  -6.503
  824    HD1  HIS 109           1HD      HIS 109  25.276  11.081  -2.856
  825    HD2  HIS 109           2HD      HIS 109  27.411  10.341  -6.342
  826    HE1  HIS 109           1HE      HIS 109  27.697  11.352  -2.231
  827    HE2  HIS 109           2HE      HIS 109  28.964  10.987  -4.377
  828    H    TYR 110           H        TYR 110  22.734  13.574  -4.786
  829    HA   TYR 110           HA       TYR 110  21.507  14.981  -6.082
  830   1HB   TYR 110          2HB       TYR 110  22.984  13.297  -7.914
  831   2HB   TYR 110          1HB       TYR 110  21.447  13.784  -8.619
  832    HD1  TYR 110           1HD      TYR 110  21.044  16.060  -9.256
  833    HD2  TYR 110           2HD      TYR 110  24.651  14.998  -7.266
  834    HE1  TYR 110           1HE      TYR 110  21.997  18.254  -9.828
  835    HE2  TYR 110           2HE      TYR 110  25.615  17.189  -7.830
  836    HH   TYR 110           HH       TYR 110  24.834  19.451  -8.407
  Start of MODEL    3
    1   1H    GLY   1          1HT       GLY   1 -22.859 -13.914  -6.200
    2   2H    GLY   1          2HT       GLY   1 -23.054 -15.589  -6.076
    3   3H    GLY   1          3HT       GLY   1 -24.410 -14.590  -6.239
    4   1HA   GLY   1          1HA       GLY   1 -23.309 -15.892  -8.274
    5   2HA   GLY   1          2HA       GLY   1 -24.204 -14.390  -8.449
    6    H    SER   2           H        SER   2 -21.026 -14.725  -6.970
    7    HA   SER   2           HA       SER   2 -19.534 -13.978  -9.260
    8   1HB   SER   2          2HB       SER   2 -20.847 -11.837  -8.586
    9   2HB   SER   2          1HB       SER   2 -19.697 -11.747  -7.252
   10    HG   SER   2           HG       SER   2 -18.905 -11.991  -9.961
   11    H    GLN   3           H        GLN   3 -19.732 -13.837  -5.728
   12    HA   GLN   3           HA       GLN   3 -16.872 -14.123  -5.430
   13   1HB   GLN   3          2HB       GLN   3 -19.166 -13.993  -3.484
   14   2HB   GLN   3          1HB       GLN   3 -17.527 -14.353  -2.961
   15   1HG   GLN   3          2HG       GLN   3 -16.743 -12.235  -3.601
   16   2HG   GLN   3          1HG       GLN   3 -18.189 -11.897  -4.550
   17   1HE2  GLN   3          1HE2      GLN   3 -20.257 -11.952  -3.219
   18   2HE2  GLN   3          2HE2      GLN   3 -20.198 -11.156  -1.687
   19    H    ASP   4           H        ASP   4 -16.234 -16.076  -6.234
   20    HA   ASP   4           HA       ASP   4 -16.700 -18.373  -4.596
   21   1HB   ASP   4          2HB       ASP   4 -18.217 -18.037  -7.085
   22   2HB   ASP   4          1HB       ASP   4 -17.345 -19.565  -6.986
   23    H    ARG   5           H        ARG   5 -15.524 -17.186  -7.705
   24    HA   ARG   5           HA       ARG   5 -13.190 -18.960  -7.438
   25   1HB   ARG   5          2HB       ARG   5 -14.933 -18.518  -9.621
   26   2HB   ARG   5          1HB       ARG   5 -13.397 -17.783 -10.056
   27   1HG   ARG   5          2HG       ARG   5 -13.040 -20.400  -8.870
   28   2HG   ARG   5          1HG       ARG   5 -14.083 -20.450 -10.292
   29   1HD   ARG   5          2HD       ARG   5 -11.589 -18.850 -10.465
   30   2HD   ARG   5          1HD       ARG   5 -11.434 -20.607 -10.464
   31    HE   ARG   5           HE       ARG   5 -13.338 -20.163 -12.329
   32   1HH1  ARG   5          1HH1      ARG   5 -10.137 -18.860 -11.841
   33   2HH1  ARG   5          2HH1      ARG   5  -9.851 -18.599 -13.528
   34   1HH2  ARG   5          1HH2      ARG   5 -12.963 -19.819 -14.549
   35   2HH2  ARG   5          2HH2      ARG   5 -11.455 -19.143 -15.067
   36    H    LYS   6           H        LYS   6 -12.520 -17.205  -5.894
   37    HA   LYS   6           HA       LYS   6 -11.695 -14.698  -7.049
   38   1HB   LYS   6          2HB       LYS   6 -10.534 -14.504  -4.720
   39   2HB   LYS   6          1HB       LYS   6 -12.280 -14.382  -4.842
   40   1HG   LYS   6          2HG       LYS   6 -12.569 -16.598  -4.034
   41   2HG   LYS   6          1HG       LYS   6 -10.839 -16.931  -4.160
   42   1HD   LYS   6          2HD       LYS   6 -10.377 -15.288  -2.430
   43   2HD   LYS   6          1HD       LYS   6 -12.090 -14.878  -2.339
   44   1HE   LYS   6          2HE       LYS   6 -10.900 -17.579  -1.718
   45   2HE   LYS   6          1HE       LYS   6 -11.395 -16.382  -0.522
   46   1HZ   LYS   6          1HZ       LYS   6 -13.098 -17.944  -2.365
   47   2HZ   LYS   6          2HZ       LYS   6 -13.664 -16.533  -1.623
   48   3HZ   LYS   6          3HZ       LYS   6 -13.181 -17.850  -0.678
   49    H    ILE   7           H        ILE   7  -9.358 -13.963  -6.444
   50    HA   ILE   7           HA       ILE   7  -7.488 -16.091  -7.273
   51    HB   ILE   7           HB       ILE   7  -6.183 -14.334  -8.445
   52   1HG1  ILE   7          2HG1      ILE   7  -8.305 -12.449  -8.850
   53   2HG1  ILE   7          1HG1      ILE   7  -8.015 -12.614  -7.121
   54   1HG2  ILE   7          1HG2      ILE   7  -8.788 -15.389  -9.235
   55   2HG2  ILE   7          2HG2      ILE   7  -7.252 -15.393 -10.100
   56   3HG2  ILE   7          3HG2      ILE   7  -8.289 -13.968 -10.151
   57   1HD1  ILE   7          1HD1      ILE   7  -5.489 -12.388  -7.980
   58   2HD1  ILE   7          2HD1      ILE   7  -6.495 -11.010  -7.535
   59   3HD1  ILE   7          3HD1      ILE   7  -6.318 -11.461  -9.231
   60    H    PHE   8           H        PHE   8  -8.200 -13.673  -4.980
   61    HA   PHE   8           HA       PHE   8  -5.428 -13.421  -4.106
   62   1HB   PHE   8          2HB       PHE   8  -7.991 -12.046  -3.331
   63   2HB   PHE   8          1HB       PHE   8  -6.537 -11.882  -2.363
   64    HD1  PHE   8           1HD      PHE   8  -4.746 -12.015  -5.008
   65    HD2  PHE   8           2HD      PHE   8  -8.028  -9.636  -3.707
   66    HE1  PHE   8           1HE      PHE   8  -3.996 -10.184  -6.464
   67    HE2  PHE   8           2HE      PHE   8  -7.280  -7.805  -5.161
   68    HZ   PHE   8           HZ       PHE   8  -5.264  -8.076  -6.544
   69    H    ARG   9           H        ARG   9  -8.549 -14.611  -2.911
   70    HA   ARG   9           HA       ARG   9  -9.087 -15.839  -1.040
   71   1HB   ARG   9          2HB       ARG   9  -8.310 -17.525  -2.643
   72   2HB   ARG   9          1HB       ARG   9  -6.666 -17.343  -2.048
   73   1HG   ARG   9          2HG       ARG   9  -7.369 -18.168   0.145
   74   2HG   ARG   9          1HG       ARG   9  -9.017 -18.357  -0.461
   75   1HD   ARG   9          2HD       ARG   9  -6.572 -19.770  -1.522
   76   2HD   ARG   9          1HD       ARG   9  -7.796 -20.480  -0.469
   77    HE   ARG   9           HE       ARG   9  -9.252 -19.632  -2.568
   78   1HH1  ARG   9          1HH1      ARG   9  -6.347 -21.554  -2.346
   79   2HH1  ARG   9          2HH1      ARG   9  -6.684 -22.455  -3.786
   80   1HH2  ARG   9          1HH2      ARG   9  -9.697 -20.817  -4.461
   81   2HH2  ARG   9          2HH2      ARG   9  -8.586 -22.037  -4.987
   82    H    GLY  10           H        GLY  10  -8.656 -14.340   0.614
   83   1HA   GLY  10          2HA       GLY  10  -7.753 -13.846   2.690
   84   2HA   GLY  10          1HA       GLY  10  -6.645 -15.194   2.475
   85    H    LEU  11           H        LEU  11  -7.269 -11.906   1.350
   86    HA   LEU  11           HA       LEU  11  -4.414 -11.325   1.516
   87   1HB   LEU  11          2HB       LEU  11  -5.309 -12.085  -0.859
   88   2HB   LEU  11          1HB       LEU  11  -5.859 -10.424  -0.931
   89    HG   LEU  11           HG       LEU  11  -2.998 -11.137  -0.351
   90   1HD1  LEU  11          1HD1      LEU  11  -3.816 -10.238  -3.053
   91   2HD1  LEU  11          2HD1      LEU  11  -4.102 -11.926  -2.630
   92   3HD1  LEU  11          3HD1      LEU  11  -2.470 -11.262  -2.557
   93   1HD2  LEU  11          1HD2      LEU  11  -4.533  -8.711  -0.497
   94   2HD2  LEU  11          2HD2      LEU  11  -3.253  -8.706  -1.710
   95   3HD2  LEU  11          3HD2      LEU  11  -2.857  -8.949  -0.008
   96    H    GLU  12           H        GLU  12  -4.131  -9.424   2.509
   97    HA   GLU  12           HA       GLU  12  -6.407  -7.567   2.631
   98   1HB   GLU  12          2HB       GLU  12  -4.431  -8.466   4.558
   99   2HB   GLU  12          1HB       GLU  12  -4.475  -6.712   4.462
  100   1HG   GLU  12          2HG       GLU  12  -6.561  -6.573   5.329
  101   2HG   GLU  12          1HG       GLU  12  -7.072  -8.114   4.639
  102    H    ILE  13           H        ILE  13  -6.316  -5.731   1.515
  103    HA   ILE  13           HA       ILE  13  -3.675  -4.607   0.858
  104    HB   ILE  13           HB       ILE  13  -6.024  -4.592  -1.032
  105   1HG1  ILE  13          2HG1      ILE  13  -3.738  -6.111  -1.943
  106   2HG1  ILE  13          1HG1      ILE  13  -4.343  -6.761  -0.423
  107   1HG2  ILE  13          1HG2      ILE  13  -4.603  -3.608  -2.603
  108   2HG2  ILE  13          2HG2      ILE  13  -3.153  -4.027  -1.690
  109   3HG2  ILE  13          3HG2      ILE  13  -4.235  -2.764  -1.100
  110   1HD1  ILE  13          1HD1      ILE  13  -5.537  -7.940  -2.002
  111   2HD1  ILE  13          2HD1      ILE  13  -5.714  -6.544  -3.063
  112   3HD1  ILE  13          3HD1      ILE  13  -6.651  -6.643  -1.573
  113    H    CYS  14           H        CYS  14  -3.448  -2.580   1.521
  114    HA   CYS  14           HA       CYS  14  -5.870  -0.988   2.027
  115   1HB   CYS  14          2HB       CYS  14  -4.616   0.215   3.708
  116   2HB   CYS  14          1HB       CYS  14  -4.478  -1.512   4.011
  117    HG   CYS  14           HG       CYS  14  -2.049  -1.154   2.691
  118    H    CYS  15           H        CYS  15  -6.010   1.113   1.306
  119    HA   CYS  15           HA       CYS  15  -4.027   1.868  -0.730
  120   1HB   CYS  15          2HB       CYS  15  -6.815   2.990  -0.469
  121   2HB   CYS  15          1HB       CYS  15  -5.740   3.066  -1.861
  122    HG   CYS  15           HG       CYS  15  -6.530   0.216  -1.200
  123    H    TYR  16           H        TYR  16  -2.617   3.346  -0.071
  124    HA   TYR  16           HA       TYR  16  -3.387   5.234   2.027
  125   1HB   TYR  16          2HB       TYR  16  -1.178   3.781   1.912
  126   2HB   TYR  16          1HB       TYR  16  -0.618   5.118   0.914
  127    HD1  TYR  16           1HD      TYR  16  -1.028   7.513   1.953
  128    HD2  TYR  16           2HD      TYR  16  -0.865   3.903   4.199
  129    HE1  TYR  16           1HE      TYR  16  -0.493   8.803   3.978
  130    HE2  TYR  16           2HE      TYR  16  -0.330   5.182   6.229
  131    HH   TYR  16           HH       TYR  16  -0.693   8.524   6.445
  132    H    GLY  17           H        GLY  17  -4.278   7.060   1.322
  133   1HA   GLY  17          2HA       GLY  17  -4.316   9.146   0.314
  134   2HA   GLY  17          1HA       GLY  17  -2.829   8.734  -0.525
  135    HA   PRO  18           HA       PRO  18  -6.960   8.358  -3.125
  136   1HB   PRO  18          2HB       PRO  18  -6.008  10.961  -4.205
  137   2HB   PRO  18          1HB       PRO  18  -7.657  10.408  -3.887
  138   1HG   PRO  18          2HG       PRO  18  -6.476  12.169  -2.273
  139   2HG   PRO  18          1HG       PRO  18  -7.526  10.896  -1.624
  140   1HD   PRO  18          2HD       PRO  18  -4.544  11.077  -1.628
  141   2HD   PRO  18          1HD       PRO  18  -5.636  10.439  -0.382
  142    H    PHE  19           H        PHE  19  -6.823   8.893  -5.693
  143    HA   PHE  19           HA       PHE  19  -4.168   8.014  -6.606
  144   1HB   PHE  19          2HB       PHE  19  -6.864   6.969  -7.478
  145   2HB   PHE  19          1HB       PHE  19  -5.365   6.632  -8.334
  146    HD1  PHE  19           1HD      PHE  19  -6.624   6.513  -4.818
  147    HD2  PHE  19           2HD      PHE  19  -4.416   4.594  -7.911
  148    HE1  PHE  19           1HE      PHE  19  -6.214   4.597  -3.332
  149    HE2  PHE  19           2HE      PHE  19  -4.003   2.674  -6.428
  150    HZ   PHE  19           HZ       PHE  19  -4.902   2.673  -4.136
  151    H    THR  20           H        THR  20  -7.169   8.703  -8.345
  152    HA   THR  20           HA       THR  20  -5.791  10.929  -9.700
  153    HB   THR  20           HB       THR  20  -7.329  10.337 -11.664
  154    HG1  THR  20           1HG      THR  20  -7.436   7.850 -10.314
  155   1HG2  THR  20          1HG2      THR  20  -5.600   9.343 -12.625
  156   2HG2  THR  20          2HG2      THR  20  -5.666   7.978 -11.509
  157   3HG2  THR  20          3HG2      THR  20  -4.792   9.443 -11.060
  158    H    ASN  21           H        ASN  21  -8.908   9.607  -8.680
  159    HA   ASN  21           HA       ASN  21  -9.908  12.362  -8.422
  160   1HB   ASN  21          2HB       ASN  21 -11.188  10.011  -9.756
  161   2HB   ASN  21          1HB       ASN  21 -12.215  11.170  -8.917
  162   1HD2  ASN  21          1HD2      ASN  21 -11.993  10.532 -11.765
  163   2HD2  ASN  21          2HD2      ASN  21 -11.630  12.024 -12.555
  164    H    MET  22           H        MET  22 -11.279   9.169  -7.684
  165    HA   MET  22           HA       MET  22 -10.815   9.352  -4.887
  166   1HB   MET  22          2HB       MET  22 -12.745  11.037  -5.475
  167   2HB   MET  22          1HB       MET  22 -13.727   9.580  -5.541
  168   1HG   MET  22          2HG       MET  22 -12.474   9.200  -3.190
  169   2HG   MET  22          1HG       MET  22 -12.534  10.962  -3.235
  170   1HE   MET  22          1HE       MET  22 -15.388  11.765  -1.627
  171   2HE   MET  22          2HE       MET  22 -13.658  11.442  -1.500
  172   3HE   MET  22          3HE       MET  22 -14.816  10.358  -0.730
  173    HA   PRO  23           HA       PRO  23 -12.243   5.226  -6.571
  174   1HB   PRO  23          2HB       PRO  23  -9.976   4.062  -7.314
  175   2HB   PRO  23          1HB       PRO  23 -10.751   5.263  -8.358
  176   1HG   PRO  23          2HG       PRO  23  -8.394   5.565  -6.543
  177   2HG   PRO  23          1HG       PRO  23  -8.655   6.236  -8.162
  178   1HD   PRO  23          2HD       PRO  23  -9.058   7.594  -5.758
  179   2HD   PRO  23          1HD       PRO  23  -9.713   8.068  -7.336
  180    H    THR  24           H        THR  24 -11.031   6.348  -3.900
  181    HA   THR  24           HA       THR  24  -9.486   4.386  -2.678
  182    HB   THR  24           HB       THR  24 -11.529   5.748  -1.009
  183    HG1  THR  24           1HG      THR  24  -9.463   7.200  -2.294
  184   1HG2  THR  24          1HG2      THR  24  -8.813   6.385  -0.393
  185   2HG2  THR  24          2HG2      THR  24  -8.990   4.642  -0.595
  186   3HG2  THR  24          3HG2      THR  24 -10.002   5.503   0.564
  187    H    ASP  25           H        ASP  25 -13.005   4.652  -2.948
  188    HA   ASP  25           HA       ASP  25 -13.407   2.198  -1.455
  189   1HB   ASP  25          2HB       ASP  25 -14.950   4.344  -1.585
  190   2HB   ASP  25          1HB       ASP  25 -15.599   3.521  -3.002
  191    H    GLN  26           H        GLN  26 -13.110   3.260  -4.716
  192    HA   GLN  26           HA       GLN  26 -14.338   0.981  -5.931
  193   1HB   GLN  26          2HB       GLN  26 -13.656   3.463  -6.806
  194   2HB   GLN  26          1HB       GLN  26 -12.335   2.513  -7.467
  195   1HG   GLN  26          2HG       GLN  26 -14.247   0.958  -8.311
  196   2HG   GLN  26          1HG       GLN  26 -15.249   2.389  -8.066
  197   1HE2  GLN  26          1HE2      GLN  26 -12.914   0.853 -10.033
  198   2HE2  GLN  26          2HE2      GLN  26 -12.782   2.085 -11.238
  199    H    LEU  27           H        LEU  27 -11.148   1.852  -4.829
  200    HA   LEU  27           HA       LEU  27  -9.763  -0.245  -6.180
  201   1HB   LEU  27          2HB       LEU  27  -9.097   1.963  -4.493
  202   2HB   LEU  27          1HB       LEU  27  -8.369   0.520  -3.821
  203    HG   LEU  27           HG       LEU  27  -6.726   1.443  -5.222
  204   1HD1  LEU  27          1HD1      LEU  27  -7.561  -1.061  -5.620
  205   2HD1  LEU  27          2HD1      LEU  27  -6.206  -0.351  -6.497
  206   3HD1  LEU  27          3HD1      LEU  27  -7.801  -0.423  -7.246
  207   1HD2  LEU  27          1HD2      LEU  27  -7.533   1.719  -7.769
  208   2HD2  LEU  27          2HD2      LEU  27  -7.555   3.032  -6.590
  209   3HD2  LEU  27          3HD2      LEU  27  -9.029   2.127  -6.930
  210    H    GLU  28           H        GLU  28 -10.851   0.211  -2.810
  211    HA   GLU  28           HA       GLU  28 -10.026  -2.330  -1.921
  212   1HB   GLU  28          2HB       GLU  28 -11.809  -1.934  -0.114
  213   2HB   GLU  28          1HB       GLU  28 -10.461  -0.813  -0.210
  214   1HG   GLU  28          2HG       GLU  28 -11.800   0.912  -0.615
  215   2HG   GLU  28          1HG       GLU  28 -12.707   0.025  -1.837
  216    H    TRP  29           H        TRP  29 -12.822  -1.265  -3.682
  217    HA   TRP  29           HA       TRP  29 -14.454  -3.545  -3.185
  218   1HB   TRP  29          2HB       TRP  29 -15.665  -1.729  -4.015
  219   2HB   TRP  29          1HB       TRP  29 -14.437  -1.329  -5.210
  220    HD1  TRP  29           HD       TRP  29 -16.992  -4.179  -4.594
  221    HE1  TRP  29           1HE      TRP  29 -17.895  -4.946  -6.880
  222    HE3  TRP  29           3HE      TRP  29 -14.164  -1.190  -7.618
  223    HZ2  TRP  29           2HZ      TRP  29 -17.459  -4.360  -9.607
  224    HZ3  TRP  29           3HZ      TRP  29 -14.464  -1.354 -10.055
  225    HH2  TRP  29           HH       TRP  29 -16.077  -2.909 -11.027
  226    H    MET  30           H        MET  30 -12.372  -2.581  -5.871
  227    HA   MET  30           HA       MET  30 -12.620  -4.816  -7.483
  228   1HB   MET  30          2HB       MET  30 -10.346  -2.897  -7.032
  229   2HB   MET  30          1HB       MET  30 -10.209  -4.219  -8.181
  230   1HG   MET  30          2HG       MET  30 -12.407  -3.284  -9.160
  231   2HG   MET  30          1HG       MET  30 -11.985  -1.822  -8.269
  232   1HE   MET  30          1HE       MET  30  -9.659  -1.068  -8.161
  233   2HE   MET  30          2HE       MET  30  -9.376  -0.158  -9.645
  234   3HE   MET  30          3HE       MET  30  -8.356  -1.543  -9.251
  235    H    VAL  31           H        VAL  31 -10.239  -4.241  -4.879
  236    HA   VAL  31           HA       VAL  31  -8.951  -6.738  -5.106
  237    HB   VAL  31           HB       VAL  31  -8.179  -6.360  -2.779
  238   1HG1  VAL  31          1HG1      VAL  31  -6.642  -4.810  -3.402
  239   2HG1  VAL  31          2HG1      VAL  31  -7.858  -3.704  -4.043
  240   3HG1  VAL  31          3HG1      VAL  31  -7.357  -5.110  -4.987
  241   1HG2  VAL  31          1HG2      VAL  31  -8.763  -4.226  -1.680
  242   2HG2  VAL  31          2HG2      VAL  31 -10.127  -5.334  -1.822
  243   3HG2  VAL  31          3HG2      VAL  31  -9.984  -3.965  -2.923
  244    H    GLN  32           H        GLN  32 -11.635  -5.622  -3.102
  245    HA   GLN  32           HA       GLN  32 -12.090  -7.949  -1.629
  246   1HB   GLN  32          2HB       GLN  32 -13.548  -5.499  -2.263
  247   2HB   GLN  32          1HB       GLN  32 -14.616  -6.878  -2.063
  248   1HG   GLN  32          2HG       GLN  32 -13.897  -7.246   0.146
  249   2HG   GLN  32          1HG       GLN  32 -12.513  -6.170  -0.045
  250   1HE2  GLN  32          1HE2      GLN  32 -14.350  -5.964   2.040
  251   2HE2  GLN  32          2HE2      GLN  32 -15.208  -4.474   1.875
  252    H    LEU  33           H        LEU  33 -13.049  -7.019  -4.860
  253    HA   LEU  33           HA       LEU  33 -14.848  -9.166  -5.331
  254   1HB   LEU  33          2HB       LEU  33 -14.769  -7.011  -6.606
  255   2HB   LEU  33          1HB       LEU  33 -13.285  -7.568  -7.357
  256    HG   LEU  33           HG       LEU  33 -14.450  -9.383  -8.445
  257   1HD1  LEU  33          1HD1      LEU  33 -16.078 -10.086  -6.927
  258   2HD1  LEU  33          2HD1      LEU  33 -17.003  -9.385  -8.254
  259   3HD1  LEU  33          3HD1      LEU  33 -16.761  -8.468  -6.767
  260   1HD2  LEU  33          1HD2      LEU  33 -16.325  -7.840  -9.566
  261   2HD2  LEU  33          2HD2      LEU  33 -14.604  -7.670  -9.915
  262   3HD2  LEU  33          3HD2      LEU  33 -15.378  -6.594  -8.751
  263    H    CYS  34           H        CYS  34 -11.425  -8.886  -5.317
  264    HA   CYS  34           HA       CYS  34 -11.041 -11.289  -6.918
  265   1HB   CYS  34          2HB       CYS  34  -9.286  -9.110  -5.911
  266   2HB   CYS  34          1HB       CYS  34  -8.550 -10.689  -6.166
  267    HG   CYS  34           HG       CYS  34  -8.362  -9.238  -8.344
  268    H    GLY  35           H        GLY  35 -11.752 -10.655  -3.743
  269   1HA   GLY  35          2HA       GLY  35 -11.979 -12.595  -2.289
  270   2HA   GLY  35          1HA       GLY  35 -10.428 -13.152  -2.895
  271    H    ALA  36           H        ALA  36  -9.580 -10.184  -2.681
  272    HA   ALA  36           HA       ALA  36  -8.320 -10.442  -0.140
  273   1HB   ALA  36          1HB       ALA  36  -8.435  -8.188  -2.125
  274   2HB   ALA  36          2HB       ALA  36  -7.122  -9.334  -1.864
  275   3HB   ALA  36          3HB       ALA  36  -7.495  -8.125  -0.635
  276    H    SER  37           H        SER  37  -8.288  -8.326   1.250
  277    HA   SER  37           HA       SER  37 -11.057  -7.480   1.776
  278   1HB   SER  37          2HB       SER  37  -9.446  -9.112   3.440
  279   2HB   SER  37          1HB       SER  37  -9.530  -7.530   4.214
  280    HG   SER  37           HG       SER  37 -11.826  -8.864   3.238
  281    H    VAL  38           H        VAL  38 -11.293  -5.394   2.699
  282    HA   VAL  38           HA       VAL  38  -9.155  -3.583   1.952
  283    HB   VAL  38           HB       VAL  38 -11.501  -3.073   1.357
  284   1HG1  VAL  38          1HG1      VAL  38 -11.940  -2.503   4.278
  285   2HG1  VAL  38          2HG1      VAL  38 -12.466  -3.989   3.488
  286   3HG1  VAL  38          3HG1      VAL  38 -13.121  -2.434   2.969
  287   1HG2  VAL  38          1HG2      VAL  38 -10.479  -0.987   3.262
  288   2HG2  VAL  38          2HG2      VAL  38 -11.355  -0.759   1.748
  289   3HG2  VAL  38          3HG2      VAL  38  -9.687  -1.330   1.723
  290    H    VAL  39           H        VAL  39  -7.655  -2.901   3.324
  291    HA   VAL  39           HA       VAL  39  -8.068  -3.263   6.194
  292    HB   VAL  39           HB       VAL  39  -5.510  -2.185   5.134
  293   1HG1  VAL  39          1HG1      VAL  39  -4.614  -3.045   7.013
  294   2HG1  VAL  39          2HG1      VAL  39  -5.642  -4.478   6.980
  295   3HG1  VAL  39          3HG1      VAL  39  -6.284  -2.946   7.572
  296   1HG2  VAL  39          1HG2      VAL  39  -6.659  -4.778   4.333
  297   2HG2  VAL  39          2HG2      VAL  39  -4.991  -4.818   4.903
  298   3HG2  VAL  39          3HG2      VAL  39  -5.433  -3.787   3.542
  299    H    LYS  40           H        LYS  40  -8.475  -1.628   7.546
  300    HA   LYS  40           HA       LYS  40  -9.109   0.939   6.651
  301   1HB   LYS  40          2HB       LYS  40  -8.527  -0.159   9.390
  302   2HB   LYS  40          1HB       LYS  40  -8.952   1.529   9.141
  303   1HG   LYS  40          2HG       LYS  40 -11.035   0.771   9.500
  304   2HG   LYS  40          1HG       LYS  40 -10.952   0.348   7.789
  305   1HD   LYS  40          2HD       LYS  40  -9.774  -1.774   9.251
  306   2HD   LYS  40          1HD       LYS  40 -11.296  -1.366  10.044
  307   1HE   LYS  40          2HE       LYS  40 -12.056  -1.323   7.450
  308   2HE   LYS  40          1HE       LYS  40 -10.792  -2.550   7.395
  309   1HZ   LYS  40          1HZ       LYS  40 -13.217  -2.560   9.106
  310   2HZ   LYS  40          2HZ       LYS  40 -11.951  -3.670   9.262
  311   3HZ   LYS  40          3HZ       LYS  40 -12.858  -3.618   7.835
  312    H    GLU  41           H        GLU  41  -6.223  -0.210   8.351
  313    HA   GLU  41           HA       GLU  41  -4.700   1.979   7.169
  314   1HB   GLU  41          2HB       GLU  41  -5.118   1.550  10.103
  315   2HB   GLU  41          1HB       GLU  41  -3.588   2.204   9.534
  316   1HG   GLU  41          2HG       GLU  41  -5.441   3.733   8.205
  317   2HG   GLU  41          1HG       GLU  41  -6.190   3.473   9.780
  318    H    LEU  42           H        LEU  42  -2.283   1.698   8.047
  319    HA   LEU  42           HA       LEU  42  -1.384  -0.763   6.985
  320   1HB   LEU  42          2HB       LEU  42   0.215   1.134   8.698
  321   2HB   LEU  42          1HB       LEU  42   0.828  -0.007   7.517
  322    HG   LEU  42           HG       LEU  42  -0.868   2.397   6.838
  323   1HD1  LEU  42          1HD1      LEU  42   1.136   3.329   7.564
  324   2HD1  LEU  42          2HD1      LEU  42   1.370   3.156   5.825
  325   3HD1  LEU  42          3HD1      LEU  42   2.099   1.994   6.931
  326   1HD2  LEU  42          1HD2      LEU  42  -1.179   1.174   4.978
  327   2HD2  LEU  42          2HD2      LEU  42   0.191   0.116   5.316
  328   3HD2  LEU  42          3HD2      LEU  42   0.458   1.699   4.585
  329    H    SER  43           H        SER  43  -1.647   0.462  10.297
  330    HA   SER  43           HA       SER  43  -0.464  -1.813  11.521
  331   1HB   SER  43          2HB       SER  43  -0.729   0.515  12.527
  332   2HB   SER  43          1HB       SER  43  -2.407   0.078  12.847
  333    HG   SER  43           HG       SER  43  -0.420  -0.404  14.398
  334    H    SER  44           H        SER  44  -3.602  -1.181  10.260
  335    HA   SER  44           HA       SER  44  -5.106  -2.952  11.868
  336   1HB   SER  44          2HB       SER  44  -5.560  -1.895   9.076
  337   2HB   SER  44          1HB       SER  44  -6.735  -2.884   9.941
  338    HG   SER  44           HG       SER  44  -7.367  -1.063  10.766
  339    H    PHE  45           H        PHE  45  -2.766  -3.543   9.465
  340    HA   PHE  45           HA       PHE  45  -3.644  -5.819   8.178
  341   1HB   PHE  45          2HB       PHE  45  -0.915  -4.906   9.035
  342   2HB   PHE  45          1HB       PHE  45  -1.124  -6.465   8.246
  343    HD1  PHE  45           1HD      PHE  45   0.150  -3.553   7.498
  344    HD2  PHE  45           2HD      PHE  45  -3.179  -5.895   6.255
  345    HE1  PHE  45           1HE      PHE  45   0.190  -2.437   5.306
  346    HE2  PHE  45           2HE      PHE  45  -3.145  -4.784   4.059
  347    HZ   PHE  45           HZ       PHE  45  -1.460  -3.053   3.584
  348    H    THR  46           H        THR  46  -4.666  -7.433   9.191
  349    HA   THR  46           HA       THR  46  -3.188  -8.878  11.270
  350    HB   THR  46           HB       THR  46  -5.481  -9.289  12.370
  351    HG1  THR  46           1HG      THR  46  -6.056  -6.966  10.851
  352   1HG2  THR  46          1HG2      THR  46  -3.792  -6.897  12.574
  353   2HG2  THR  46          2HG2      THR  46  -4.324  -8.029  13.817
  354   3HG2  THR  46          3HG2      THR  46  -5.410  -6.755  13.261
  355    H    LEU  47           H        LEU  47  -3.798 -11.116  11.483
  356    HA   LEU  47           HA       LEU  47  -5.560 -12.254   9.487
  357   1HB   LEU  47          2HB       LEU  47  -3.810 -13.763   8.591
  358   2HB   LEU  47          1HB       LEU  47  -3.562 -12.077   8.177
  359    HG   LEU  47           HG       LEU  47  -2.168 -13.100  10.593
  360   1HD1  LEU  47          1HD1      LEU  47  -1.926 -14.865   8.813
  361   2HD1  LEU  47          2HD1      LEU  47  -0.421 -14.145   9.385
  362   3HD1  LEU  47          3HD1      LEU  47  -1.102 -13.650   7.835
  363   1HD2  LEU  47          1HD2      LEU  47  -1.955 -10.772   9.957
  364   2HD2  LEU  47          2HD2      LEU  47  -1.419 -11.237   8.343
  365   3HD2  LEU  47          3HD2      LEU  47  -0.412 -11.600   9.745
  366    H    GLY  48           H        GLY  48  -6.428 -14.156  10.135
  367   1HA   GLY  48          2HA       GLY  48  -5.390 -15.277  12.663
  368   2HA   GLY  48          1HA       GLY  48  -7.086 -15.284  12.203
  369    H    THR  49           H        THR  49  -6.405 -16.013   9.409
  370    HA   THR  49           HA       THR  49  -5.769 -18.850   9.887
  371    HB   THR  49           HB       THR  49  -7.417 -17.793   7.593
  372    HG1  THR  49           1HG      THR  49  -9.228 -18.416   8.854
  373   1HG2  THR  49          1HG2      THR  49  -7.086 -20.516   8.811
  374   2HG2  THR  49          2HG2      THR  49  -6.702 -20.006   7.167
  375   3HG2  THR  49          3HG2      THR  49  -8.383 -20.098   7.693
  376    H    GLY  50           H        GLY  50  -5.777 -16.488   7.205
  377   1HA   GLY  50          2HA       GLY  50  -3.014 -16.742   6.676
  378   2HA   GLY  50          1HA       GLY  50  -3.908 -17.814   5.610
  379    H    VAL  51           H        VAL  51  -3.340 -14.477   6.510
  380    HA   VAL  51           HA       VAL  51  -4.466 -13.657   3.913
  381    HB   VAL  51           HB       VAL  51  -4.472 -11.956   6.407
  382   1HG1  VAL  51          1HG1      VAL  51  -5.633 -10.361   5.193
  383   2HG1  VAL  51          2HG1      VAL  51  -6.131 -11.517   3.957
  384   3HG1  VAL  51          3HG1      VAL  51  -4.460 -10.957   4.018
  385   1HG2  VAL  51          1HG2      VAL  51  -6.081 -14.146   5.979
  386   2HG2  VAL  51          2HG2      VAL  51  -7.063 -12.809   5.383
  387   3HG2  VAL  51          3HG2      VAL  51  -6.451 -12.785   7.036
  388    H    HIS  52           H        HIS  52  -3.146 -12.512   2.623
  389    HA   HIS  52           HA       HIS  52  -0.478 -11.886   3.625
  390   1HB   HIS  52          2HB       HIS  52  -1.580 -11.902   0.808
  391   2HB   HIS  52          1HB       HIS  52   0.095 -11.571   1.232
  392    HD1  HIS  52           1HD      HIS  52  -2.296 -14.320   0.665
  393    HD2  HIS  52           2HD      HIS  52   1.530 -13.849   2.212
  394    HE1  HIS  52           1HE      HIS  52  -1.320 -16.635   0.758
  395    HE2  HIS  52           2HE      HIS  52   1.035 -16.310   1.591
  396    HA   PRO  53           HA       PRO  53  -1.644  -7.576   3.808
  397   1HB   PRO  53          2HB       PRO  53   0.660  -6.601   4.763
  398   2HB   PRO  53          1HB       PRO  53  -0.406  -7.594   5.764
  399   1HG   PRO  53          2HG       PRO  53   2.096  -8.365   4.318
  400   2HG   PRO  53          1HG       PRO  53   1.557  -8.820   5.943
  401   1HD   PRO  53          2HD       PRO  53   1.289 -10.416   3.717
  402   2HD   PRO  53          1HD       PRO  53   0.262 -10.534   5.159
  403    H    ILE  54           H        ILE  54  -1.683  -6.084   2.253
  404    HA   ILE  54           HA       ILE  54   0.693  -5.589   0.620
  405    HB   ILE  54           HB       ILE  54  -1.995  -5.946  -0.692
  406   1HG1  ILE  54          2HG1      ILE  54  -1.156  -8.083   0.366
  407   2HG1  ILE  54          1HG1      ILE  54  -1.393  -8.152  -1.376
  408   1HG2  ILE  54          1HG2      ILE  54  -0.798  -4.758  -2.203
  409   2HG2  ILE  54          2HG2      ILE  54  -0.212  -6.366  -2.627
  410   3HG2  ILE  54          3HG2      ILE  54   0.754  -5.322  -1.585
  411   1HD1  ILE  54          1HD1      ILE  54   0.712  -9.208  -0.367
  412   2HD1  ILE  54          2HD1      ILE  54   1.295  -7.550  -0.220
  413   3HD1  ILE  54          3HD1      ILE  54   0.881  -8.202  -1.805
  414    H    VAL  55           H        VAL  55   0.478  -3.570  -0.664
  415    HA   VAL  55           HA       VAL  55  -1.564  -1.727   0.356
  416    HB   VAL  55           HB       VAL  55   1.354  -0.966   0.210
  417   1HG1  VAL  55          1HG1      VAL  55   0.210   1.012   0.005
  418   2HG1  VAL  55          2HG1      VAL  55   0.339   0.888   1.760
  419   3HG1  VAL  55          3HG1      VAL  55  -1.165   0.442   0.952
  420   1HG2  VAL  55          1HG2      VAL  55   1.592  -2.130   2.106
  421   2HG2  VAL  55          2HG2      VAL  55  -0.148  -2.320   2.314
  422   3HG2  VAL  55          3HG2      VAL  55   0.648  -0.844   2.858
  423    H    VAL  56           H        VAL  56  -2.004   0.070  -0.995
  424    HA   VAL  56           HA       VAL  56  -0.848  -0.118  -3.700
  425    HB   VAL  56           HB       VAL  56  -3.699   0.689  -3.210
  426   1HG1  VAL  56          1HG1      VAL  56  -2.536  -0.524  -5.692
  427   2HG1  VAL  56          2HG1      VAL  56  -2.425   1.207  -5.371
  428   3HG1  VAL  56          3HG1      VAL  56  -4.004   0.435  -5.510
  429   1HG2  VAL  56          1HG2      VAL  56  -3.871  -1.824  -4.275
  430   2HG2  VAL  56          2HG2      VAL  56  -4.117  -1.417  -2.576
  431   3HG2  VAL  56          3HG2      VAL  56  -2.543  -1.991  -3.126
  432    H    VAL  57           H        VAL  57  -0.665   1.824  -4.880
  433    HA   VAL  57           HA       VAL  57  -1.281   4.322  -3.493
  434    HB   VAL  57           HB       VAL  57   1.046   5.164  -4.132
  435   1HG1  VAL  57          1HG1      VAL  57   0.474   4.922  -1.840
  436   2HG1  VAL  57          2HG1      VAL  57   2.056   4.173  -2.053
  437   3HG1  VAL  57          3HG1      VAL  57   0.613   3.166  -1.924
  438   1HG2  VAL  57          1HG2      VAL  57   1.448   2.198  -4.399
  439   2HG2  VAL  57          2HG2      VAL  57   2.777   3.308  -4.060
  440   3HG2  VAL  57          3HG2      VAL  57   1.852   3.468  -5.553
  441    H    GLN  58           H        GLN  58  -0.311   6.190  -5.044
  442    HA   GLN  58           HA       GLN  58  -0.187   5.828  -7.795
  443   1HB   GLN  58          2HB       GLN  58  -2.483   5.029  -7.670
  444   2HB   GLN  58          1HB       GLN  58  -2.971   6.484  -6.814
  445   1HG   GLN  58          2HG       GLN  58  -3.567   7.249  -8.817
  446   2HG   GLN  58          1HG       GLN  58  -1.844   7.501  -9.087
  447   1HE2  GLN  58          1HE2      GLN  58  -3.962   6.927 -11.001
  448   2HE2  GLN  58          2HE2      GLN  58  -3.490   5.480 -11.820
  449    HA   PRO  59           HA       PRO  59   0.889   9.988  -5.865
  450   1HB   PRO  59          2HB       PRO  59   3.041   9.573  -7.884
  451   2HB   PRO  59          1HB       PRO  59   3.150  10.201  -6.235
  452   1HG   PRO  59          2HG       PRO  59   3.956   7.728  -6.798
  453   2HG   PRO  59          1HG       PRO  59   3.104   8.086  -5.284
  454   1HD   PRO  59          2HD       PRO  59   2.096   6.758  -7.761
  455   2HD   PRO  59          1HD       PRO  59   1.700   6.430  -6.061
  456    H    ASP  60           H        ASP  60  -0.952  10.888  -6.891
  457    HA   ASP  60           HA       ASP  60  -0.337  12.418  -9.233
  458   1HB   ASP  60          2HB       ASP  60  -2.169  10.062  -9.399
  459   2HB   ASP  60          1HB       ASP  60  -2.554  11.502 -10.337
  460    H    ALA  61           H        ALA  61  -2.885  11.267  -7.072
  461    HA   ALA  61           HA       ALA  61  -3.953  14.014  -6.998
  462   1HB   ALA  61          1HB       ALA  61  -5.476  11.425  -6.719
  463   2HB   ALA  61          2HB       ALA  61  -5.532  12.535  -8.089
  464   3HB   ALA  61          3HB       ALA  61  -6.161  13.038  -6.520
  465    H    TRP  62           H        TRP  62  -1.879  13.253  -5.322
  466    HA   TRP  62           HA       TRP  62  -2.893  12.378  -2.785
  467   1HB   TRP  62          2HB       TRP  62  -0.413  12.407  -3.900
  468   2HB   TRP  62          1HB       TRP  62  -0.310  13.805  -2.835
  469    HD1  TRP  62           HD       TRP  62  -2.099  10.450  -2.101
  470    HE1  TRP  62           1HE      TRP  62  -1.067   9.448   0.033
  471    HE3  TRP  62           3HE      TRP  62   1.595  13.893  -1.289
  472    HZ2  TRP  62           2HZ      TRP  62   1.032  10.039   1.823
  473    HZ3  TRP  62           3HZ      TRP  62   3.069  13.600   0.658
  474    HH2  TRP  62           HH       TRP  62   2.793  11.712   2.181
  475    H    THR  63           H        THR  63  -3.141  15.276  -4.403
  476    HA   THR  63           HA       THR  63  -3.845  17.345  -3.799
  477    HB   THR  63           HB       THR  63  -4.277  16.070  -1.093
  478    HG1  THR  63           1HG      THR  63  -6.157  15.449  -1.838
  479   1HG2  THR  63          1HG2      THR  63  -6.135  18.128  -1.606
  480   2HG2  THR  63          2HG2      THR  63  -4.521  18.790  -1.863
  481   3HG2  THR  63          3HG2      THR  63  -4.928  18.032  -0.324
  482    H    GLU  64           H        GLU  64  -2.415  16.390  -0.702
  483    HA   GLU  64           HA       GLU  64  -0.721  18.757  -0.788
  484   1HB   GLU  64          2HB       GLU  64  -1.057  16.726   1.425
  485   2HB   GLU  64          1HB       GLU  64  -0.252  18.283   1.551
  486   1HG   GLU  64          2HG       GLU  64  -2.381  19.409   1.095
  487   2HG   GLU  64          1HG       GLU  64  -3.179  17.839   1.011
  488    H    ASP  65           H        ASP  65   1.413  18.739  -1.152
  489    HA   ASP  65           HA       ASP  65   2.696  16.127  -1.561
  490   1HB   ASP  65          2HB       ASP  65   2.856  18.719  -2.925
  491   2HB   ASP  65          1HB       ASP  65   4.429  17.992  -2.607
  492    H    ASN  66           H        ASN  66   3.026  15.908   0.753
  493    HA   ASN  66           HA       ASN  66   4.899  17.749   2.003
  494   1HB   ASN  66          2HB       ASN  66   3.139  15.538   2.933
  495   2HB   ASN  66          1HB       ASN  66   4.598  15.849   3.868
  496   1HD2  ASN  66          1HD2      ASN  66   1.423  16.557   3.632
  497   2HD2  ASN  66          2HD2      ASN  66   1.396  18.084   4.438
  498    H    GLY  67           H        GLY  67   4.747  14.214   1.533
  499   1HA   GLY  67          2HA       GLY  67   7.341  13.991   0.467
  500   2HA   GLY  67          1HA       GLY  67   7.419  13.700   2.197
  501    H    PHE  68           H        PHE  68   6.704  12.383  -0.850
  502    HA   PHE  68           HA       PHE  68   5.304  10.083   0.284
  503   1HB   PHE  68          2HB       PHE  68   4.725  11.364  -1.950
  504   2HB   PHE  68          1HB       PHE  68   5.956  10.301  -2.625
  505    HD1  PHE  68           1HD      PHE  68   2.913  10.160  -0.479
  506    HD2  PHE  68           2HD      PHE  68   5.316   8.244  -3.422
  507    HE1  PHE  68           1HE      PHE  68   1.253   8.353  -0.651
  508    HE2  PHE  68           2HE      PHE  68   3.660   6.433  -3.601
  509    HZ   PHE  68           HZ       PHE  68   1.627   6.486  -2.211
  510    H    HIS  69           H        HIS  69   8.402  10.894   0.163
  511    HA   HIS  69           HA       HIS  69   9.455   8.433  -0.968
  512   1HB   HIS  69          2HB       HIS  69  10.448  11.032  -0.690
  513   2HB   HIS  69          1HB       HIS  69  11.403  10.068   0.430
  514    HD1  HIS  69           1HD      HIS  69  13.556   9.846  -0.818
  515    HD2  HIS  69           2HD      HIS  69  10.261   8.900  -3.166
  516    HE1  HIS  69           1HE      HIS  69  14.499   8.937  -2.964
  517    HE2  HIS  69           2HE      HIS  69  12.488   8.468  -4.408
  518    H    ALA  70           H        ALA  70   7.858   7.716   1.049
  519    HA   ALA  70           HA       ALA  70   9.590   6.310   2.790
  520   1HB   ALA  70          1HB       ALA  70   9.291   8.833   3.674
  521   2HB   ALA  70          2HB       ALA  70   9.543   7.448   4.737
  522   3HB   ALA  70          3HB       ALA  70   7.914   8.065   4.463
  523    H    ILE  71           H        ILE  71   7.385   5.783   1.015
  524    HA   ILE  71           HA       ILE  71   5.052   5.198   2.574
  525    HB   ILE  71           HB       ILE  71   5.781   4.096  -0.138
  526   1HG1  ILE  71          2HG1      ILE  71   5.853   6.561  -0.116
  527   2HG1  ILE  71          1HG1      ILE  71   4.505   5.957  -1.073
  528   1HG2  ILE  71          1HG2      ILE  71   3.026   4.562   0.952
  529   2HG2  ILE  71          2HG2      ILE  71   3.898   3.060   1.259
  530   3HG2  ILE  71          3HG2      ILE  71   3.526   3.541  -0.397
  531   1HD1  ILE  71          1HD1      ILE  71   4.178   7.944   0.579
  532   2HD1  ILE  71          2HD1      ILE  71   4.054   6.662   1.783
  533   3HD1  ILE  71          3HD1      ILE  71   2.936   6.702   0.420
  534    H    GLY  72           H        GLY  72   7.398   3.084   0.898
  535   1HA   GLY  72          2HA       GLY  72   6.502   0.712   2.154
  536   2HA   GLY  72          1HA       GLY  72   8.030   0.914   1.311
  537    H    GLN  73           H        GLN  73   8.624   3.221   3.215
  538    HA   GLN  73           HA       GLN  73   9.907   1.572   5.224
  539   1HB   GLN  73          2HB       GLN  73  11.049   3.475   4.010
  540   2HB   GLN  73          1HB       GLN  73  10.043   4.574   4.943
  541   1HG   GLN  73          2HG       GLN  73  12.178   4.419   5.992
  542   2HG   GLN  73          1HG       GLN  73  10.992   3.609   7.016
  543   1HE2  GLN  73          1HE2      GLN  73  13.478   2.999   7.558
  544   2HE2  GLN  73          2HE2      GLN  73  13.917   1.438   6.960
  545    H    MET  74           H        MET  74   7.103   3.532   4.947
  546    HA   MET  74           HA       MET  74   6.867   3.900   7.832
  547   1HB   MET  74          2HB       MET  74   6.297   5.742   6.231
  548   2HB   MET  74          1HB       MET  74   4.957   4.760   5.655
  549   1HG   MET  74          2HG       MET  74   3.878   4.858   7.777
  550   2HG   MET  74          1HG       MET  74   5.284   5.622   8.515
  551   1HE   MET  74          1HE       MET  74   1.922   6.762   6.173
  552   2HE   MET  74          2HE       MET  74   3.198   5.770   5.467
  553   3HE   MET  74          3HE       MET  74   3.076   7.480   5.049
  554    H    CYS  75           H        CYS  75   5.573   1.970   5.236
  555    HA   CYS  75           HA       CYS  75   3.651   0.744   7.095
  556   1HB   CYS  75          2HB       CYS  75   2.464  -0.080   5.146
  557   2HB   CYS  75          1HB       CYS  75   2.710   1.656   4.991
  558    HG   CYS  75           HG       CYS  75   3.298   0.035   2.807
  559    H    GLU  76           H        GLU  76   3.504  -1.534   7.230
  560    HA   GLU  76           HA       GLU  76   6.055  -2.869   6.703
  561   1HB   GLU  76          2HB       GLU  76   4.982  -2.858   9.004
  562   2HB   GLU  76          1HB       GLU  76   3.749  -3.921   8.339
  563   1HG   GLU  76          2HG       GLU  76   6.087  -5.154   7.597
  564   2HG   GLU  76          1HG       GLU  76   6.463  -4.510   9.194
  565    H    ALA  77           H        ALA  77   4.108  -2.366   4.580
  566    HA   ALA  77           HA       ALA  77   3.793  -5.137   3.684
  567   1HB   ALA  77          1HB       ALA  77   1.627  -3.162   4.082
  568   2HB   ALA  77          2HB       ALA  77   1.593  -4.922   4.184
  569   3HB   ALA  77          3HB       ALA  77   1.561  -4.130   2.609
  570    HA   PRO  78           HA       PRO  78   5.336  -3.586  -0.149
  571   1HB   PRO  78          2HB       PRO  78   4.201  -5.226  -1.953
  572   2HB   PRO  78          1HB       PRO  78   5.406  -5.806  -0.795
  573   1HG   PRO  78          2HG       PRO  78   2.418  -6.013  -0.679
  574   2HG   PRO  78          1HG       PRO  78   3.634  -7.257  -0.338
  575   1HD   PRO  78          2HD       PRO  78   2.395  -5.832   1.615
  576   2HD   PRO  78          1HD       PRO  78   4.053  -6.445   1.776
  577    H    VAL  79           H        VAL  79   4.809  -1.736  -1.111
  578    HA   VAL  79           HA       VAL  79   2.012  -1.088  -1.613
  579    HB   VAL  79           HB       VAL  79   4.368   0.708  -2.155
  580   1HG1  VAL  79          1HG1      VAL  79   1.740   1.670  -1.183
  581   2HG1  VAL  79          2HG1      VAL  79   1.826   1.068  -2.839
  582   3HG1  VAL  79          3HG1      VAL  79   2.865   2.399  -2.329
  583   1HG2  VAL  79          1HG2      VAL  79   2.852   0.639   0.441
  584   2HG2  VAL  79          2HG2      VAL  79   4.323   1.531   0.056
  585   3HG2  VAL  79          3HG2      VAL  79   4.370  -0.226   0.204
  586    H    VAL  80           H        VAL  80   1.127  -0.757  -3.637
  587    HA   VAL  80           HA       VAL  80   2.846  -0.832  -5.981
  588    HB   VAL  80           HB       VAL  80   1.430  -2.661  -7.018
  589   1HG1  VAL  80          1HG1      VAL  80   3.254  -3.339  -4.716
  590   2HG1  VAL  80          2HG1      VAL  80   3.720  -3.073  -6.397
  591   3HG1  VAL  80          3HG1      VAL  80   2.741  -4.473  -5.963
  592   1HG2  VAL  80          1HG2      VAL  80   0.820  -3.406  -4.168
  593   2HG2  VAL  80          2HG2      VAL  80   0.197  -4.136  -5.648
  594   3HG2  VAL  80          3HG2      VAL  80  -0.313  -2.513  -5.183
  595    H    THR  81           H        THR  81   2.030   0.352  -7.615
  596    HA   THR  81           HA       THR  81  -0.077   2.081  -7.341
  597    HB   THR  81           HB       THR  81   0.079   2.528  -9.667
  598    HG1  THR  81           1HG      THR  81   0.821   1.053 -11.139
  599   1HG2  THR  81          1HG2      THR  81   2.285   2.637  -8.214
  600   2HG2  THR  81          2HG2      THR  81   2.273   3.010  -9.938
  601   3HG2  THR  81          3HG2      THR  81   2.807   1.423  -9.382
  602    H    ARG  82           H        ARG  82  -2.186   2.164  -8.422
  603    HA   ARG  82           HA       ARG  82  -3.818   0.018  -7.763
  604   1HB   ARG  82          2HB       ARG  82  -5.439   1.147  -9.477
  605   2HB   ARG  82          1HB       ARG  82  -5.011   1.973  -7.987
  606   1HG   ARG  82          2HG       ARG  82  -3.507   3.415  -9.115
  607   2HG   ARG  82          1HG       ARG  82  -3.585   2.451 -10.588
  608   1HD   ARG  82          2HD       ARG  82  -6.230   3.143 -10.020
  609   2HD   ARG  82          1HD       ARG  82  -5.292   4.602  -9.705
  610    HE   ARG  82           HE       ARG  82  -4.485   3.499 -12.160
  611   1HH1  ARG  82          1HH1      ARG  82  -7.219   5.119 -10.718
  612   2HH1  ARG  82          2HH1      ARG  82  -7.746   5.825 -12.210
  613   1HH2  ARG  82          1HH2      ARG  82  -5.176   4.427 -14.121
  614   2HH2  ARG  82          2HH2      ARG  82  -6.587   5.432 -14.142
  615    H    GLU  83           H        GLU  83  -1.843   0.454 -10.548
  616    HA   GLU  83           HA       GLU  83  -3.099  -0.947 -12.538
  617   1HB   GLU  83          2HB       GLU  83  -0.574   0.031 -12.168
  618   2HB   GLU  83          1HB       GLU  83  -0.274  -1.702 -12.185
  619   1HG   GLU  83          2HG       GLU  83  -0.943  -1.937 -14.368
  620   2HG   GLU  83          1HG       GLU  83  -1.964  -0.500 -14.322
  621    H    TRP  84           H        TRP  84  -1.373  -2.256  -9.748
  622    HA   TRP  84           HA       TRP  84  -1.422  -4.968 -10.417
  623   1HB   TRP  84          2HB       TRP  84  -0.171  -4.043  -8.502
  624   2HB   TRP  84          1HB       TRP  84  -1.682  -3.702  -7.680
  625    HD1  TRP  84           HD       TRP  84   0.315  -6.768  -8.957
  626    HE1  TRP  84           1HE      TRP  84  -0.242  -8.763  -7.427
  627    HE3  TRP  84           3HE      TRP  84  -3.227  -4.564  -6.003
  628    HZ2  TRP  84           2HZ      TRP  84  -1.959  -9.326  -5.254
  629    HZ3  TRP  84           3HZ      TRP  84  -4.277  -5.899  -4.223
  630    HH2  TRP  84           HH       TRP  84  -3.659  -8.228  -3.857
  631    H    VAL  85           H        VAL  85  -3.637  -3.159  -8.354
  632    HA   VAL  85           HA       VAL  85  -5.543  -5.115  -7.910
  633    HB   VAL  85           HB       VAL  85  -6.047  -2.151  -8.199
  634   1HG1  VAL  85          1HG1      VAL  85  -7.629  -3.634  -6.253
  635   2HG1  VAL  85          2HG1      VAL  85  -7.907  -4.157  -7.915
  636   3HG1  VAL  85          3HG1      VAL  85  -8.135  -2.464  -7.472
  637   1HG2  VAL  85          1HG2      VAL  85  -5.813  -2.204  -5.684
  638   2HG2  VAL  85          2HG2      VAL  85  -4.323  -2.417  -6.602
  639   3HG2  VAL  85          3HG2      VAL  85  -5.116  -3.813  -5.871
  640    H    LEU  86           H        LEU  86  -5.355  -2.777 -10.562
  641    HA   LEU  86           HA       LEU  86  -7.789  -3.576 -11.791
  642   1HB   LEU  86          2HB       LEU  86  -5.856  -1.573 -12.179
  643   2HB   LEU  86          1HB       LEU  86  -5.894  -2.488 -13.674
  644    HG   LEU  86           HG       LEU  86  -8.578  -2.088 -13.083
  645   1HD1  LEU  86          1HD1      LEU  86  -7.508   0.647 -12.933
  646   2HD1  LEU  86          2HD1      LEU  86  -7.353  -0.313 -11.462
  647   3HD1  LEU  86          3HD1      LEU  86  -8.941  -0.058 -12.186
  648   1HD2  LEU  86          1HD2      LEU  86  -8.627  -0.997 -15.107
  649   2HD2  LEU  86          2HD2      LEU  86  -7.118  -1.899 -15.240
  650   3HD2  LEU  86          3HD2      LEU  86  -7.088  -0.184 -14.830
  651    H    ASP  87           H        ASP  87  -4.387  -4.233 -12.618
  652    HA   ASP  87           HA       ASP  87  -4.861  -5.945 -14.767
  653   1HB   ASP  87          2HB       ASP  87  -2.651  -4.985 -14.222
  654   2HB   ASP  87          1HB       ASP  87  -2.555  -6.033 -12.809
  655    H    SER  88           H        SER  88  -4.977  -6.524 -11.330
  656    HA   SER  88           HA       SER  88  -4.964  -9.385 -11.545
  657   1HB   SER  88          2HB       SER  88  -5.759  -7.584  -9.246
  658   2HB   SER  88          1HB       SER  88  -5.577  -9.337  -9.144
  659    HG   SER  88           HG       SER  88  -3.519  -7.547  -9.930
  660    H    VAL  89           H        VAL  89  -7.476  -6.947 -10.882
  661    HA   VAL  89           HA       VAL  89  -9.595  -8.845 -10.799
  662    HB   VAL  89           HB       VAL  89  -9.822  -5.883 -11.331
  663   1HG1  VAL  89          1HG1      VAL  89 -11.752  -7.905 -11.312
  664   2HG1  VAL  89          2HG1      VAL  89 -12.026  -6.163 -11.274
  665   3HG1  VAL  89          3HG1      VAL  89 -11.928  -7.072  -9.767
  666   1HG2  VAL  89          1HG2      VAL  89  -9.206  -5.468  -9.240
  667   2HG2  VAL  89          2HG2      VAL  89  -8.783  -7.169  -9.048
  668   3HG2  VAL  89          3HG2      VAL  89 -10.401  -6.609  -8.624
  669    H    ALA  90           H        ALA  90  -8.053  -7.037 -13.346
  670    HA   ALA  90           HA       ALA  90 -10.117  -7.283 -15.278
  671   1HB   ALA  90          1HB       ALA  90  -8.667  -5.636 -15.890
  672   2HB   ALA  90          2HB       ALA  90  -8.005  -6.964 -16.844
  673   3HB   ALA  90          3HB       ALA  90  -7.250  -6.514 -15.315
  674    H    LEU  91           H        LEU  91  -7.015  -9.023 -14.964
  675    HA   LEU  91           HA       LEU  91  -7.971 -11.074 -16.791
  676   1HB   LEU  91          2HB       LEU  91  -5.707 -10.263 -17.079
  677   2HB   LEU  91          1HB       LEU  91  -5.314 -10.675 -15.421
  678    HG   LEU  91           HG       LEU  91  -5.636 -13.069 -15.962
  679   1HD1  LEU  91          1HD1      LEU  91  -5.638 -13.621 -18.441
  680   2HD1  LEU  91          2HD1      LEU  91  -6.164 -11.958 -18.701
  681   3HD1  LEU  91          3HD1      LEU  91  -7.160 -13.059 -17.751
  682   1HD2  LEU  91          1HD2      LEU  91  -3.412 -12.655 -16.060
  683   2HD2  LEU  91          2HD2      LEU  91  -3.594 -11.343 -17.224
  684   3HD2  LEU  91          3HD2      LEU  91  -3.669 -13.020 -17.767
  685    H    TYR  92           H        TYR  92  -7.986 -10.529 -13.460
  686    HA   TYR  92           HA       TYR  92  -8.540 -11.812 -11.668
  687   1HB   TYR  92          2HB       TYR  92  -9.819 -13.067 -13.928
  688   2HB   TYR  92          1HB       TYR  92  -9.335 -14.287 -12.756
  689    HD1  TYR  92           1HD      TYR  92  -9.680 -12.621 -10.243
  690    HD2  TYR  92           2HD      TYR  92 -12.159 -13.130 -13.667
  691    HE1  TYR  92           1HE      TYR  92 -11.659 -12.096  -8.883
  692    HE2  TYR  92           2HE      TYR  92 -14.143 -12.605 -12.314
  693    HH   TYR  92           HH       TYR  92 -14.175 -12.627  -9.010
  694    H    GLN  93           H        GLN  93  -6.215 -11.839 -11.267
  695    HA   GLN  93           HA       GLN  93  -5.276 -14.381 -10.581
  696   1HB   GLN  93          2HB       GLN  93  -4.940 -13.980 -13.276
  697   2HB   GLN  93          1HB       GLN  93  -3.389 -13.459 -12.633
  698   1HG   GLN  93          2HG       GLN  93  -3.085 -15.713 -13.095
  699   2HG   GLN  93          1HG       GLN  93  -3.376 -15.669 -11.357
  700   1HE2  GLN  93          1HE2      GLN  93  -5.315 -16.461 -10.541
  701   2HE2  GLN  93          2HE2      GLN  93  -6.361 -17.472 -11.473
  702    H    CYS  94           H        CYS  94  -3.789 -14.157  -9.022
  703    HA   CYS  94           HA       CYS  94  -3.059 -11.625  -8.065
  704   1HB   CYS  94          2HB       CYS  94  -3.168 -13.686  -6.681
  705   2HB   CYS  94          1HB       CYS  94  -1.711 -14.269  -7.478
  706    HG   CYS  94           HG       CYS  94  -0.594 -13.165  -5.588
  707    H    GLN  95           H        GLN  95  -2.126 -10.493  -9.818
  708    HA   GLN  95           HA       GLN  95   0.184 -11.409 -11.193
  709   1HB   GLN  95          2HB       GLN  95  -0.695  -8.539 -10.858
  710   2HB   GLN  95          1HB       GLN  95   0.291  -9.210 -12.150
  711   1HG   GLN  95          2HG       GLN  95  -2.612  -9.810 -11.637
  712   2HG   GLN  95          1HG       GLN  95  -1.967  -8.779 -12.913
  713   1HE2  GLN  95          1HE2      GLN  95  -1.486  -9.676 -14.802
  714   2HE2  GLN  95          2HE2      GLN  95  -1.420 -11.373 -15.120
  715    H    GLU  96           H        GLU  96   2.277 -10.159 -11.160
  716    HA   GLU  96           HA       GLU  96   3.409 -10.307  -8.568
  717   1HB   GLU  96          2HB       GLU  96   4.693  -8.866 -10.875
  718   2HB   GLU  96          1HB       GLU  96   5.465  -9.766  -9.577
  719   1HG   GLU  96          2HG       GLU  96   3.969 -11.705 -10.741
  720   2HG   GLU  96          1HG       GLU  96   4.373 -10.695 -12.129
  721    H    LEU  97           H        LEU  97   4.474  -8.586  -7.398
  722    HA   LEU  97           HA       LEU  97   2.953  -6.083  -7.570
  723   1HB   LEU  97          2HB       LEU  97   4.312  -7.547  -5.354
  724   2HB   LEU  97          1HB       LEU  97   4.148  -5.804  -5.232
  725    HG   LEU  97           HG       LEU  97   1.607  -6.568  -5.919
  726   1HD1  LEU  97          1HD1      LEU  97   2.051  -8.914  -5.703
  727   2HD1  LEU  97          2HD1      LEU  97   1.052  -8.402  -4.342
  728   3HD1  LEU  97          3HD1      LEU  97   2.778  -8.674  -4.114
  729   1HD2  LEU  97          1HD2      LEU  97   2.196  -6.549  -3.032
  730   2HD2  LEU  97          2HD2      LEU  97   1.056  -5.581  -3.968
  731   3HD2  LEU  97          3HD2      LEU  97   2.768  -5.154  -3.947
  732    H    ASP  98           H        ASP  98   6.092  -7.401  -8.012
  733    HA   ASP  98           HA       ASP  98   7.625  -5.059  -7.571
  734   1HB   ASP  98          2HB       ASP  98   8.068  -7.738  -8.698
  735   2HB   ASP  98          1HB       ASP  98   9.085  -6.483  -9.400
  736    H    THR  99           H        THR  99   5.676  -6.164 -10.213
  737    HA   THR  99           HA       THR  99   6.863  -4.507 -12.217
  738    HB   THR  99           HB       THR  99   4.068  -5.630 -12.288
  739    HG1  THR  99           1HG      THR  99   4.905  -7.558 -12.909
  740   1HG2  THR  99          1HG2      THR  99   5.274  -4.131 -14.144
  741   2HG2  THR  99          2HG2      THR  99   4.124  -5.412 -14.523
  742   3HG2  THR  99          3HG2      THR  99   5.856  -5.725 -14.624
  743    H    TYR 100           H        TYR 100   4.743  -3.878  -9.628
  744    HA   TYR 100           HA       TYR 100   4.212  -1.213 -10.725
  745   1HB   TYR 100          2HB       TYR 100   2.065  -2.727  -9.250
  746   2HB   TYR 100          1HB       TYR 100   1.908  -1.246 -10.188
  747    HD1  TYR 100           1HD      TYR 100   2.395  -1.443 -12.734
  748    HD2  TYR 100           2HD      TYR 100   1.544  -4.770 -10.223
  749    HE1  TYR 100           1HE      TYR 100   1.752  -2.760 -14.708
  750    HE2  TYR 100           2HE      TYR 100   0.899  -6.097 -12.189
  751    HH   TYR 100           HH       TYR 100   0.328  -4.734 -15.220
  752    H    LEU 101           H        LEU 101   5.883  -2.621  -8.533
  753    HA   LEU 101           HA       LEU 101   4.884  -1.529  -6.080
  754   1HB   LEU 101          2HB       LEU 101   6.866  -3.385  -6.858
  755   2HB   LEU 101          1HB       LEU 101   7.689  -2.119  -5.969
  756    HG   LEU 101           HG       LEU 101   5.219  -3.243  -4.761
  757   1HD1  LEU 101          1HD1      LEU 101   6.642  -5.156  -5.690
  758   2HD1  LEU 101          2HD1      LEU 101   6.203  -5.209  -3.983
  759   3HD1  LEU 101          3HD1      LEU 101   7.821  -4.697  -4.461
  760   1HD2  LEU 101          1HD2      LEU 101   7.892  -2.342  -3.699
  761   2HD2  LEU 101          2HD2      LEU 101   6.563  -2.944  -2.707
  762   3HD2  LEU 101          3HD2      LEU 101   6.369  -1.454  -3.630
  763    H    ILE 102           H        ILE 102   4.703   0.657  -6.124
  764    HA   ILE 102           HA       ILE 102   5.337   2.836  -5.973
  765    HB   ILE 102           HB       ILE 102   8.179   1.832  -5.839
  766   1HG1  ILE 102          2HG1      ILE 102   6.380   2.361  -3.478
  767   2HG1  ILE 102          1HG1      ILE 102   6.525   0.761  -4.199
  768   1HG2  ILE 102          1HG2      ILE 102   6.817   4.390  -5.059
  769   2HG2  ILE 102          2HG2      ILE 102   8.214   4.158  -6.110
  770   3HG2  ILE 102          3HG2      ILE 102   8.368   3.913  -4.370
  771   1HD1  ILE 102          1HD1      ILE 102   8.472   0.380  -3.196
  772   2HD1  ILE 102          2HD1      ILE 102   8.084   1.776  -2.188
  773   3HD1  ILE 102          3HD1      ILE 102   9.100   1.975  -3.616
  774    HA   PRO 103           HA       PRO 103   6.232   3.653 -10.275
  775   1HB   PRO 103          2HB       PRO 103   5.763   6.310 -10.254
  776   2HB   PRO 103          1HB       PRO 103   4.456   5.122 -10.174
  777   1HG   PRO 103          2HG       PRO 103   5.730   6.687  -7.962
  778   2HG   PRO 103          1HG       PRO 103   4.012   6.351  -8.249
  779   1HD   PRO 103          2HD       PRO 103   5.518   4.963  -6.457
  780   2HD   PRO 103          1HD       PRO 103   4.141   4.251  -7.323
  781    H    GLN 104           H        GLN 104   7.501   5.519 -11.454
  782    HA   GLN 104           HA       GLN 104   9.601   6.850 -10.160
  783   1HB   GLN 104          2HB       GLN 104  11.511   5.445 -10.878
  784   2HB   GLN 104          1HB       GLN 104  10.502   4.659  -9.673
  785   1HG   GLN 104          2HG       GLN 104   9.688   3.112 -11.161
  786   2HG   GLN 104          1HG       GLN 104   9.998   4.137 -12.561
  787   1HE2  GLN 104          1HE2      GLN 104  12.552   4.770 -12.450
  788   2HE2  GLN 104          2HE2      GLN 104  13.565   3.371 -12.464
  789    H    ILE 105           H        ILE 105  11.002   7.956 -11.625
  790    HA   ILE 105           HA       ILE 105   9.757   8.696 -14.046
  791    HB   ILE 105           HB       ILE 105  11.852   9.960 -14.506
  792   1HG1  ILE 105          2HG1      ILE 105  13.235   9.866 -12.119
  793   2HG1  ILE 105          1HG1      ILE 105  12.833   8.175 -12.399
  794   1HG2  ILE 105          1HG2      ILE 105  10.440  10.197 -11.876
  795   2HG2  ILE 105          2HG2      ILE 105  10.260  11.179 -13.330
  796   3HG2  ILE 105          3HG2      ILE 105  11.706  11.336 -12.333
  797   1HD1  ILE 105          1HD1      ILE 105  14.443  10.018 -14.129
  798   2HD1  ILE 105          2HD1      ILE 105  13.793   8.490 -14.724
  799   3HD1  ILE 105          3HD1      ILE 105  14.933   8.499 -13.378
  800    HA   PRO 106           HA       PRO 106  11.352   5.516 -16.714
  801   1HB   PRO 106          2HB       PRO 106  10.741   6.624 -19.099
  802   2HB   PRO 106          1HB       PRO 106   9.508   5.947 -18.028
  803   1HG   PRO 106          2HG       PRO 106  10.312   8.804 -18.424
  804   2HG   PRO 106          1HG       PRO 106   8.687   8.109 -18.283
  805   1HD   PRO 106          2HD       PRO 106   9.957   9.338 -16.216
  806   2HD   PRO 106          1HD       PRO 106   8.787   8.023 -15.987
  807    H    HIS 107           H        HIS 107  12.934   5.215 -18.448
  808    HA   HIS 107           HA       HIS 107  15.325   6.597 -17.982
  809   1HB   HIS 107          2HB       HIS 107  14.392   4.496 -19.809
  810   2HB   HIS 107          1HB       HIS 107  15.703   5.473 -20.461
  811    HD1  HIS 107           1HD      HIS 107  16.736   2.868 -20.155
  812    HD2  HIS 107           2HD      HIS 107  16.353   5.285 -16.796
  813    HE1  HIS 107           1HE      HIS 107  18.288   1.885 -18.439
  814    HE2  HIS 107           2HE      HIS 107  17.976   3.312 -16.387
  815    H    SER 108           H        SER 108  15.499   8.722 -18.362
  816    HA   SER 108           HA       SER 108  15.243   9.649 -21.102
  817   1HB   SER 108          2HB       SER 108  13.011  10.008 -19.874
  818   2HB   SER 108          1HB       SER 108  13.868  11.234 -18.940
  819    HG   SER 108           HG       SER 108  12.704  11.759 -21.076
  820    H    HIS 109           H        HIS 109  16.973  10.826 -21.574
  821    HA   HIS 109           HA       HIS 109  18.835  12.116 -21.375
  822   1HB   HIS 109          2HB       HIS 109  17.179  13.231 -19.114
  823   2HB   HIS 109          1HB       HIS 109  18.760  13.883 -19.531
  824    HD1  HIS 109           1HD      HIS 109  15.732  12.952 -21.655
  825    HD2  HIS 109           2HD      HIS 109  18.347  16.112 -20.988
  826    HE1  HIS 109           1HE      HIS 109  15.034  14.754 -23.265
  827    HE2  HIS 109           2HE      HIS 109  16.686  16.621 -22.905
  828    H    TYR 110           H        TYR 110  19.081   9.574 -20.376
  829    HA   TYR 110           HA       TYR 110  21.337   9.836 -18.679
  830   1HB   TYR 110          2HB       TYR 110  18.726   9.284 -17.427
  831   2HB   TYR 110          1HB       TYR 110  20.012   8.175 -16.966
  832    HD1  TYR 110           1HD      TYR 110  18.382  10.862 -15.788
  833    HD2  TYR 110           2HD      TYR 110  22.373   9.724 -16.723
  834    HE1  TYR 110           1HE      TYR 110  19.226  12.520 -14.179
  835    HE2  TYR 110           2HE      TYR 110  23.228  11.378 -15.117
  836    HH   TYR 110           HH       TYR 110  22.001  13.778 -14.118
  Start of MODEL    4
    1   1H    GLY   1          1HT       GLY   1 -15.467 -15.326  -8.776
    2   2H    GLY   1          2HT       GLY   1 -16.961 -15.290  -9.566
    3   3H    GLY   1          3HT       GLY   1 -16.829 -16.004  -8.038
    4   1HA   GLY   1          1HA       GLY   1 -15.973 -13.243  -8.172
    5   2HA   GLY   1          2HA       GLY   1 -17.687 -13.504  -8.460
    6    H    SER   2           H        SER   2 -18.546 -15.308  -6.813
    7    HA   SER   2           HA       SER   2 -18.583 -14.081  -4.296
    8   1HB   SER   2          2HB       SER   2 -19.623 -16.605  -5.451
    9   2HB   SER   2          1HB       SER   2 -19.454 -16.566  -3.695
   10    HG   SER   2           HG       SER   2 -20.695 -14.601  -3.750
   11    H    GLN   3           H        GLN   3 -18.250 -15.785  -2.303
   12    HA   GLN   3           HA       GLN   3 -15.381 -16.050  -2.144
   13   1HB   GLN   3          2HB       GLN   3 -17.648 -16.348  -0.205
   14   2HB   GLN   3          1HB       GLN   3 -16.054 -16.963   0.210
   15   1HG   GLN   3          2HG       GLN   3 -15.114 -14.861   0.286
   16   2HG   GLN   3          1HG       GLN   3 -16.351 -14.156  -0.755
   17   1HE2  GLN   3          1HE2      GLN   3 -15.225 -13.824   2.150
   18   2HE2  GLN   3          2HE2      GLN   3 -16.661 -13.546   3.069
   19    H    ASP   4           H        ASP   4 -15.772 -17.712  -4.033
   20    HA   ASP   4           HA       ASP   4 -16.037 -20.395  -2.847
   21   1HB   ASP   4          2HB       ASP   4 -17.407 -19.356  -4.993
   22   2HB   ASP   4          1HB       ASP   4 -16.097 -20.233  -5.777
   23    H    ARG   5           H        ARG   5 -14.069 -18.308  -4.865
   24    HA   ARG   5           HA       ARG   5 -11.827 -20.146  -4.488
   25   1HB   ARG   5          2HB       ARG   5 -13.143 -19.645  -7.000
   26   2HB   ARG   5          1HB       ARG   5 -11.480 -19.078  -7.068
   27   1HG   ARG   5          2HG       ARG   5 -11.226 -21.533  -5.875
   28   2HG   ARG   5          1HG       ARG   5 -12.536 -21.791  -7.028
   29   1HD   ARG   5          2HD       ARG   5 -11.040 -21.943  -8.660
   30   2HD   ARG   5          1HD       ARG   5 -10.552 -20.278  -8.351
   31    HE   ARG   5           HE       ARG   5  -8.617 -21.100  -7.492
   32   1HH1  ARG   5          1HH1      ARG   5 -11.063 -23.570  -7.184
   33   2HH1  ARG   5          2HH1      ARG   5  -9.974 -24.742  -6.519
   34   1HH2  ARG   5          1HH2      ARG   5  -7.183 -22.639  -6.618
   35   2HH2  ARG   5          2HH2      ARG   5  -7.772 -24.213  -6.197
   36    H    LYS   6           H        LYS   6 -12.394 -17.147  -6.304
   37    HA   LYS   6           HA       LYS   6 -11.421 -15.087  -6.201
   38   1HB   LYS   6          2HB       LYS   6 -10.476 -15.740  -3.417
   39   2HB   LYS   6          1HB       LYS   6 -10.884 -14.173  -4.093
   40   1HG   LYS   6          2HG       LYS   6 -13.077 -16.130  -4.042
   41   2HG   LYS   6          1HG       LYS   6 -12.495 -15.580  -2.469
   42   1HD   LYS   6          2HD       LYS   6 -12.640 -13.219  -3.694
   43   2HD   LYS   6          1HD       LYS   6 -13.866 -14.076  -4.629
   44   1HE   LYS   6          2HE       LYS   6 -15.322 -14.083  -2.924
   45   2HE   LYS   6          1HE       LYS   6 -14.078 -14.504  -1.746
   46   1HZ   LYS   6          1HZ       LYS   6 -13.535 -12.292  -1.410
   47   2HZ   LYS   6          2HZ       LYS   6 -15.218 -12.234  -1.562
   48   3HZ   LYS   6          3HZ       LYS   6 -14.237 -11.777  -2.861
   49    H    ILE   7           H        ILE   7  -9.620 -14.558  -7.241
   50    HA   ILE   7           HA       ILE   7  -7.417 -16.295  -7.465
   51    HB   ILE   7           HB       ILE   7  -6.269 -14.255  -8.504
   52   1HG1  ILE   7          2HG1      ILE   7  -9.038 -13.086  -8.527
   53   2HG1  ILE   7          1HG1      ILE   7  -7.914 -12.704  -7.231
   54   1HG2  ILE   7          1HG2      ILE   7  -8.877 -14.852  -9.833
   55   2HG2  ILE   7          2HG2      ILE   7  -7.682 -16.129  -9.609
   56   3HG2  ILE   7          3HG2      ILE   7  -7.270 -14.689 -10.538
   57   1HD1  ILE   7          1HD1      ILE   7  -7.443 -10.984  -8.616
   58   2HD1  ILE   7          2HD1      ILE   7  -7.888 -11.882 -10.066
   59   3HD1  ILE   7          3HD1      ILE   7  -6.329 -12.171  -9.294
   60    H    PHE   8           H        PHE   8  -8.166 -13.876  -5.139
   61    HA   PHE   8           HA       PHE   8  -5.391 -13.644  -4.255
   62   1HB   PHE   8          2HB       PHE   8  -7.942 -12.245  -3.463
   63   2HB   PHE   8          1HB       PHE   8  -6.467 -12.083  -2.526
   64    HD1  PHE   8           1HD      PHE   8  -6.086 -12.429  -6.115
   65    HD2  PHE   8           2HD      PHE   8  -6.631  -9.655  -2.933
   66    HE1  PHE   8           1HE      PHE   8  -5.355 -10.601  -7.588
   67    HE2  PHE   8           2HE      PHE   8  -5.901  -7.822  -4.401
   68    HZ   PHE   8           HZ       PHE   8  -5.262  -8.293  -6.732
   69    H    ARG   9           H        ARG   9  -8.555 -14.616  -2.960
   70    HA   ARG   9           HA       ARG   9  -9.139 -15.831  -1.116
   71   1HB   ARG   9          2HB       ARG   9  -8.452 -17.581  -2.686
   72   2HB   ARG   9          1HB       ARG   9  -6.798 -17.466  -2.105
   73   1HG   ARG   9          2HG       ARG   9  -7.921 -17.994   0.213
   74   2HG   ARG   9          1HG       ARG   9  -9.186 -18.674  -0.813
   75   1HD   ARG   9          2HD       ARG   9  -7.967 -20.522  -0.996
   76   2HD   ARG   9          1HD       ARG   9  -6.760 -19.589  -1.878
   77    HE   ARG   9           HE       ARG   9  -5.401 -19.814  -0.072
   78   1HH1  ARG   9          1HH1      ARG   9  -8.702 -20.069   1.032
   79   2HH1  ARG   9          2HH1      ARG   9  -8.259 -20.380   2.677
   80   1HH2  ARG   9          1HH2      ARG   9  -4.817 -20.224   2.091
   81   2HH2  ARG   9          2HH2      ARG   9  -6.053 -20.468   3.279
   82    H    GLY  10           H        GLY  10  -8.686 -14.400   0.553
   83   1HA   GLY  10          2HA       GLY  10  -7.800 -14.015   2.662
   84   2HA   GLY  10          1HA       GLY  10  -6.625 -15.285   2.362
   85    H    LEU  11           H        LEU  11  -7.420 -11.944   1.538
   86    HA   LEU  11           HA       LEU  11  -4.572 -11.300   1.646
   87   1HB   LEU  11          2HB       LEU  11  -6.055 -11.498  -0.765
   88   2HB   LEU  11          1HB       LEU  11  -5.730  -9.798  -0.490
   89    HG   LEU  11           HG       LEU  11  -3.407 -11.574  -0.133
   90   1HD1  LEU  11          1HD1      LEU  11  -4.638 -12.601  -2.056
   91   2HD1  LEU  11          2HD1      LEU  11  -3.028 -11.993  -2.440
   92   3HD1  LEU  11          3HD1      LEU  11  -4.454 -11.066  -2.904
   93   1HD2  LEU  11          1HD2      LEU  11  -3.398  -9.074  -0.061
   94   2HD2  LEU  11          2HD2      LEU  11  -3.782  -9.085  -1.783
   95   3HD2  LEU  11          3HD2      LEU  11  -2.265  -9.782  -1.213
   96    H    GLU  12           H        GLU  12  -4.157  -8.989   1.835
   97    HA   GLU  12           HA       GLU  12  -6.448  -7.357   2.621
   98   1HB   GLU  12          2HB       GLU  12  -4.112  -8.046   4.392
   99   2HB   GLU  12          1HB       GLU  12  -5.065  -6.592   4.645
  100   1HG   GLU  12          2HG       GLU  12  -7.090  -8.110   4.751
  101   2HG   GLU  12          1HG       GLU  12  -5.949  -9.451   4.849
  102    H    ILE  13           H        ILE  13  -6.278  -5.673   1.288
  103    HA   ILE  13           HA       ILE  13  -3.618  -4.451   0.942
  104    HB   ILE  13           HB       ILE  13  -5.821  -4.302  -1.103
  105   1HG1  ILE  13          2HG1      ILE  13  -3.626  -5.972  -1.925
  106   2HG1  ILE  13          1HG1      ILE  13  -4.314  -6.601  -0.431
  107   1HG2  ILE  13          1HG2      ILE  13  -4.036  -3.606  -2.594
  108   2HG2  ILE  13          2HG2      ILE  13  -2.853  -3.811  -1.302
  109   3HG2  ILE  13          3HG2      ILE  13  -4.093  -2.563  -1.172
  110   1HD1  ILE  13          1HD1      ILE  13  -5.670  -6.173  -3.068
  111   2HD1  ILE  13          2HD1      ILE  13  -6.567  -6.434  -1.573
  112   3HD1  ILE  13          3HD1      ILE  13  -5.462  -7.674  -2.167
  113    H    CYS  14           H        CYS  14  -3.435  -2.431   1.619
  114    HA   CYS  14           HA       CYS  14  -5.874  -0.920   2.216
  115   1HB   CYS  14          2HB       CYS  14  -4.344   0.521   3.581
  116   2HB   CYS  14          1HB       CYS  14  -4.434  -1.151   4.117
  117    HG   CYS  14           HG       CYS  14  -1.930   0.243   3.431
  118    H    CYS  15           H        CYS  15  -6.211   1.148   1.460
  119    HA   CYS  15           HA       CYS  15  -4.581   1.886  -0.865
  120   1HB   CYS  15          2HB       CYS  15  -6.515   3.309  -1.495
  121   2HB   CYS  15          1HB       CYS  15  -6.940   1.609  -1.346
  122    HG   CYS  15           HG       CYS  15  -7.909   2.343   1.099
  123    H    TYR  16           H        TYR  16  -2.939   3.143  -0.206
  124    HA   TYR  16           HA       TYR  16  -3.407   5.218   1.793
  125   1HB   TYR  16          2HB       TYR  16  -1.382   3.658   1.813
  126   2HB   TYR  16          1HB       TYR  16  -0.788   4.584   0.439
  127    HD1  TYR  16           1HD      TYR  16   0.635   6.348   0.867
  128    HD2  TYR  16           2HD      TYR  16  -2.111   5.156   3.890
  129    HE1  TYR  16           1HE      TYR  16   1.617   8.000   2.402
  130    HE2  TYR  16           2HE      TYR  16  -1.138   6.805   5.433
  131    HH   TYR  16           HH       TYR  16   1.802   8.427   4.774
  132    H    GLY  17           H        GLY  17  -3.411   7.369   1.370
  133   1HA   GLY  17          2HA       GLY  17  -3.044   9.328   0.162
  134   2HA   GLY  17          1HA       GLY  17  -2.485   8.363  -1.195
  135    HA   PRO  18           HA       PRO  18  -7.163   9.636  -1.427
  136   1HB   PRO  18          2HB       PRO  18  -6.365  12.118  -2.777
  137   2HB   PRO  18          1HB       PRO  18  -7.521  11.877  -1.466
  138   1HG   PRO  18          2HG       PRO  18  -5.136  13.079  -1.084
  139   2HG   PRO  18          1HG       PRO  18  -5.919  12.097   0.167
  140   1HD   PRO  18          2HD       PRO  18  -3.657  11.391  -1.657
  141   2HD   PRO  18          1HD       PRO  18  -3.901  10.984   0.052
  142    H    PHE  19           H        PHE  19  -4.406   9.409  -3.420
  143    HA   PHE  19           HA       PHE  19  -4.098   8.667  -5.546
  144   1HB   PHE  19          2HB       PHE  19  -7.077   8.144  -5.458
  145   2HB   PHE  19          1HB       PHE  19  -6.007   7.623  -6.753
  146    HD1  PHE  19           1HD      PHE  19  -4.775   5.637  -6.575
  147    HD2  PHE  19           2HD      PHE  19  -6.703   7.246  -3.143
  148    HE1  PHE  19           1HE      PHE  19  -4.283   3.569  -5.336
  149    HE2  PHE  19           2HE      PHE  19  -6.216   5.184  -1.896
  150    HZ   PHE  19           HZ       PHE  19  -5.003   3.339  -2.992
  151    H    THR  20           H        THR  20  -7.341  10.049  -5.883
  152    HA   THR  20           HA       THR  20  -6.303  12.413  -7.187
  153    HB   THR  20           HB       THR  20  -7.697  12.017  -9.243
  154    HG1  THR  20           1HG      THR  20  -7.895   9.454  -8.069
  155   1HG2  THR  20          1HG2      THR  20  -5.497  10.018  -8.779
  156   2HG2  THR  20          2HG2      THR  20  -5.305  11.664  -9.382
  157   3HG2  THR  20          3HG2      THR  20  -6.170  10.467 -10.346
  158    H    ASN  21           H        ASN  21  -9.425  10.741  -7.436
  159    HA   ASN  21           HA       ASN  21 -10.789  12.085  -5.423
  160   1HB   ASN  21          2HB       ASN  21 -10.169  13.849  -7.497
  161   2HB   ASN  21          1HB       ASN  21 -11.854  13.421  -7.777
  162   1HD2  ASN  21          1HD2      ASN  21 -12.789  13.094  -5.240
  163   2HD2  ASN  21          2HD2      ASN  21 -12.722  14.597  -4.391
  164    H    MET  22           H        MET  22 -10.729   9.527  -6.563
  165    HA   MET  22           HA       MET  22 -13.483   8.957  -6.760
  166   1HB   MET  22          2HB       MET  22 -12.001   9.348  -9.292
  167   2HB   MET  22          1HB       MET  22 -13.013   7.912  -9.207
  168   1HG   MET  22          2HG       MET  22 -14.753   9.716  -8.284
  169   2HG   MET  22          1HG       MET  22 -13.763  10.764  -9.298
  170   1HE   MET  22          1HE       MET  22 -15.722  10.913 -12.010
  171   2HE   MET  22          2HE       MET  22 -14.174  10.262 -12.548
  172   3HE   MET  22          3HE       MET  22 -14.238  11.356 -11.167
  173    HA   PRO  23           HA       PRO  23 -11.023   4.868  -7.613
  174   1HB   PRO  23          2HB       PRO  23  -8.300   5.120  -7.797
  175   2HB   PRO  23          1HB       PRO  23  -9.385   5.088  -9.191
  176   1HG   PRO  23          2HG       PRO  23  -8.150   7.434  -7.804
  177   2HG   PRO  23          1HG       PRO  23  -8.351   7.138  -9.541
  178   1HD   PRO  23          2HD       PRO  23  -9.989   8.782  -8.189
  179   2HD   PRO  23          1HD       PRO  23 -10.580   7.765  -9.517
  180    H    THR  24           H        THR  24 -11.694   4.755  -5.414
  181    HA   THR  24           HA       THR  24  -9.480   4.414  -3.584
  182    HB   THR  24           HB       THR  24 -11.364   5.814  -2.020
  183    HG1  THR  24           1HG      THR  24 -10.667   7.283  -4.341
  184   1HG2  THR  24          1HG2      THR  24  -9.528   6.749  -1.224
  185   2HG2  THR  24          2HG2      THR  24  -9.148   7.479  -2.784
  186   3HG2  THR  24          3HG2      THR  24  -8.617   5.835  -2.425
  187    H    ASP  25           H        ASP  25 -13.038   4.600  -3.729
  188    HA   ASP  25           HA       ASP  25 -13.286   2.372  -1.892
  189   1HB   ASP  25          2HB       ASP  25 -15.729   2.720  -2.194
  190   2HB   ASP  25          1HB       ASP  25 -14.894   4.189  -1.698
  191    H    GLN  26           H        GLN  26 -13.348   3.009  -5.280
  192    HA   GLN  26           HA       GLN  26 -14.612   0.558  -6.055
  193   1HB   GLN  26          2HB       GLN  26 -14.129   2.936  -7.298
  194   2HB   GLN  26          1HB       GLN  26 -12.873   1.929  -7.999
  195   1HG   GLN  26          2HG       GLN  26 -14.884   0.261  -8.340
  196   2HG   GLN  26          1HG       GLN  26 -15.821   1.752  -8.256
  197   1HE2  GLN  26          1HE2      GLN  26 -15.199   3.480  -9.740
  198   2HE2  GLN  26          2HE2      GLN  26 -14.591   3.058 -11.301
  199    H    LEU  27           H        LEU  27 -11.389   1.629  -5.347
  200    HA   LEU  27           HA       LEU  27 -10.029  -0.528  -6.636
  201   1HB   LEU  27          2HB       LEU  27  -9.040   1.722  -6.052
  202   2HB   LEU  27          1HB       LEU  27  -9.018   1.200  -4.379
  203    HG   LEU  27           HG       LEU  27  -6.828   0.998  -5.576
  204   1HD1  LEU  27          1HD1      LEU  27  -6.237  -0.713  -4.245
  205   2HD1  LEU  27          2HD1      LEU  27  -7.495  -1.777  -4.876
  206   3HD1  LEU  27          3HD1      LEU  27  -7.894  -0.568  -3.656
  207   1HD2  LEU  27          1HD2      LEU  27  -8.153  -1.298  -7.006
  208   2HD2  LEU  27          2HD2      LEU  27  -6.489  -0.743  -7.178
  209   3HD2  LEU  27          3HD2      LEU  27  -7.818   0.269  -7.743
  210    H    GLU  28           H        GLU  28 -10.890   0.190  -3.250
  211    HA   GLU  28           HA       GLU  28  -9.835  -2.223  -2.217
  212   1HB   GLU  28          2HB       GLU  28 -11.409  -1.713  -0.265
  213   2HB   GLU  28          1HB       GLU  28 -10.167  -0.527  -0.637
  214   1HG   GLU  28          2HG       GLU  28 -11.659   1.054  -1.158
  215   2HG   GLU  28          1HG       GLU  28 -12.704  -0.077  -2.016
  216    H    TRP  29           H        TRP  29 -12.839  -1.425  -3.763
  217    HA   TRP  29           HA       TRP  29 -14.286  -3.732  -2.897
  218   1HB   TRP  29          2HB       TRP  29 -15.721  -2.080  -3.675
  219   2HB   TRP  29          1HB       TRP  29 -14.651  -1.625  -4.994
  220    HD1  TRP  29           HD       TRP  29 -16.946  -4.601  -4.056
  221    HE1  TRP  29           1HE      TRP  29 -17.988  -5.521  -6.224
  222    HE3  TRP  29           3HE      TRP  29 -14.563  -1.597  -7.429
  223    HZ2  TRP  29           2HZ      TRP  29 -17.814  -5.035  -9.000
  224    HZ3  TRP  29           3HZ      TRP  29 -15.053  -1.889  -9.822
  225    HH2  TRP  29           HH       TRP  29 -16.644  -3.573 -10.591
  226    H    MET  30           H        MET  30 -12.556  -2.854  -5.846
  227    HA   MET  30           HA       MET  30 -12.897  -5.193  -7.294
  228   1HB   MET  30          2HB       MET  30 -10.738  -3.110  -7.240
  229   2HB   MET  30          1HB       MET  30 -10.571  -4.528  -8.263
  230   1HG   MET  30          2HG       MET  30 -12.865  -3.914  -9.191
  231   2HG   MET  30          1HG       MET  30 -12.623  -2.355  -8.407
  232   1HE   MET  30          1HE       MET  30 -10.354  -1.345  -8.433
  233   2HE   MET  30          2HE       MET  30 -10.261  -0.465  -9.958
  234   3HE   MET  30          3HE       MET  30  -9.071  -1.712  -9.586
  235    H    VAL  31           H        VAL  31 -10.286  -4.362  -4.999
  236    HA   VAL  31           HA       VAL  31  -8.886  -6.799  -5.248
  237    HB   VAL  31           HB       VAL  31  -7.901  -6.259  -3.039
  238   1HG1  VAL  31          1HG1      VAL  31  -6.559  -4.601  -3.856
  239   2HG1  VAL  31          2HG1      VAL  31  -7.914  -3.667  -4.488
  240   3HG1  VAL  31          3HG1      VAL  31  -7.352  -5.102  -5.350
  241   1HG2  VAL  31          1HG2      VAL  31  -9.855  -3.976  -3.086
  242   2HG2  VAL  31          2HG2      VAL  31  -8.502  -4.117  -1.965
  243   3HG2  VAL  31          3HG2      VAL  31  -9.809  -5.301  -1.925
  244    H    GLN  32           H        GLN  32 -11.407  -5.718  -3.040
  245    HA   GLN  32           HA       GLN  32 -11.579  -7.985  -1.416
  246   1HB   GLN  32          2HB       GLN  32 -13.181  -5.611  -1.975
  247   2HB   GLN  32          1HB       GLN  32 -14.175  -7.006  -1.590
  248   1HG   GLN  32          2HG       GLN  32 -13.246  -7.227   0.540
  249   2HG   GLN  32          1HG       GLN  32 -11.863  -6.210   0.139
  250   1HE2  GLN  32          1HE2      GLN  32 -14.000  -6.098   2.256
  251   2HE2  GLN  32          2HE2      GLN  32 -14.617  -4.487   2.157
  252    H    LEU  33           H        LEU  33 -12.965  -7.251  -4.547
  253    HA   LEU  33           HA       LEU  33 -14.742  -9.464  -4.669
  254   1HB   LEU  33          2HB       LEU  33 -14.946  -7.406  -6.038
  255   2HB   LEU  33          1HB       LEU  33 -13.514  -7.884  -6.928
  256    HG   LEU  33           HG       LEU  33 -14.670  -9.857  -7.778
  257   1HD1  LEU  33          1HD1      LEU  33 -16.703  -9.002  -5.812
  258   2HD1  LEU  33          2HD1      LEU  33 -16.237 -10.621  -6.336
  259   3HD1  LEU  33          3HD1      LEU  33 -17.298  -9.638  -7.345
  260   1HD2  LEU  33          1HD2      LEU  33 -14.943  -8.206  -9.323
  261   2HD2  LEU  33          2HD2      LEU  33 -15.758  -7.127  -8.192
  262   3HD2  LEU  33          3HD2      LEU  33 -16.634  -8.481  -8.905
  263    H    CYS  34           H        CYS  34 -11.349  -9.121  -5.174
  264    HA   CYS  34           HA       CYS  34 -11.163 -11.606  -6.692
  265   1HB   CYS  34          2HB       CYS  34  -8.908  -9.816  -5.785
  266   2HB   CYS  34          1HB       CYS  34  -8.855 -11.053  -7.033
  267    HG   CYS  34           HG       CYS  34 -10.022  -9.514  -8.645
  268    H    GLY  35           H        GLY  35 -11.360 -10.804  -3.481
  269   1HA   GLY  35          2HA       GLY  35 -11.292 -12.625  -1.882
  270   2HA   GLY  35          1HA       GLY  35  -9.888 -13.247  -2.734
  271    H    ALA  36           H        ALA  36 -10.329  -9.864  -1.979
  272    HA   ALA  36           HA       ALA  36  -8.111 -10.067  -0.051
  273   1HB   ALA  36          1HB       ALA  36  -8.226  -8.604  -2.420
  274   2HB   ALA  36          2HB       ALA  36  -7.030  -8.453  -1.134
  275   3HB   ALA  36          3HB       ALA  36  -8.455  -7.416  -1.137
  276    H    SER  37           H        SER  37  -8.066  -7.977   1.356
  277    HA   SER  37           HA       SER  37 -10.792  -7.300   2.219
  278   1HB   SER  37          2HB       SER  37  -9.081  -8.999   3.633
  279   2HB   SER  37          1HB       SER  37  -8.944  -7.446   4.458
  280    HG   SER  37           HG       SER  37 -11.376  -8.781   3.850
  281    H    VAL  38           H        VAL  38 -11.100  -5.183   2.497
  282    HA   VAL  38           HA       VAL  38  -8.988  -3.345   1.961
  283    HB   VAL  38           HB       VAL  38 -11.312  -2.882   1.305
  284   1HG1  VAL  38          1HG1      VAL  38 -13.030  -2.387   2.843
  285   2HG1  VAL  38          2HG1      VAL  38 -11.907  -2.341   4.201
  286   3HG1  VAL  38          3HG1      VAL  38 -12.286  -3.877   3.421
  287   1HG2  VAL  38          1HG2      VAL  38 -10.753  -0.704   3.229
  288   2HG2  VAL  38          2HG2      VAL  38 -11.078  -0.635   1.497
  289   3HG2  VAL  38          3HG2      VAL  38  -9.479  -1.102   2.077
  290    H    VAL  39           H        VAL  39  -7.483  -2.756   3.359
  291    HA   VAL  39           HA       VAL  39  -7.986  -3.004   6.223
  292    HB   VAL  39           HB       VAL  39  -5.349  -2.064   5.255
  293   1HG1  VAL  39          1HG1      VAL  39  -5.871  -4.354   7.094
  294   2HG1  VAL  39          2HG1      VAL  39  -6.100  -2.695   7.646
  295   3HG1  VAL  39          3HG1      VAL  39  -4.519  -3.221   7.067
  296   1HG2  VAL  39          1HG2      VAL  39  -4.835  -4.617   4.894
  297   2HG2  VAL  39          2HG2      VAL  39  -5.442  -3.619   3.573
  298   3HG2  VAL  39          3HG2      VAL  39  -6.544  -4.671   4.459
  299    H    LYS  40           H        LYS  40  -8.601  -1.316   7.386
  300    HA   LYS  40           HA       LYS  40  -8.924   1.270   6.408
  301   1HB   LYS  40          2HB       LYS  40  -8.655   0.333   9.268
  302   2HB   LYS  40          1HB       LYS  40  -9.219   1.927   8.790
  303   1HG   LYS  40          2HG       LYS  40 -11.228   0.924   9.049
  304   2HG   LYS  40          1HG       LYS  40 -10.928   0.464   7.373
  305   1HD   LYS  40          2HD       LYS  40 -10.685  -1.713   7.886
  306   2HD   LYS  40          1HD       LYS  40  -9.786  -1.365   9.364
  307   1HE   LYS  40          2HE       LYS  40 -12.059  -0.603  10.305
  308   2HE   LYS  40          1HE       LYS  40 -12.754  -1.478   8.942
  309   1HZ   LYS  40          1HZ       LYS  40 -11.089  -3.312   9.896
  310   2HZ   LYS  40          2HZ       LYS  40 -12.695  -3.172  10.405
  311   3HZ   LYS  40          3HZ       LYS  40 -11.453  -2.497  11.334
  312    H    GLU  41           H        GLU  41  -6.203  -0.220   8.037
  313    HA   GLU  41           HA       GLU  41  -4.498   1.963   7.219
  314   1HB   GLU  41          2HB       GLU  41  -5.104   1.404  10.109
  315   2HB   GLU  41          1HB       GLU  41  -3.565   2.104   9.626
  316   1HG   GLU  41          2HG       GLU  41  -5.327   3.701   8.308
  317   2HG   GLU  41          1HG       GLU  41  -6.222   3.313   9.776
  318    H    LEU  42           H        LEU  42  -2.177   1.494   8.188
  319    HA   LEU  42           HA       LEU  42  -1.414  -1.042   7.168
  320   1HB   LEU  42          2HB       LEU  42   0.275   0.786   8.866
  321   2HB   LEU  42          1HB       LEU  42   0.830  -0.413   7.713
  322    HG   LEU  42           HG       LEU  42  -0.775   1.996   6.883
  323   1HD1  LEU  42          1HD1      LEU  42   2.225   1.719   6.944
  324   2HD1  LEU  42          2HD1      LEU  42   1.268   2.743   8.014
  325   3HD1  LEU  42          3HD1      LEU  42   1.313   3.075   6.282
  326   1HD2  LEU  42          1HD2      LEU  42  -0.836   0.714   5.033
  327   2HD2  LEU  42          2HD2      LEU  42   0.545  -0.262   5.535
  328   3HD2  LEU  42          3HD2      LEU  42   0.804   1.321   4.802
  329    H    SER  43           H        SER  43  -1.760   0.268  10.427
  330    HA   SER  43           HA       SER  43  -0.697  -2.007  11.761
  331   1HB   SER  43          2HB       SER  43  -1.262   0.515  12.550
  332   2HB   SER  43          1HB       SER  43  -2.668  -0.328  13.198
  333    HG   SER  43           HG       SER  43   0.067  -0.841  13.729
  334    H    SER  44           H        SER  44  -3.721  -1.367  10.284
  335    HA   SER  44           HA       SER  44  -5.279  -3.156  11.895
  336   1HB   SER  44          2HB       SER  44  -5.727  -1.491   9.484
  337   2HB   SER  44          1HB       SER  44  -6.761  -2.910   9.657
  338    HG   SER  44           HG       SER  44  -7.288  -0.712  10.723
  339    H    PHE  45           H        PHE  45  -2.875  -3.731   9.682
  340    HA   PHE  45           HA       PHE  45  -3.849  -5.774   8.062
  341   1HB   PHE  45          2HB       PHE  45  -1.140  -5.087   9.137
  342   2HB   PHE  45          1HB       PHE  45  -1.364  -6.607   8.276
  343    HD1  PHE  45           1HD      PHE  45   0.092  -3.740   7.722
  344    HD2  PHE  45           2HD      PHE  45  -3.259  -5.863   6.181
  345    HE1  PHE  45           1HE      PHE  45   0.329  -2.552   5.581
  346    HE2  PHE  45           2HE      PHE  45  -3.027  -4.680   4.036
  347    HZ   PHE  45           HZ       PHE  45  -1.231  -3.023   3.735
  348    H    THR  46           H        THR  46  -2.692  -8.096   8.360
  349    HA   THR  46           HA       THR  46  -3.122 -10.131   9.309
  350    HB   THR  46           HB       THR  46  -1.064  -9.691  10.403
  351    HG1  THR  46           1HG      THR  46  -2.130 -11.408  11.356
  352   1HG2  THR  46          1HG2      THR  46  -1.379  -7.452  11.210
  353   2HG2  THR  46          2HG2      THR  46  -0.901  -8.497  12.547
  354   3HG2  THR  46          3HG2      THR  46  -2.585  -8.003  12.374
  355    H    LEU  47           H        LEU  47  -5.390 -10.147   9.205
  356    HA   LEU  47           HA       LEU  47  -6.664 -10.125  11.824
  357   1HB   LEU  47          2HB       LEU  47  -7.353  -8.307   9.573
  358   2HB   LEU  47          1HB       LEU  47  -8.676  -8.985  10.504
  359    HG   LEU  47           HG       LEU  47  -6.392  -7.507  11.793
  360   1HD1  LEU  47          1HD1      LEU  47  -7.750  -6.186  10.044
  361   2HD1  LEU  47          2HD1      LEU  47  -7.538  -5.494  11.652
  362   3HD1  LEU  47          3HD1      LEU  47  -9.059  -6.275  11.222
  363   1HD2  LEU  47          1HD2      LEU  47  -8.227  -9.106  12.930
  364   2HD2  LEU  47          2HD2      LEU  47  -9.110  -7.580  12.937
  365   3HD2  LEU  47          3HD2      LEU  47  -7.538  -7.692  13.729
  366    H    GLY  48           H        GLY  48  -7.022 -12.297  11.799
  367   1HA   GLY  48          2HA       GLY  48  -9.142 -13.587  11.061
  368   2HA   GLY  48          1HA       GLY  48  -8.410 -13.439   9.471
  369    H    THR  49           H        THR  49  -7.181 -15.074   8.825
  370    HA   THR  49           HA       THR  49  -5.774 -16.680  10.837
  371    HB   THR  49           HB       THR  49  -7.028 -18.090   8.524
  372    HG1  THR  49           1HG      THR  49  -8.389 -17.189  10.829
  373   1HG2  THR  49          1HG2      THR  49  -5.693 -19.499   9.832
  374   2HG2  THR  49          2HG2      THR  49  -7.352 -19.837  10.327
  375   3HG2  THR  49          3HG2      THR  49  -6.317 -18.829  11.340
  376    H    GLY  50           H        GLY  50  -6.256 -16.713   7.299
  377   1HA   GLY  50          2HA       GLY  50  -3.326 -16.471   7.014
  378   2HA   GLY  50          1HA       GLY  50  -4.251 -17.624   6.064
  379    H    VAL  51           H        VAL  51  -3.430 -14.274   6.519
  380    HA   VAL  51           HA       VAL  51  -4.507 -13.707   3.842
  381    HB   VAL  51           HB       VAL  51  -5.119 -11.421   4.609
  382   1HG1  VAL  51          1HG1      VAL  51  -6.997 -12.715   4.402
  383   2HG1  VAL  51          2HG1      VAL  51  -7.084 -12.310   6.116
  384   3HG1  VAL  51          3HG1      VAL  51  -6.462 -13.881   5.612
  385   1HG2  VAL  51          1HG2      VAL  51  -4.141 -12.526   7.183
  386   2HG2  VAL  51          2HG2      VAL  51  -5.539 -11.453   7.231
  387   3HG2  VAL  51          3HG2      VAL  51  -4.019 -10.892   6.532
  388    H    HIS  52           H        HIS  52  -3.243 -12.441   2.550
  389    HA   HIS  52           HA       HIS  52  -0.553 -11.886   3.534
  390   1HB   HIS  52          2HB       HIS  52  -1.433 -12.968   1.181
  391   2HB   HIS  52          1HB       HIS  52  -1.153 -11.293   0.714
  392    HD1  HIS  52           1HD      HIS  52   0.983 -13.145   3.210
  393    HD2  HIS  52           2HD      HIS  52   1.173 -11.740  -0.696
  394    HE1  HIS  52           1HE      HIS  52   3.382 -13.424   2.511
  395    HE2  HIS  52           2HE      HIS  52   3.454 -12.652   0.114
  396    HA   PRO  53           HA       PRO  53  -1.636  -7.563   3.812
  397   1HB   PRO  53          2HB       PRO  53   0.692  -6.640   4.751
  398   2HB   PRO  53          1HB       PRO  53  -0.362  -7.655   5.745
  399   1HG   PRO  53          2HG       PRO  53   2.100  -8.406   4.217
  400   2HG   PRO  53          1HG       PRO  53   1.600  -8.896   5.846
  401   1HD   PRO  53          2HD       PRO  53   1.256 -10.437   3.592
  402   2HD   PRO  53          1HD       PRO  53   0.265 -10.576   5.056
  403    H    ILE  54           H        ILE  54  -1.741  -6.134   2.216
  404    HA   ILE  54           HA       ILE  54   0.622  -5.660   0.532
  405    HB   ILE  54           HB       ILE  54  -2.144  -5.718  -0.645
  406   1HG1  ILE  54          2HG1      ILE  54  -1.756  -7.963   0.185
  407   2HG1  ILE  54          1HG1      ILE  54  -1.587  -7.953  -1.567
  408   1HG2  ILE  54          1HG2      ILE  54   0.596  -5.302  -1.623
  409   2HG2  ILE  54          2HG2      ILE  54  -0.935  -4.674  -2.227
  410   3HG2  ILE  54          3HG2      ILE  54  -0.431  -6.313  -2.641
  411   1HD1  ILE  54          1HD1      ILE  54   0.488  -8.710  -1.443
  412   2HD1  ILE  54          2HD1      ILE  54   0.197  -8.986   0.274
  413   3HD1  ILE  54          3HD1      ILE  54   0.942  -7.479  -0.264
  414    H    VAL  55           H        VAL  55   0.496  -3.587  -0.647
  415    HA   VAL  55           HA       VAL  55  -1.340  -1.633   0.540
  416    HB   VAL  55           HB       VAL  55   1.632  -1.146   0.310
  417   1HG1  VAL  55          1HG1      VAL  55   0.044   0.804   0.062
  418   2HG1  VAL  55          2HG1      VAL  55   1.242   0.942   1.350
  419   3HG1  VAL  55          3HG1      VAL  55  -0.426   0.520   1.738
  420   1HG2  VAL  55          1HG2      VAL  55   1.832  -2.269   2.222
  421   2HG2  VAL  55          2HG2      VAL  55   0.084  -2.411   2.405
  422   3HG2  VAL  55          3HG2      VAL  55   0.916  -0.970   2.985
  423    H    VAL  56           H        VAL  56  -1.973  -0.014  -0.826
  424    HA   VAL  56           HA       VAL  56  -0.807  -0.072  -3.531
  425    HB   VAL  56           HB       VAL  56  -3.642   0.482  -2.683
  426   1HG1  VAL  56          1HG1      VAL  56  -2.346   0.904  -5.365
  427   2HG1  VAL  56          2HG1      VAL  56  -3.179   2.098  -4.369
  428   3HG1  VAL  56          3HG1      VAL  56  -4.091   0.795  -5.131
  429   1HG2  VAL  56          1HG2      VAL  56  -3.500  -1.361  -4.801
  430   2HG2  VAL  56          2HG2      VAL  56  -3.952  -1.669  -3.125
  431   3HG2  VAL  56          3HG2      VAL  56  -2.270  -1.840  -3.629
  432    H    VAL  57           H        VAL  57  -0.830   1.992  -4.701
  433    HA   VAL  57           HA       VAL  57  -1.124   4.400  -3.099
  434    HB   VAL  57           HB       VAL  57   1.240   5.090  -4.053
  435   1HG1  VAL  57          1HG1      VAL  57   0.635   5.153  -1.712
  436   2HG1  VAL  57          2HG1      VAL  57   2.235   4.434  -1.894
  437   3HG1  VAL  57          3HG1      VAL  57   0.836   3.406  -1.585
  438   1HG2  VAL  57          1HG2      VAL  57   1.500   2.101  -3.740
  439   2HG2  VAL  57          2HG2      VAL  57   2.841   3.229  -3.938
  440   3HG2  VAL  57          3HG2      VAL  57   1.670   3.016  -5.238
  441    H    GLN  58           H        GLN  58  -0.393   6.364  -4.501
  442    HA   GLN  58           HA       GLN  58  -0.329   6.291  -7.273
  443   1HB   GLN  58          2HB       GLN  58  -2.800   5.457  -6.524
  444   2HB   GLN  58          1HB       GLN  58  -3.073   7.188  -6.640
  445   1HG   GLN  58          2HG       GLN  58  -1.736   5.705  -8.864
  446   2HG   GLN  58          1HG       GLN  58  -3.492   5.706  -8.703
  447   1HE2  GLN  58          1HE2      GLN  58  -4.351   7.091 -10.064
  448   2HE2  GLN  58          2HE2      GLN  58  -3.754   8.671 -10.429
  449    HA   PRO  59           HA       PRO  59   0.416  10.280  -4.794
  450   1HB   PRO  59          2HB       PRO  59   2.697  10.156  -6.716
  451   2HB   PRO  59          1HB       PRO  59   2.675  10.679  -5.028
  452   1HG   PRO  59          2HG       PRO  59   3.658   8.298  -5.692
  453   2HG   PRO  59          1HG       PRO  59   2.697   8.506  -4.216
  454   1HD   PRO  59          2HD       PRO  59   1.933   7.268  -6.818
  455   2HD   PRO  59          1HD       PRO  59   1.429   6.841  -5.170
  456    H    ASP  60           H        ASP  60  -0.958  11.763  -5.563
  457    HA   ASP  60           HA       ASP  60  -0.420  13.215  -7.913
  458   1HB   ASP  60          2HB       ASP  60  -2.041  10.866  -8.275
  459   2HB   ASP  60          1HB       ASP  60  -3.004  12.304  -8.605
  460    H    ALA  61           H        ALA  61  -2.897  12.216  -5.609
  461    HA   ALA  61           HA       ALA  61  -4.044  14.910  -5.653
  462   1HB   ALA  61          1HB       ALA  61  -5.882  13.607  -5.667
  463   2HB   ALA  61          2HB       ALA  61  -5.617  13.564  -3.924
  464   3HB   ALA  61          3HB       ALA  61  -5.047  12.237  -4.935
  465    H    TRP  62           H        TRP  62  -1.426  14.262  -4.428
  466    HA   TRP  62           HA       TRP  62  -1.930  14.560  -1.576
  467   1HB   TRP  62          2HB       TRP  62   0.425  13.901  -3.263
  468   2HB   TRP  62          1HB       TRP  62   0.746  14.733  -1.744
  469    HD1  TRP  62           HD       TRP  62  -1.756  11.858  -2.508
  470    HE1  TRP  62           1HE      TRP  62  -1.291   9.949  -0.847
  471    HE3  TRP  62           3HE      TRP  62   2.252  13.873  -0.057
  472    HZ2  TRP  62           2HZ      TRP  62   0.533   9.372   1.229
  473    HZ3  TRP  62           3HZ      TRP  62   3.300  12.577   1.754
  474    HH2  TRP  62           HH       TRP  62   2.457  10.375   2.384
  475    H    THR  63           H        THR  63  -0.636  16.390  -4.294
  476    HA   THR  63           HA       THR  63  -0.160  18.595  -4.580
  477    HB   THR  63           HB       THR  63  -1.745  19.443  -2.224
  478    HG1  THR  63           1HG      THR  63  -2.958  18.131  -4.424
  479   1HG2  THR  63          1HG2      THR  63  -1.952  21.266  -3.446
  480   2HG2  THR  63          2HG2      THR  63  -2.813  20.342  -4.679
  481   3HG2  THR  63          3HG2      THR  63  -1.058  20.501  -4.760
  482    H    GLU  64           H        GLU  64   0.548  20.670  -3.297
  483    HA   GLU  64           HA       GLU  64   2.127  21.670  -2.008
  484   1HB   GLU  64          2HB       GLU  64   1.397  19.400  -0.158
  485   2HB   GLU  64          1HB       GLU  64   2.519  20.678   0.286
  486   1HG   GLU  64          2HG       GLU  64   0.882  22.263   0.431
  487   2HG   GLU  64          1HG       GLU  64  -0.169  21.442  -0.723
  488    H    ASP  65           H        ASP  65   2.865  18.351  -1.000
  489    HA   ASP  65           HA       ASP  65   5.300  18.403  -2.623
  490   1HB   ASP  65          2HB       ASP  65   6.663  17.661  -0.708
  491   2HB   ASP  65          1HB       ASP  65   5.973  19.258  -0.435
  492    H    ASN  66           H        ASN  66   6.470  16.195  -2.364
  493    HA   ASN  66           HA       ASN  66   4.530  14.169  -3.022
  494   1HB   ASN  66          2HB       ASN  66   7.013  14.649  -3.939
  495   2HB   ASN  66          1HB       ASN  66   7.393  13.442  -2.714
  496   1HD2  ASN  66          1HD2      ASN  66   7.108  11.368  -3.188
  497   2HD2  ASN  66          2HD2      ASN  66   6.312  10.766  -4.599
  498    H    GLY  67           H        GLY  67   7.311  14.120  -0.781
  499   1HA   GLY  67          2HA       GLY  67   7.574  13.140   1.277
  500   2HA   GLY  67          1HA       GLY  67   5.839  13.331   1.481
  501    H    PHE  68           H        PHE  68   7.136  11.473  -1.166
  502    HA   PHE  68           HA       PHE  68   5.885   9.088  -0.044
  503   1HB   PHE  68          2HB       PHE  68   5.543   9.952  -2.462
  504   2HB   PHE  68          1HB       PHE  68   7.125   9.244  -2.778
  505    HD1  PHE  68           1HD      PHE  68   7.452   6.831  -2.663
  506    HD2  PHE  68           2HD      PHE  68   3.615   8.576  -2.073
  507    HE1  PHE  68           1HE      PHE  68   6.408   4.625  -2.965
  508    HE2  PHE  68           2HE      PHE  68   2.562   6.372  -2.375
  509    HZ   PHE  68           HZ       PHE  68   3.963   4.392  -2.810
  510    H    HIS  69           H        HIS  69   8.774  10.390   0.389
  511    HA   HIS  69           HA       HIS  69  10.418   8.068  -0.185
  512   1HB   HIS  69          2HB       HIS  69  11.126  10.679   1.169
  513   2HB   HIS  69          1HB       HIS  69  12.270   9.432   0.683
  514    HD1  HIS  69           1HD      HIS  69   9.658  11.656  -0.968
  515    HD2  HIS  69           2HD      HIS  69  13.310   9.849  -1.779
  516    HE1  HIS  69           1HE      HIS  69  10.308  12.454  -3.262
  517    HE2  HIS  69           2HE      HIS  69  12.473  11.269  -3.771
  518    H    ALA  70           H        ALA  70   8.296   7.650   1.696
  519    HA   ALA  70           HA       ALA  70   9.813   6.452   3.812
  520   1HB   ALA  70          1HB       ALA  70   8.339   7.634   5.584
  521   2HB   ALA  70          2HB       ALA  70   8.144   8.877   4.347
  522   3HB   ALA  70          3HB       ALA  70   9.753   8.472   4.944
  523    H    ILE  71           H        ILE  71   7.820   5.826   1.662
  524    HA   ILE  71           HA       ILE  71   5.436   4.993   3.041
  525    HB   ILE  71           HB       ILE  71   6.345   4.249   0.267
  526   1HG1  ILE  71          2HG1      ILE  71   6.251   6.702   0.623
  527   2HG1  ILE  71          1HG1      ILE  71   5.033   6.140  -0.510
  528   1HG2  ILE  71          1HG2      ILE  71   4.474   2.953   1.464
  529   2HG2  ILE  71          2HG2      ILE  71   4.151   3.576  -0.154
  530   3HG2  ILE  71          3HG2      ILE  71   3.521   4.422   1.260
  531   1HD1  ILE  71          1HD1      ILE  71   3.432   6.128   1.461
  532   2HD1  ILE  71          2HD1      ILE  71   3.941   7.698   0.838
  533   3HD1  ILE  71          3HD1      ILE  71   4.667   7.056   2.312
  534    H    GLY  72           H        GLY  72   8.213   3.354   1.534
  535   1HA   GLY  72          2HA       GLY  72   7.389   0.742   2.300
  536   2HA   GLY  72          1HA       GLY  72   8.996   1.202   1.759
  537    H    GLN  73           H        GLN  73   8.903   3.301   4.015
  538    HA   GLN  73           HA       GLN  73   9.937   1.489   6.064
  539   1HB   GLN  73          2HB       GLN  73  10.560   4.209   5.177
  540   2HB   GLN  73          1HB       GLN  73  10.492   4.045   6.926
  541   1HG   GLN  73          2HG       GLN  73  11.963   1.863   6.210
  542   2HG   GLN  73          1HG       GLN  73  12.468   3.059   5.017
  543   1HE2  GLN  73          1HE2      GLN  73  11.835   2.813   8.501
  544   2HE2  GLN  73          2HE2      GLN  73  13.192   3.764   8.989
  545    H    MET  74           H        MET  74   7.186   3.379   5.398
  546    HA   MET  74           HA       MET  74   6.515   3.747   8.213
  547   1HB   MET  74          2HB       MET  74   5.411   4.761   5.628
  548   2HB   MET  74          1HB       MET  74   4.361   4.721   7.038
  549   1HG   MET  74          2HG       MET  74   5.735   6.216   8.230
  550   2HG   MET  74          1HG       MET  74   7.056   6.039   7.077
  551   1HE   MET  74          1HE       MET  74   3.373   6.456   7.037
  552   2HE   MET  74          2HE       MET  74   3.321   6.753   5.299
  553   3HE   MET  74          3HE       MET  74   3.063   8.082   6.429
  554    H    CYS  75           H        CYS  75   5.708   1.732   5.490
  555    HA   CYS  75           HA       CYS  75   3.679   0.372   7.138
  556   1HB   CYS  75          2HB       CYS  75   2.584  -0.343   5.105
  557   2HB   CYS  75          1HB       CYS  75   2.793   1.404   5.055
  558    HG   CYS  75           HG       CYS  75   4.880  -0.269   3.525
  559    H    GLU  76           H        GLU  76   3.658  -1.898   7.169
  560    HA   GLU  76           HA       GLU  76   6.265  -3.090   6.577
  561   1HB   GLU  76          2HB       GLU  76   4.631  -3.244   8.801
  562   2HB   GLU  76          1HB       GLU  76   4.335  -4.774   7.989
  563   1HG   GLU  76          2HG       GLU  76   7.115  -3.792   8.515
  564   2HG   GLU  76          1HG       GLU  76   6.195  -4.674   9.734
  565    H    ALA  77           H        ALA  77   4.280  -2.570   4.493
  566    HA   ALA  77           HA       ALA  77   4.110  -5.297   3.448
  567   1HB   ALA  77          1HB       ALA  77   1.789  -4.320   2.478
  568   2HB   ALA  77          2HB       ALA  77   1.829  -3.539   4.058
  569   3HB   ALA  77          3HB       ALA  77   1.913  -5.297   3.940
  570    HA   PRO  78           HA       PRO  78   5.425  -3.533  -0.365
  571   1HB   PRO  78          2HB       PRO  78   4.004  -4.888  -2.232
  572   2HB   PRO  78          1HB       PRO  78   5.297  -5.634  -1.287
  573   1HG   PRO  78          2HG       PRO  78   2.336  -5.771  -0.879
  574   2HG   PRO  78          1HG       PRO  78   3.540  -7.070  -0.778
  575   1HD   PRO  78          2HD       PRO  78   2.535  -5.834   1.413
  576   2HD   PRO  78          1HD       PRO  78   4.190  -6.473   1.349
  577    H    VAL  79           H        VAL  79   5.028  -1.675  -1.377
  578    HA   VAL  79           HA       VAL  79   2.256  -0.725  -1.564
  579    HB   VAL  79           HB       VAL  79   4.585   1.042  -2.178
  580   1HG1  VAL  79          1HG1      VAL  79   3.057   2.650  -2.049
  581   2HG1  VAL  79          2HG1      VAL  79   2.499   2.088  -0.474
  582   3HG1  VAL  79          3HG1      VAL  79   1.838   1.380  -1.948
  583   1HG2  VAL  79          1HG2      VAL  79   5.165  -0.174  -0.076
  584   2HG2  VAL  79          2HG2      VAL  79   3.697   0.480   0.648
  585   3HG2  VAL  79          3HG2      VAL  79   4.983   1.568   0.124
  586    H    VAL  80           H        VAL  80   1.262  -0.538  -3.514
  587    HA   VAL  80           HA       VAL  80   2.924  -0.342  -5.922
  588    HB   VAL  80           HB       VAL  80   1.601  -2.080  -7.077
  589   1HG1  VAL  80          1HG1      VAL  80   2.566  -4.048  -5.773
  590   2HG1  VAL  80          2HG1      VAL  80   3.190  -2.844  -4.648
  591   3HG1  VAL  80          3HG1      VAL  80   3.697  -2.820  -6.337
  592   1HG2  VAL  80          1HG2      VAL  80   0.088  -3.499  -5.973
  593   2HG2  VAL  80          2HG2      VAL  80  -0.342  -1.872  -5.444
  594   3HG2  VAL  80          3HG2      VAL  80   0.586  -2.930  -4.380
  595    H    THR  81           H        THR  81   1.780   0.405  -7.800
  596    HA   THR  81           HA       THR  81  -0.135   2.397  -7.257
  597    HB   THR  81           HB       THR  81  -0.145   2.845  -9.565
  598    HG1  THR  81           1HG      THR  81   0.368   0.097  -9.843
  599   1HG2  THR  81          1HG2      THR  81   2.004   3.276  -9.888
  600   2HG2  THR  81          2HG2      THR  81   2.431   1.565  -9.891
  601   3HG2  THR  81          3HG2      THR  81   2.297   2.438  -8.364
  602    H    ARG  82           H        ARG  82  -2.099   2.161  -9.204
  603    HA   ARG  82           HA       ARG  82  -3.799   0.154  -7.964
  604   1HB   ARG  82          2HB       ARG  82  -4.622   2.079 -10.127
  605   2HB   ARG  82          1HB       ARG  82  -5.639   1.264  -8.947
  606   1HG   ARG  82          2HG       ARG  82  -4.185   2.618  -7.233
  607   2HG   ARG  82          1HG       ARG  82  -3.916   3.664  -8.631
  608   1HD   ARG  82          2HD       ARG  82  -6.706   2.896  -8.311
  609   2HD   ARG  82          1HD       ARG  82  -6.074   3.761  -6.914
  610    HE   ARG  82           HE       ARG  82  -5.928   5.667  -8.189
  611   1HH1  ARG  82          1HH1      ARG  82  -6.520   2.929 -10.272
  612   2HH1  ARG  82          2HH1      ARG  82  -6.831   3.903 -11.670
  613   1HH2  ARG  82          1HH2      ARG  82  -6.339   6.948 -10.025
  614   2HH2  ARG  82          2HH2      ARG  82  -6.728   6.183 -11.530
  615    H    GLU  83           H        GLU  83  -1.876   0.447 -10.753
  616    HA   GLU  83           HA       GLU  83  -3.300  -0.956 -12.678
  617   1HB   GLU  83          2HB       GLU  83  -0.405  -0.531 -12.116
  618   2HB   GLU  83          1HB       GLU  83  -0.840  -1.770 -13.284
  619   1HG   GLU  83          2HG       GLU  83  -1.864   1.045 -13.466
  620   2HG   GLU  83          1HG       GLU  83  -0.339   0.537 -14.190
  621    H    TRP  84           H        TRP  84  -1.503  -2.130  -9.905
  622    HA   TRP  84           HA       TRP  84  -1.336  -4.843 -10.549
  623   1HB   TRP  84          2HB       TRP  84  -0.203  -3.814  -8.615
  624   2HB   TRP  84          1HB       TRP  84  -1.755  -3.583  -7.831
  625    HD1  TRP  84           HD       TRP  84   0.463  -6.515  -9.072
  626    HE1  TRP  84           1HE      TRP  84   0.035  -8.531  -7.530
  627    HE3  TRP  84           3HE      TRP  84  -3.223  -4.525  -6.145
  628    HZ2  TRP  84           2HZ      TRP  84  -1.648  -9.190  -5.358
  629    HZ3  TRP  84           3HZ      TRP  84  -4.191  -5.912  -4.359
  630    HH2  TRP  84           HH       TRP  84  -3.420  -8.196  -3.974
  631    H    VAL  85           H        VAL  85  -3.733  -3.200  -8.547
  632    HA   VAL  85           HA       VAL  85  -5.486  -5.346  -8.223
  633    HB   VAL  85           HB       VAL  85  -6.238  -2.423  -8.311
  634   1HG1  VAL  85          1HG1      VAL  85  -8.261  -3.514  -8.254
  635   2HG1  VAL  85          2HG1      VAL  85  -7.909  -3.370  -6.532
  636   3HG1  VAL  85          3HG1      VAL  85  -7.615  -4.895  -7.368
  637   1HG2  VAL  85          1HG2      VAL  85  -5.926  -2.531  -5.837
  638   2HG2  VAL  85          2HG2      VAL  85  -4.432  -2.681  -6.762
  639   3HG2  VAL  85          3HG2      VAL  85  -5.177  -4.114  -6.053
  640    H    LEU  86           H        LEU  86  -5.539  -2.730 -10.616
  641    HA   LEU  86           HA       LEU  86  -7.868  -3.558 -11.954
  642   1HB   LEU  86          2HB       LEU  86  -6.179  -1.421 -12.134
  643   2HB   LEU  86          1HB       LEU  86  -5.806  -2.281 -13.615
  644    HG   LEU  86           HG       LEU  86  -8.426  -2.299 -13.896
  645   1HD1  LEU  86          1HD1      LEU  86  -7.918  -0.278 -11.785
  646   2HD1  LEU  86          2HD1      LEU  86  -9.318  -1.317 -12.047
  647   3HD1  LEU  86          3HD1      LEU  86  -9.088   0.119 -13.043
  648   1HD2  LEU  86          1HD2      LEU  86  -8.052   0.186 -14.810
  649   2HD2  LEU  86          2HD2      LEU  86  -7.401  -1.242 -15.616
  650   3HD2  LEU  86          3HD2      LEU  86  -6.370  -0.281 -14.556
  651    H    ASP  87           H        ASP  87  -4.449  -4.259 -12.568
  652    HA   ASP  87           HA       ASP  87  -4.841  -5.783 -14.902
  653   1HB   ASP  87          2HB       ASP  87  -2.650  -4.865 -14.207
  654   2HB   ASP  87          1HB       ASP  87  -2.610  -6.010 -12.869
  655    H    SER  88           H        SER  88  -4.875  -6.623 -11.486
  656    HA   SER  88           HA       SER  88  -5.027  -9.450 -11.956
  657   1HB   SER  88          2HB       SER  88  -5.673  -7.901  -9.436
  658   2HB   SER  88          1HB       SER  88  -5.387  -9.639  -9.552
  659    HG   SER  88           HG       SER  88  -3.546  -7.526  -9.937
  660    H    VAL  89           H        VAL  89  -7.343  -6.911 -11.067
  661    HA   VAL  89           HA       VAL  89  -9.575  -8.673 -10.903
  662    HB   VAL  89           HB       VAL  89  -9.619  -5.689 -11.363
  663   1HG1  VAL  89          1HG1      VAL  89 -11.692  -7.561 -11.329
  664   2HG1  VAL  89          2HG1      VAL  89 -11.835  -5.806 -11.231
  665   3HG1  VAL  89          3HG1      VAL  89 -11.752  -6.768  -9.755
  666   1HG2  VAL  89          1HG2      VAL  89 -10.143  -6.532  -8.653
  667   2HG2  VAL  89          2HG2      VAL  89  -8.987  -5.347  -9.257
  668   3HG2  VAL  89          3HG2      VAL  89  -8.543  -7.051  -9.182
  669    H    ALA  90           H        ALA  90  -8.021  -6.974 -13.508
  670    HA   ALA  90           HA       ALA  90 -10.225  -7.091 -15.325
  671   1HB   ALA  90          1HB       ALA  90  -7.296  -6.732 -15.943
  672   2HB   ALA  90          2HB       ALA  90  -8.407  -5.431 -15.515
  673   3HB   ALA  90          3HB       ALA  90  -8.654  -6.347 -17.001
  674    H    LEU  91           H        LEU  91  -7.173  -8.916 -15.087
  675    HA   LEU  91           HA       LEU  91  -8.234 -10.901 -16.951
  676   1HB   LEU  91          2HB       LEU  91  -5.951  -9.970 -17.257
  677   2HB   LEU  91          1HB       LEU  91  -5.486 -10.691 -15.728
  678    HG   LEU  91           HG       LEU  91  -6.572 -12.794 -17.236
  679   1HD1  LEU  91          1HD1      LEU  91  -4.859 -10.965 -18.893
  680   2HD1  LEU  91          2HD1      LEU  91  -6.436 -11.651 -19.288
  681   3HD1  LEU  91          3HD1      LEU  91  -5.013 -12.690 -19.229
  682   1HD2  LEU  91          1HD2      LEU  91  -3.995 -13.316 -17.400
  683   2HD2  LEU  91          2HD2      LEU  91  -4.844 -13.376 -15.856
  684   3HD2  LEU  91          3HD2      LEU  91  -3.882 -11.960 -16.279
  685    H    TYR  92           H        TYR  92  -8.328 -10.419 -13.691
  686    HA   TYR  92           HA       TYR  92  -8.714 -11.734 -11.880
  687   1HB   TYR  92          2HB       TYR  92 -10.119 -12.869 -14.042
  688   2HB   TYR  92          1HB       TYR  92  -9.382 -14.219 -13.185
  689    HD1  TYR  92           1HD      TYR  92 -12.385 -13.204 -13.488
  690    HD2  TYR  92           2HD      TYR  92  -9.468 -13.038 -10.393
  691    HE1  TYR  92           1HE      TYR  92 -14.179 -13.107 -11.809
  692    HE2  TYR  92           2HE      TYR  92 -11.254 -12.943  -8.707
  693    HH   TYR  92           HH       TYR  92 -14.436 -12.256  -9.435
  694    H    GLN  93           H        GLN  93  -6.426 -11.712 -11.426
  695    HA   GLN  93           HA       GLN  93  -5.374 -14.235 -10.850
  696   1HB   GLN  93          2HB       GLN  93  -4.977 -13.561 -13.532
  697   2HB   GLN  93          1HB       GLN  93  -3.437 -13.222 -12.757
  698   1HG   GLN  93          2HG       GLN  93  -2.996 -15.394 -12.375
  699   2HG   GLN  93          1HG       GLN  93  -4.682 -15.791 -12.047
  700   1HE2  GLN  93          1HE2      GLN  93  -2.910 -14.482 -14.832
  701   2HE2  GLN  93          2HE2      GLN  93  -3.519 -15.626 -15.974
  702    H    CYS  94           H        CYS  94  -4.082 -13.944  -9.159
  703    HA   CYS  94           HA       CYS  94  -3.408 -11.418  -8.171
  704   1HB   CYS  94          2HB       CYS  94  -3.550 -13.682  -6.941
  705   2HB   CYS  94          1HB       CYS  94  -1.881 -13.908  -7.453
  706    HG   CYS  94           HG       CYS  94  -2.240 -12.750  -5.005
  707    H    GLN  95           H        GLN  95  -2.367 -10.254  -9.825
  708    HA   GLN  95           HA       GLN  95  -0.032 -11.133 -11.150
  709   1HB   GLN  95          2HB       GLN  95  -0.837  -8.267 -10.639
  710   2HB   GLN  95          1HB       GLN  95   0.188  -8.871 -11.934
  711   1HG   GLN  95          2HG       GLN  95  -2.753  -9.403 -11.588
  712   2HG   GLN  95          1HG       GLN  95  -2.010  -8.331 -12.773
  713   1HE2  GLN  95          1HE2      GLN  95  -1.307  -9.152 -14.654
  714   2HE2  GLN  95          2HE2      GLN  95  -1.353 -10.827 -15.076
  715    H    GLU  96           H        GLU  96   2.096  -9.957 -10.975
  716    HA   GLU  96           HA       GLU  96   3.011 -10.141  -8.241
  717   1HB   GLU  96          2HB       GLU  96   5.262  -9.646  -9.305
  718   2HB   GLU  96          1HB       GLU  96   4.465 -11.125  -9.825
  719   1HG   GLU  96          2HG       GLU  96   3.900 -10.229 -11.905
  720   2HG   GLU  96          1HG       GLU  96   4.191  -8.575 -11.370
  721    H    LEU  97           H        LEU  97   3.445  -8.508  -6.899
  722    HA   LEU  97           HA       LEU  97   2.594  -5.881  -7.496
  723   1HB   LEU  97          2HB       LEU  97   4.013  -7.176  -5.209
  724   2HB   LEU  97          1HB       LEU  97   3.936  -5.426  -5.284
  725    HG   LEU  97           HG       LEU  97   1.327  -6.042  -5.684
  726   1HD1  LEU  97          1HD1      LEU  97   2.264  -8.493  -5.120
  727   2HD1  LEU  97          2HD1      LEU  97   0.637  -7.953  -4.705
  728   3HD1  LEU  97          3HD1      LEU  97   1.912  -7.921  -3.488
  729   1HD2  LEU  97          1HD2      LEU  97   2.069  -5.994  -2.848
  730   2HD2  LEU  97          2HD2      LEU  97   1.044  -4.899  -3.775
  731   3HD2  LEU  97          3HD2      LEU  97   2.797  -4.715  -3.819
  732    H    ASP  98           H        ASP  98   5.685  -7.472  -7.687
  733    HA   ASP  98           HA       ASP  98   7.404  -5.283  -7.658
  734   1HB   ASP  98          2HB       ASP  98   7.661  -8.010  -8.066
  735   2HB   ASP  98          1HB       ASP  98   8.181  -7.321  -9.602
  736    H    THR  99           H        THR  99   5.181  -6.331 -10.099
  737    HA   THR  99           HA       THR  99   6.424  -4.857 -12.236
  738    HB   THR  99           HB       THR  99   3.679  -6.111 -12.064
  739    HG1  THR  99           1HG      THR  99   6.167  -7.057 -13.015
  740   1HG2  THR  99          1HG2      THR  99   4.575  -6.112 -14.702
  741   2HG2  THR  99          2HG2      THR  99   4.864  -4.479 -14.104
  742   3HG2  THR  99          3HG2      THR  99   3.246  -5.176 -14.018
  743    H    TYR 100           H        TYR 100   4.460  -4.010  -9.616
  744    HA   TYR 100           HA       TYR 100   3.964  -1.395 -10.826
  745   1HB   TYR 100          2HB       TYR 100   1.792  -2.783  -9.262
  746   2HB   TYR 100          1HB       TYR 100   1.671  -1.318 -10.230
  747    HD1  TYR 100           1HD      TYR 100   1.351  -4.885 -10.210
  748    HD2  TYR 100           2HD      TYR 100   1.927  -1.524 -12.753
  749    HE1  TYR 100           1HE      TYR 100   0.620  -6.226 -12.137
  750    HE2  TYR 100           2HE      TYR 100   1.197  -2.855 -14.688
  751    HH   TYR 100           HH       TYR 100   0.994  -5.148 -15.374
  752    H    LEU 101           H        LEU 101   5.835  -2.428  -8.824
  753    HA   LEU 101           HA       LEU 101   4.880  -1.258  -6.328
  754   1HB   LEU 101          2HB       LEU 101   6.663  -3.338  -6.998
  755   2HB   LEU 101          1HB       LEU 101   7.630  -2.083  -6.251
  756    HG   LEU 101           HG       LEU 101   5.160  -2.708  -4.795
  757   1HD1  LEU 101          1HD1      LEU 101   7.281  -4.737  -4.428
  758   2HD1  LEU 101          2HD1      LEU 101   6.223  -4.919  -5.827
  759   3HD1  LEU 101          3HD1      LEU 101   5.537  -4.862  -4.203
  760   1HD2  LEU 101          1HD2      LEU 101   6.860  -2.798  -2.922
  761   2HD2  LEU 101          2HD2      LEU 101   6.715  -1.258  -3.772
  762   3HD2  LEU 101          3HD2      LEU 101   8.065  -2.336  -4.123
  763    H    ILE 102           H        ILE 102   5.970   0.436  -5.255
  764    HA   ILE 102           HA       ILE 102   7.624   2.115  -7.028
  765    HB   ILE 102           HB       ILE 102   5.830   3.122  -4.821
  766   1HG1  ILE 102          2HG1      ILE 102   5.326   3.047  -7.805
  767   2HG1  ILE 102          1HG1      ILE 102   4.481   2.088  -6.593
  768   1HG2  ILE 102          1HG2      ILE 102   6.686   4.845  -7.056
  769   2HG2  ILE 102          2HG2      ILE 102   7.946   4.359  -5.922
  770   3HG2  ILE 102          3HG2      ILE 102   6.515   5.210  -5.339
  771   1HD1  ILE 102          1HD1      ILE 102   4.264   4.993  -7.200
  772   2HD1  ILE 102          2HD1      ILE 102   3.891   4.411  -5.578
  773   3HD1  ILE 102          3HD1      ILE 102   2.996   3.791  -6.965
  774    HA   PRO 103           HA       PRO 103  10.331   1.247  -3.449
  775   1HB   PRO 103          2HB       PRO 103  12.636   1.145  -4.821
  776   2HB   PRO 103          1HB       PRO 103  11.506  -0.214  -4.803
  777   1HG   PRO 103          2HG       PRO 103  11.932   1.868  -6.907
  778   2HG   PRO 103          1HG       PRO 103  11.670   0.125  -7.094
  779   1HD   PRO 103          2HD       PRO 103   9.708   2.023  -7.414
  780   2HD   PRO 103          1HD       PRO 103   9.395   0.337  -6.965
  781    H    GLN 104           H        GLN 104  12.756   2.339  -3.223
  782    HA   GLN 104           HA       GLN 104  12.188   5.209  -3.252
  783   1HB   GLN 104          2HB       GLN 104  14.391   3.708  -1.824
  784   2HB   GLN 104          1HB       GLN 104  13.977   5.404  -1.610
  785   1HG   GLN 104          2HG       GLN 104  11.622   4.401  -0.997
  786   2HG   GLN 104          1HG       GLN 104  12.586   2.970  -0.635
  787   1HE2  GLN 104          1HE2      GLN 104  11.064   4.821   1.103
  788   2HE2  GLN 104          2HE2      GLN 104  12.195   5.364   2.292
  789    H    ILE 105           H        ILE 105  13.199   6.573  -4.576
  790    HA   ILE 105           HA       ILE 105  14.593   7.395  -6.178
  791    HB   ILE 105           HB       ILE 105  16.646   5.463  -5.107
  792   1HG1  ILE 105          2HG1      ILE 105  17.131   7.966  -3.992
  793   2HG1  ILE 105          1HG1      ILE 105  15.386   7.774  -3.857
  794   1HG2  ILE 105          1HG2      ILE 105  16.681   7.735  -6.975
  795   2HG2  ILE 105          2HG2      ILE 105  17.750   6.337  -6.863
  796   3HG2  ILE 105          3HG2      ILE 105  17.980   7.711  -5.783
  797   1HD1  ILE 105          1HD1      ILE 105  15.625   6.401  -2.143
  798   2HD1  ILE 105          2HD1      ILE 105  17.357   6.731  -2.180
  799   3HD1  ILE 105          3HD1      ILE 105  16.704   5.356  -3.068
  800    HA   PRO 106           HA       PRO 106  13.423   4.136  -9.181
  801   1HB   PRO 106          2HB       PRO 106  14.109   6.468 -10.916
  802   2HB   PRO 106          1HB       PRO 106  12.733   5.365 -11.008
  803   1HG   PRO 106          2HG       PRO 106  12.434   7.816 -10.021
  804   2HG   PRO 106          1HG       PRO 106  11.588   6.436  -9.298
  805   1HD   PRO 106          2HD       PRO 106  13.968   7.932  -8.309
  806   2HD   PRO 106          1HD       PRO 106  12.656   7.162  -7.395
  807    H    HIS 107           H        HIS 107  15.959   6.488 -10.079
  808    HA   HIS 107           HA       HIS 107  17.575   4.295 -11.129
  809   1HB   HIS 107          2HB       HIS 107  17.398   7.201 -11.603
  810   2HB   HIS 107          1HB       HIS 107  19.029   6.539 -11.642
  811    HD1  HIS 107           1HD      HIS 107  17.098   7.606 -14.072
  812    HD2  HIS 107           2HD      HIS 107  18.246   3.708 -13.200
  813    HE1  HIS 107           1HE      HIS 107  16.872   6.339 -16.234
  814    HE2  HIS 107           2HE      HIS 107  17.652   4.003 -15.700
  815    H    SER 108           H        SER 108  18.630   3.290  -9.508
  816    HA   SER 108           HA       SER 108  20.641   4.817  -8.074
  817   1HB   SER 108          2HB       SER 108  18.271   4.404  -6.784
  818   2HB   SER 108          1HB       SER 108  19.183   2.978  -6.288
  819    HG   SER 108           HG       SER 108  19.876   5.702  -5.941
  820    H    HIS 109           H        HIS 109  19.116   1.636  -8.493
  821    HA   HIS 109           HA       HIS 109  21.704   0.464  -9.051
  822   1HB   HIS 109          2HB       HIS 109  20.251   0.019  -6.514
  823   2HB   HIS 109          1HB       HIS 109  20.851  -1.432  -7.311
  824    HD1  HIS 109           1HD      HIS 109  21.852   0.893  -4.862
  825    HD2  HIS 109           2HD      HIS 109  23.787  -0.935  -8.053
  826    HE1  HIS 109           1HE      HIS 109  24.307   1.075  -4.352
  827    HE2  HIS 109           2HE      HIS 109  25.461   0.042  -6.340
  828    H    TYR 110           H        TYR 110  18.421  -0.610  -8.145
  829    HA   TYR 110           HA       TYR 110  18.426  -2.388 -10.473
  830   1HB   TYR 110          2HB       TYR 110  17.160  -2.435  -7.818
  831   2HB   TYR 110          1HB       TYR 110  16.106  -2.947  -9.133
  832    HD1  TYR 110           1HD      TYR 110  16.166  -5.157  -9.823
  833    HD2  TYR 110           2HD      TYR 110  19.534  -3.548  -7.781
  834    HE1  TYR 110           1HE      TYR 110  17.206  -7.384  -9.794
  835    HE2  TYR 110           2HE      TYR 110  20.584  -5.772  -7.748
  836    HH   TYR 110           HH       TYR 110  19.861  -8.151  -7.867
  Start of MODEL    5
    1   1H    GLY   1          1HT       GLY   1 -16.881 -10.533  -3.521
    2   2H    GLY   1          2HT       GLY   1 -18.445 -11.137  -3.739
    3   3H    GLY   1          3HT       GLY   1 -17.146 -12.204  -3.558
    4   1HA   GLY   1          1HA       GLY   1 -16.835 -10.966  -1.298
    5   2HA   GLY   1          2HA       GLY   1 -18.536 -10.596  -1.535
    6    H    SER   2           H        SER   2 -18.943 -13.158  -2.996
    7    HA   SER   2           HA       SER   2 -19.204 -14.844  -0.617
    8   1HB   SER   2          2HB       SER   2 -21.046 -14.207  -2.522
    9   2HB   SER   2          1HB       SER   2 -20.448 -15.750  -3.134
   10    HG   SER   2           HG       SER   2 -21.836 -15.175  -0.779
   11    H    GLN   3           H        GLN   3 -18.346 -16.874  -0.469
   12    HA   GLN   3           HA       GLN   3 -15.992 -17.451  -1.868
   13   1HB   GLN   3          2HB       GLN   3 -16.928 -18.349   0.414
   14   2HB   GLN   3          1HB       GLN   3 -17.593 -19.633  -0.587
   15   1HG   GLN   3          2HG       GLN   3 -15.632 -20.624  -0.146
   16   2HG   GLN   3          1HG       GLN   3 -15.061 -19.622  -1.479
   17   1HE2  GLN   3          1HE2      GLN   3 -14.039 -20.698   1.276
   18   2HE2  GLN   3          2HE2      GLN   3 -13.185 -19.336   1.909
   19    H    ASP   4           H        ASP   4 -15.798 -17.990  -3.932
   20    HA   ASP   4           HA       ASP   4 -17.312 -20.175  -5.030
   21   1HB   ASP   4          2HB       ASP   4 -17.783 -17.351  -5.926
   22   2HB   ASP   4          1HB       ASP   4 -17.955 -18.683  -7.065
   23    H    ARG   5           H        ARG   5 -15.151 -17.465  -5.733
   24    HA   ARG   5           HA       ARG   5 -13.030 -19.070  -6.608
   25   1HB   ARG   5          2HB       ARG   5 -14.864 -19.225  -8.510
   26   2HB   ARG   5          1HB       ARG   5 -14.187 -17.673  -8.981
   27   1HG   ARG   5          2HG       ARG   5 -11.912 -18.982  -8.785
   28   2HG   ARG   5          1HG       ARG   5 -12.961 -20.377  -9.044
   29   1HD   ARG   5          2HD       ARG   5 -13.152 -19.921 -11.212
   30   2HD   ARG   5          1HD       ARG   5 -13.613 -18.251 -10.878
   31    HE   ARG   5           HE       ARG   5 -11.013 -19.217 -11.635
   32   1HH1  ARG   5          1HH1      ARG   5 -12.760 -16.652 -10.038
   33   2HH1  ARG   5          2HH1      ARG   5 -11.512 -15.478 -10.285
   34   1HH2  ARG   5          1HH2      ARG   5  -9.370 -17.673 -11.961
   35   2HH2  ARG   5          2HH2      ARG   5  -9.587 -16.058 -11.377
   36    H    LYS   6           H        LYS   6 -11.855 -17.638  -5.361
   37    HA   LYS   6           HA       LYS   6 -11.665 -14.879  -6.377
   38   1HB   LYS   6          2HB       LYS   6 -10.544 -15.589  -3.711
   39   2HB   LYS   6          1HB       LYS   6 -11.288 -14.097  -4.256
   40   1HG   LYS   6          2HG       LYS   6 -12.960 -16.546  -3.924
   41   2HG   LYS   6          1HG       LYS   6 -12.502 -15.583  -2.520
   42   1HD   LYS   6          2HD       LYS   6 -13.361 -13.581  -3.929
   43   2HD   LYS   6          1HD       LYS   6 -14.198 -14.820  -4.866
   44   1HE   LYS   6          2HE       LYS   6 -15.547 -13.796  -3.018
   45   2HE   LYS   6          1HE       LYS   6 -15.415 -15.553  -2.957
   46   1HZ   LYS   6          1HZ       LYS   6 -14.260 -15.485  -1.051
   47   2HZ   LYS   6          2HZ       LYS   6 -14.949 -13.951  -0.876
   48   3HZ   LYS   6          3HZ       LYS   6 -13.380 -14.106  -1.487
   49    H    ILE   7           H        ILE   7  -9.628 -13.963  -6.721
   50    HA   ILE   7           HA       ILE   7  -7.544 -15.912  -7.304
   51    HB   ILE   7           HB       ILE   7  -6.389 -13.991  -8.395
   52   1HG1  ILE   7          2HG1      ILE   7  -8.646 -12.260  -8.669
   53   2HG1  ILE   7          1HG1      ILE   7  -8.342 -12.504  -6.953
   54   1HG2  ILE   7          1HG2      ILE   7  -7.413 -15.062 -10.072
   55   2HG2  ILE   7          2HG2      ILE   7  -8.549 -13.715 -10.040
   56   3HG2  ILE   7          3HG2      ILE   7  -8.927 -15.207  -9.181
   57   1HD1  ILE   7          1HD1      ILE   7  -7.022 -10.695  -7.373
   58   2HD1  ILE   7          2HD1      ILE   7  -6.645 -11.210  -9.017
   59   3HD1  ILE   7          3HD1      ILE   7  -5.867 -11.999  -7.646
   60    H    PHE   8           H        PHE   8  -8.260 -13.508  -4.945
   61    HA   PHE   8           HA       PHE   8  -5.477 -13.317  -4.079
   62   1HB   PHE   8          2HB       PHE   8  -8.007 -11.904  -3.243
   63   2HB   PHE   8          1HB       PHE   8  -6.508 -11.749  -2.340
   64    HD1  PHE   8           1HD      PHE   8  -8.191  -9.608  -3.839
   65    HD2  PHE   8           2HD      PHE   8  -4.687 -11.805  -4.848
   66    HE1  PHE   8           1HE      PHE   8  -7.491  -7.797  -5.341
   67    HE2  PHE   8           2HE      PHE   8  -3.983  -9.993  -6.351
   68    HZ   PHE   8           HZ       PHE   8  -5.386  -7.984  -6.597
   69    H    ARG   9           H        ARG   9  -8.638 -14.341  -2.815
   70    HA   ARG   9           HA       ARG   9  -9.190 -15.516  -0.913
   71   1HB   ARG   9          2HB       ARG   9  -8.615 -17.218  -2.634
   72   2HB   ARG   9          1HB       ARG   9  -6.981 -17.277  -1.987
   73   1HG   ARG   9          2HG       ARG   9  -7.577 -18.573  -0.264
   74   2HG   ARG   9          1HG       ARG   9  -9.076 -17.686   0.014
   75   1HD   ARG   9          2HD       ARG   9 -10.274 -18.978  -1.473
   76   2HD   ARG   9          1HD       ARG   9  -8.839 -19.436  -2.390
   77    HE   ARG   9           HE       ARG   9  -8.804 -20.477   0.269
   78   1HH1  ARG   9          1HH1      ARG   9 -10.096 -20.992  -2.931
   79   2HH1  ARG   9          2HH1      ARG   9 -10.291 -22.699  -2.714
   80   1HH2  ARG   9          1HH2      ARG   9  -9.058 -22.722   0.556
   81   2HH2  ARG   9          2HH2      ARG   9  -9.702 -23.682  -0.734
   82    H    GLY  10           H        GLY  10  -8.496 -14.068   0.705
   83   1HA   GLY  10          2HA       GLY  10  -7.459 -13.780   2.768
   84   2HA   GLY  10          1HA       GLY  10  -6.433 -15.161   2.407
   85    H    LEU  11           H        LEU  11  -7.001 -11.855   1.283
   86    HA   LEU  11           HA       LEU  11  -4.136 -11.322   1.422
   87   1HB   LEU  11          2HB       LEU  11  -4.954 -12.142  -0.917
   88   2HB   LEU  11          1HB       LEU  11  -5.637 -10.535  -1.048
   89    HG   LEU  11           HG       LEU  11  -2.720 -11.069  -0.526
   90   1HD1  LEU  11          1HD1      LEU  11  -3.778 -10.128  -3.149
   91   2HD1  LEU  11          2HD1      LEU  11  -3.783 -11.852  -2.780
   92   3HD1  LEU  11          3HD1      LEU  11  -2.265 -10.954  -2.774
   93   1HD2  LEU  11          1HD2      LEU  11  -4.398  -8.709  -0.575
   94   2HD2  LEU  11          2HD2      LEU  11  -3.068  -8.599  -1.725
   95   3HD2  LEU  11          3HD2      LEU  11  -2.738  -8.901  -0.018
   96    H    GLU  12           H        GLU  12  -3.861  -9.447   2.454
   97    HA   GLU  12           HA       GLU  12  -6.106  -7.587   2.657
   98   1HB   GLU  12          2HB       GLU  12  -3.635  -8.105   4.239
   99   2HB   GLU  12          1HB       GLU  12  -4.345  -6.499   4.309
  100   1HG   GLU  12          2HG       GLU  12  -6.037  -7.178   5.593
  101   2HG   GLU  12          1HG       GLU  12  -6.292  -8.642   4.645
  102    H    ILE  13           H        ILE  13  -6.217  -5.793   1.484
  103    HA   ILE  13           HA       ILE  13  -3.723  -4.563   0.520
  104    HB   ILE  13           HB       ILE  13  -6.221  -4.850  -1.153
  105   1HG1  ILE  13          2HG1      ILE  13  -3.791  -6.092  -2.175
  106   2HG1  ILE  13          1HG1      ILE  13  -4.302  -6.792  -0.644
  107   1HG2  ILE  13          1HG2      ILE  13  -3.709  -3.331  -1.439
  108   2HG2  ILE  13          2HG2      ILE  13  -5.319  -2.999  -2.078
  109   3HG2  ILE  13          3HG2      ILE  13  -4.278  -4.174  -2.880
  110   1HD1  ILE  13          1HD1      ILE  13  -6.646  -6.811  -1.854
  111   2HD1  ILE  13          2HD1      ILE  13  -5.472  -8.108  -2.073
  112   3HD1  ILE  13          3HD1      ILE  13  -5.626  -6.842  -3.290
  113    H    CYS  14           H        CYS  14  -3.636  -2.387   0.661
  114    HA   CYS  14           HA       CYS  14  -6.111  -0.915   1.219
  115   1HB   CYS  14          2HB       CYS  14  -5.022   0.340   3.010
  116   2HB   CYS  14          1HB       CYS  14  -5.035  -1.379   3.377
  117    HG   CYS  14           HG       CYS  14  -2.671  -0.055   3.787
  118    H    CYS  15           H        CYS  15  -6.183   1.161   0.441
  119    HA   CYS  15           HA       CYS  15  -3.951   1.926  -1.313
  120   1HB   CYS  15          2HB       CYS  15  -5.690   3.377  -2.439
  121   2HB   CYS  15          1HB       CYS  15  -5.943   1.641  -2.589
  122    HG   CYS  15           HG       CYS  15  -7.809   1.887  -0.715
  123    H    TYR  16           H        TYR  16  -2.647   3.346  -0.358
  124    HA   TYR  16           HA       TYR  16  -3.739   5.293   1.522
  125   1HB   TYR  16          2HB       TYR  16  -1.468   3.818   1.635
  126   2HB   TYR  16          1HB       TYR  16  -0.842   5.306   0.932
  127    HD1  TYR  16           1HD      TYR  16  -0.456   7.202   2.272
  128    HD2  TYR  16           2HD      TYR  16  -2.717   3.954   3.834
  129    HE1  TYR  16           1HE      TYR  16  -0.375   8.227   4.506
  130    HE2  TYR  16           2HE      TYR  16  -2.643   4.970   6.072
  131    HH   TYR  16           HH       TYR  16  -1.257   6.557   7.328
  132    H    GLY  17           H        GLY  17  -4.620   6.997   0.489
  133   1HA   GLY  17          2HA       GLY  17  -3.777   9.210  -0.351
  134   2HA   GLY  17          1HA       GLY  17  -3.002   8.281  -1.625
  135    HA   PRO  18           HA       PRO  18  -7.468   9.431  -2.757
  136   1HB   PRO  18          2HB       PRO  18  -7.155  11.723  -4.116
  137   2HB   PRO  18          1HB       PRO  18  -7.328  11.704  -2.356
  138   1HG   PRO  18          2HG       PRO  18  -4.849  11.960  -4.013
  139   2HG   PRO  18          1HG       PRO  18  -5.312  12.847  -2.550
  140   1HD   PRO  18          2HD       PRO  18  -3.588  10.717  -2.561
  141   2HD   PRO  18          1HD       PRO  18  -4.576  11.181  -1.162
  142    H    PHE  19           H        PHE  19  -4.424   9.230  -4.363
  143    HA   PHE  19           HA       PHE  19  -3.788   8.419  -6.384
  144   1HB   PHE  19          2HB       PHE  19  -6.595   7.351  -6.242
  145   2HB   PHE  19          1HB       PHE  19  -5.590   7.081  -7.662
  146    HD1  PHE  19           1HD      PHE  19  -4.972   6.979  -3.982
  147    HD2  PHE  19           2HD      PHE  19  -4.776   4.942  -7.712
  148    HE1  PHE  19           1HE      PHE  19  -3.933   5.046  -2.868
  149    HE2  PHE  19           2HE      PHE  19  -3.738   3.006  -6.605
  150    HZ   PHE  19           HZ       PHE  19  -3.315   3.056  -4.180
  151    H    THR  20           H        THR  20  -7.138   9.074  -7.303
  152    HA   THR  20           HA       THR  20  -6.179  11.294  -8.979
  153    HB   THR  20           HB       THR  20  -8.311  10.306 -10.399
  154    HG1  THR  20           1HG      THR  20  -8.156   8.423  -8.939
  155   1HG2  THR  20          1HG2      THR  20  -6.122  10.980 -11.318
  156   2HG2  THR  20          2HG2      THR  20  -6.742   9.479 -12.007
  157   3HG2  THR  20          3HG2      THR  20  -5.462   9.429 -10.794
  158    H    ASN  21           H        ASN  21  -9.420   9.914  -8.560
  159    HA   ASN  21           HA       ASN  21 -10.322  12.551  -7.623
  160   1HB   ASN  21          2HB       ASN  21 -11.377  11.736  -9.696
  161   2HB   ASN  21          1HB       ASN  21 -11.930  10.296  -8.847
  162   1HD2  ASN  21          1HD2      ASN  21 -12.319  13.734  -9.219
  163   2HD2  ASN  21          2HD2      ASN  21 -13.850  13.848  -8.428
  164    H    MET  22           H        MET  22 -11.559   9.232  -7.223
  165    HA   MET  22           HA       MET  22 -11.161   9.251  -4.391
  166   1HB   MET  22          2HB       MET  22 -13.173  10.751  -4.728
  167   2HB   MET  22          1HB       MET  22 -14.030   9.336  -5.324
  168   1HG   MET  22          2HG       MET  22 -13.843   8.243  -3.215
  169   2HG   MET  22          1HG       MET  22 -12.756   9.489  -2.605
  170   1HE   MET  22          1HE       MET  22 -13.654  11.881  -1.597
  171   2HE   MET  22          2HE       MET  22 -15.096  12.584  -2.327
  172   3HE   MET  22          3HE       MET  22 -13.742  12.095  -3.345
  173    HA   PRO  23           HA       PRO  23 -11.980   5.123  -6.479
  174   1HB   PRO  23          2HB       PRO  23  -9.514   4.276  -7.029
  175   2HB   PRO  23          1HB       PRO  23 -10.345   5.407  -8.104
  176   1HG   PRO  23          2HG       PRO  23  -8.241   5.948  -6.046
  177   2HG   PRO  23          1HG       PRO  23  -8.409   6.619  -7.678
  178   1HD   PRO  23          2HD       PRO  23  -9.211   7.899  -5.363
  179   2HD   PRO  23          1HD       PRO  23  -9.850   8.245  -6.981
  180    H    THR  24           H        THR  24 -10.841   6.276  -3.669
  181    HA   THR  24           HA       THR  24  -9.381   4.213  -2.492
  182    HB   THR  24           HB       THR  24 -11.036   5.330  -0.488
  183    HG1  THR  24           1HG      THR  24 -11.740   6.935  -1.814
  184   1HG2  THR  24          1HG2      THR  24  -8.286   6.160  -1.377
  185   2HG2  THR  24          2HG2      THR  24  -8.668   4.898  -0.206
  186   3HG2  THR  24          3HG2      THR  24  -9.050   6.581   0.155
  187    H    ASP  25           H        ASP  25 -12.875   4.672  -2.778
  188    HA   ASP  25           HA       ASP  25 -13.404   2.223  -1.309
  189   1HB   ASP  25          2HB       ASP  25 -15.321   4.086  -2.729
  190   2HB   ASP  25          1HB       ASP  25 -15.768   2.772  -1.646
  191    H    GLN  26           H        GLN  26 -13.123   3.339  -4.560
  192    HA   GLN  26           HA       GLN  26 -14.489   1.128  -5.767
  193   1HB   GLN  26          2HB       GLN  26 -13.770   3.609  -6.621
  194   2HB   GLN  26          1HB       GLN  26 -12.519   2.630  -7.369
  195   1HG   GLN  26          2HG       GLN  26 -14.516   1.162  -8.152
  196   2HG   GLN  26          1HG       GLN  26 -15.463   2.611  -7.816
  197   1HE2  GLN  26          1HE2      GLN  26 -12.933   1.226  -9.776
  198   2HE2  GLN  26          2HE2      GLN  26 -12.963   2.428 -11.016
  199    H    LEU  27           H        LEU  27 -11.216   1.881  -4.819
  200    HA   LEU  27           HA       LEU  27 -10.004  -0.268  -6.271
  201   1HB   LEU  27          2HB       LEU  27  -8.929   1.915  -5.360
  202   2HB   LEU  27          1HB       LEU  27  -8.796   1.032  -3.852
  203    HG   LEU  27           HG       LEU  27  -7.383  -0.637  -4.893
  204   1HD1  LEU  27          1HD1      LEU  27  -6.594   0.026  -7.307
  205   2HD1  LEU  27          2HD1      LEU  27  -8.186   0.781  -7.385
  206   3HD1  LEU  27          3HD1      LEU  27  -8.045  -0.946  -7.064
  207   1HD2  LEU  27          1HD2      LEU  27  -6.720   2.145  -4.671
  208   2HD2  LEU  27          2HD2      LEU  27  -5.789   1.407  -5.975
  209   3HD2  LEU  27          3HD2      LEU  27  -5.720   0.728  -4.350
  210    H    GLU  28           H        GLU  28 -10.945   0.257  -2.881
  211    HA   GLU  28           HA       GLU  28 -10.069  -2.267  -1.965
  212   1HB   GLU  28          2HB       GLU  28 -11.504  -1.833  -0.003
  213   2HB   GLU  28          1HB       GLU  28 -10.471  -0.470  -0.403
  214   1HG   GLU  28          2HG       GLU  28 -12.210   0.875  -0.657
  215   2HG   GLU  28          1HG       GLU  28 -13.024  -0.266  -1.725
  216    H    TRP  29           H        TRP  29 -12.929  -1.219  -3.631
  217    HA   TRP  29           HA       TRP  29 -14.559  -3.461  -2.991
  218   1HB   TRP  29          2HB       TRP  29 -15.791  -1.662  -3.817
  219   2HB   TRP  29          1HB       TRP  29 -14.615  -1.307  -5.077
  220    HD1  TRP  29           HD       TRP  29 -17.142  -4.136  -4.270
  221    HE1  TRP  29           1HE      TRP  29 -18.163  -4.948  -6.490
  222    HE3  TRP  29           3HE      TRP  29 -14.478  -1.207  -7.498
  223    HZ2  TRP  29           2HZ      TRP  29 -17.871  -4.415  -9.248
  224    HZ3  TRP  29           3HZ      TRP  29 -14.906  -1.419  -9.911
  225    HH2  TRP  29           HH       TRP  29 -16.567  -2.992 -10.766
  226    H    MET  30           H        MET  30 -12.572  -2.631  -5.794
  227    HA   MET  30           HA       MET  30 -12.964  -4.931  -7.296
  228   1HB   MET  30          2HB       MET  30 -10.559  -3.119  -7.081
  229   2HB   MET  30          1HB       MET  30 -10.690  -4.407  -8.269
  230   1HG   MET  30          2HG       MET  30 -12.816  -3.313  -9.053
  231   2HG   MET  30          1HG       MET  30 -12.387  -1.945  -8.028
  232   1HE   MET  30          1HE       MET  30  -9.833  -1.175  -8.039
  233   2HE   MET  30          2HE       MET  30 -10.676   0.053  -8.983
  234   3HE   MET  30          3HE       MET  30  -9.147  -0.606  -9.561
  235    H    VAL  31           H        VAL  31 -10.445  -4.281  -4.842
  236    HA   VAL  31           HA       VAL  31  -9.154  -6.767  -5.062
  237    HB   VAL  31           HB       VAL  31  -8.325  -6.357  -2.757
  238   1HG1  VAL  31          1HG1      VAL  31  -7.927  -4.718  -5.078
  239   2HG1  VAL  31          2HG1      VAL  31  -6.759  -5.227  -3.858
  240   3HG1  VAL  31          3HG1      VAL  31  -7.704  -3.755  -3.615
  241   1HG2  VAL  31          1HG2      VAL  31 -10.111  -3.947  -2.901
  242   2HG2  VAL  31          2HG2      VAL  31  -8.880  -4.220  -1.671
  243   3HG2  VAL  31          3HG2      VAL  31 -10.265  -5.305  -1.789
  244    H    GLN  32           H        GLN  32 -11.806  -5.679  -2.985
  245    HA   GLN  32           HA       GLN  32 -12.144  -8.019  -1.489
  246   1HB   GLN  32          2HB       GLN  32 -13.274  -5.651  -1.310
  247   2HB   GLN  32          1HB       GLN  32 -14.507  -6.382  -2.328
  248   1HG   GLN  32          2HG       GLN  32 -15.169  -7.865  -0.697
  249   2HG   GLN  32          1HG       GLN  32 -13.628  -7.778   0.156
  250   1HE2  GLN  32          1HE2      GLN  32 -14.642  -7.371   2.120
  251   2HE2  GLN  32          2HE2      GLN  32 -15.359  -5.842   2.485
  252    H    LEU  33           H        LEU  33 -13.196  -7.126  -4.690
  253    HA   LEU  33           HA       LEU  33 -15.011  -9.276  -5.093
  254   1HB   LEU  33          2HB       LEU  33 -14.887  -7.095  -6.382
  255   2HB   LEU  33          1HB       LEU  33 -13.498  -7.764  -7.216
  256    HG   LEU  33           HG       LEU  33 -14.835  -9.496  -8.205
  257   1HD1  LEU  33          1HD1      LEU  33 -16.373 -10.177  -6.617
  258   2HD1  LEU  33          2HD1      LEU  33 -17.386  -9.331  -7.787
  259   3HD1  LEU  33          3HD1      LEU  33 -16.915  -8.532  -6.287
  260   1HD2  LEU  33          1HD2      LEU  33 -14.838  -7.327  -9.323
  261   2HD2  LEU  33          2HD2      LEU  33 -16.252  -6.841  -8.388
  262   3HD2  LEU  33          3HD2      LEU  33 -16.374  -8.163  -9.549
  263    H    CYS  34           H        CYS  34 -11.588  -8.992  -5.169
  264    HA   CYS  34           HA       CYS  34 -11.231 -11.412  -6.754
  265   1HB   CYS  34          2HB       CYS  34  -9.460  -9.218  -5.794
  266   2HB   CYS  34          1HB       CYS  34  -8.728 -10.793  -6.082
  267    HG   CYS  34           HG       CYS  34 -10.137  -9.139  -8.310
  268    H    GLY  35           H        GLY  35 -11.874 -10.750  -3.574
  269   1HA   GLY  35          2HA       GLY  35 -12.056 -12.660  -2.079
  270   2HA   GLY  35          1HA       GLY  35 -10.524 -13.231  -2.719
  271    H    ALA  36           H        ALA  36  -9.363 -10.534  -2.656
  272    HA   ALA  36           HA       ALA  36  -8.086 -10.636  -0.183
  273   1HB   ALA  36          1HB       ALA  36  -6.980  -9.511  -1.921
  274   2HB   ALA  36          2HB       ALA  36  -7.403  -8.250  -0.764
  275   3HB   ALA  36          3HB       ALA  36  -8.358  -8.458  -2.230
  276    H    SER  37           H        SER  37  -8.129  -9.116   1.582
  277    HA   SER  37           HA       SER  37 -10.857  -8.232   2.193
  278   1HB   SER  37          2HB       SER  37  -8.825  -9.524   3.720
  279   2HB   SER  37          1HB       SER  37  -9.104  -7.937   4.435
  280    HG   SER  37           HG       SER  37 -10.692 -10.147   4.439
  281    H    VAL  38           H        VAL  38 -11.354  -6.119   2.399
  282    HA   VAL  38           HA       VAL  38  -9.464  -4.166   1.546
  283    HB   VAL  38           HB       VAL  38 -11.215  -2.539   1.821
  284   1HG1  VAL  38          1HG1      VAL  38 -12.632  -5.018   0.903
  285   2HG1  VAL  38          2HG1      VAL  38 -11.305  -4.316  -0.021
  286   3HG1  VAL  38          3HG1      VAL  38 -12.764  -3.373   0.282
  287   1HG2  VAL  38          1HG2      VAL  38 -12.182  -2.973   3.907
  288   2HG2  VAL  38          2HG2      VAL  38 -12.522  -4.655   3.501
  289   3HG2  VAL  38          3HG2      VAL  38 -13.460  -3.361   2.755
  290    H    VAL  39           H        VAL  39  -7.895  -3.373   2.762
  291    HA   VAL  39           HA       VAL  39  -8.240  -3.270   5.669
  292    HB   VAL  39           HB       VAL  39  -5.706  -2.887   4.074
  293   1HG1  VAL  39          1HG1      VAL  39  -5.656  -3.832   6.861
  294   2HG1  VAL  39          2HG1      VAL  39  -6.142  -2.154   6.622
  295   3HG1  VAL  39          3HG1      VAL  39  -4.582  -2.716   6.019
  296   1HG2  VAL  39          1HG2      VAL  39  -7.169  -5.299   4.798
  297   2HG2  VAL  39          2HG2      VAL  39  -5.495  -5.303   5.353
  298   3HG2  VAL  39          3HG2      VAL  39  -5.857  -5.072   3.642
  299    H    LYS  40           H        LYS  40  -8.820  -1.413   6.546
  300    HA   LYS  40           HA       LYS  40  -9.011   1.009   5.157
  301   1HB   LYS  40          2HB       LYS  40 -10.176   0.167   7.343
  302   2HB   LYS  40          1HB       LYS  40  -8.819   0.951   8.140
  303   1HG   LYS  40          2HG       LYS  40 -10.636   2.488   8.079
  304   2HG   LYS  40          1HG       LYS  40  -9.409   3.050   6.941
  305   1HD   LYS  40          2HD       LYS  40 -11.355   1.257   5.719
  306   2HD   LYS  40          1HD       LYS  40 -12.092   2.708   6.400
  307   1HE   LYS  40          2HE       LYS  40  -9.681   2.808   4.607
  308   2HE   LYS  40          1HE       LYS  40 -11.328   2.834   3.979
  309   1HZ   LYS  40          1HZ       LYS  40 -10.352   5.063   4.277
  310   2HZ   LYS  40          2HZ       LYS  40 -10.254   4.786   5.941
  311   3HZ   LYS  40          3HZ       LYS  40 -11.764   4.842   5.182
  312    H    GLU  41           H        GLU  41  -6.625  -0.049   7.561
  313    HA   GLU  41           HA       GLU  41  -4.819   2.026   6.530
  314   1HB   GLU  41          2HB       GLU  41  -5.359   1.411   9.436
  315   2HB   GLU  41          1HB       GLU  41  -4.017   2.399   8.874
  316   1HG   GLU  41          2HG       GLU  41  -5.307   4.190   8.598
  317   2HG   GLU  41          1HG       GLU  41  -6.581   3.262   7.807
  318    H    LEU  42           H        LEU  42  -2.529   1.663   7.388
  319    HA   LEU  42           HA       LEU  42  -1.663  -0.890   6.545
  320   1HB   LEU  42          2HB       LEU  42  -0.053   1.072   8.169
  321   2HB   LEU  42          1HB       LEU  42   0.548  -0.149   7.064
  322    HG   LEU  42           HG       LEU  42  -1.179   2.094   6.068
  323   1HD1  LEU  42          1HD1      LEU  42   0.390   3.525   6.787
  324   2HD1  LEU  42          2HD1      LEU  42   1.334   2.895   5.436
  325   3HD1  LEU  42          3HD1      LEU  42   1.577   2.248   7.058
  326   1HD2  LEU  42          1HD2      LEU  42   0.401  -0.084   4.930
  327   2HD2  LEU  42          2HD2      LEU  42   0.706   1.484   4.182
  328   3HD2  LEU  42          3HD2      LEU  42  -0.934   0.836   4.235
  329    H    SER  43           H        SER  43  -1.931   0.597   9.752
  330    HA   SER  43           HA       SER  43  -0.811  -1.505  11.228
  331   1HB   SER  43          2HB       SER  43  -2.784   0.661  11.930
  332   2HB   SER  43          1HB       SER  43  -2.265  -0.533  13.118
  333    HG   SER  43           HG       SER  43  -0.312   0.328  13.159
  334    H    SER  44           H        SER  44  -3.950  -1.119   9.793
  335    HA   SER  44           HA       SER  44  -5.438  -2.926  11.313
  336   1HB   SER  44          2HB       SER  44  -5.759  -1.485   8.856
  337   2HB   SER  44          1HB       SER  44  -6.296  -3.148   8.617
  338    HG   SER  44           HG       SER  44  -8.020  -2.613   9.669
  339    H    PHE  45           H        PHE  45  -2.931  -3.479   9.002
  340    HA   PHE  45           HA       PHE  45  -3.516  -6.011   8.052
  341   1HB   PHE  45          2HB       PHE  45  -0.870  -4.728   8.730
  342   2HB   PHE  45          1HB       PHE  45  -0.989  -6.306   7.959
  343    HD1  PHE  45           1HD      PHE  45  -3.237  -5.860   6.097
  344    HD2  PHE  45           2HD      PHE  45   0.062  -3.365   7.106
  345    HE1  PHE  45           1HE      PHE  45  -3.393  -4.770   3.895
  346    HE2  PHE  45           2HE      PHE  45  -0.089  -2.272   4.907
  347    HZ   PHE  45           HZ       PHE  45  -1.816  -2.975   3.301
  348    H    THR  46           H        THR  46  -3.792  -7.915   9.000
  349    HA   THR  46           HA       THR  46  -2.301  -8.566  11.424
  350    HB   THR  46           HB       THR  46  -4.338  -7.695  12.343
  351    HG1  THR  46           1HG      THR  46  -4.577 -10.517  12.275
  352   1HG2  THR  46          1HG2      THR  46  -6.519  -8.332  11.749
  353   2HG2  THR  46          2HG2      THR  46  -5.940  -9.640  10.717
  354   3HG2  THR  46          3HG2      THR  46  -5.695  -7.962  10.234
  355    H    LEU  47           H        LEU  47  -1.228 -10.323  10.791
  356    HA   LEU  47           HA       LEU  47  -2.013 -12.082   8.758
  357   1HB   LEU  47          2HB       LEU  47  -0.065 -12.373  11.033
  358   2HB   LEU  47          1HB       LEU  47  -0.300 -13.633   9.837
  359    HG   LEU  47           HG       LEU  47   0.208 -11.683   8.138
  360   1HD1  LEU  47          1HD1      LEU  47   0.527  -9.767   9.297
  361   2HD1  LEU  47          2HD1      LEU  47   2.167 -10.400   9.431
  362   3HD1  LEU  47          3HD1      LEU  47   1.031 -10.607  10.763
  363   1HD2  LEU  47          1HD2      LEU  47   2.657 -12.560   9.532
  364   2HD2  LEU  47          2HD2      LEU  47   2.208 -12.687   7.831
  365   3HD2  LEU  47          3HD2      LEU  47   1.561 -13.836   9.003
  366    H    GLY  48           H        GLY  48  -2.814 -14.213   8.819
  367   1HA   GLY  48          2HA       GLY  48  -3.974 -15.116  11.356
  368   2HA   GLY  48          1HA       GLY  48  -5.050 -14.883   9.988
  369    H    THR  49           H        THR  49  -5.490 -16.652   8.867
  370    HA   THR  49           HA       THR  49  -3.921 -19.045   9.260
  371    HB   THR  49           HB       THR  49  -5.655 -20.155   7.950
  372    HG1  THR  49           1HG      THR  49  -6.044 -18.480   6.448
  373   1HG2  THR  49          1HG2      THR  49  -7.385 -20.017   9.433
  374   2HG2  THR  49          2HG2      THR  49  -7.251 -18.266   9.599
  375   3HG2  THR  49          3HG2      THR  49  -6.077 -19.319  10.388
  376    H    GLY  50           H        GLY  50  -4.400 -16.638   6.772
  377   1HA   GLY  50          2HA       GLY  50  -2.024 -17.338   5.414
  378   2HA   GLY  50          1HA       GLY  50  -3.399 -18.013   4.556
  379    H    VAL  51           H        VAL  51  -3.346 -14.967   6.320
  380    HA   VAL  51           HA       VAL  51  -4.138 -13.595   3.868
  381    HB   VAL  51           HB       VAL  51  -4.515 -11.639   5.448
  382   1HG1  VAL  51          1HG1      VAL  51  -6.122 -14.107   6.073
  383   2HG1  VAL  51          2HG1      VAL  51  -6.276 -13.192   4.573
  384   3HG1  VAL  51          3HG1      VAL  51  -6.661 -12.428   6.116
  385   1HG2  VAL  51          1HG2      VAL  51  -4.685 -13.517   7.713
  386   2HG2  VAL  51          2HG2      VAL  51  -4.226 -11.815   7.680
  387   3HG2  VAL  51          3HG2      VAL  51  -3.058 -13.053   7.217
  388    H    HIS  52           H        HIS  52  -2.676 -12.587   2.673
  389    HA   HIS  52           HA       HIS  52  -0.099 -11.876   3.847
  390   1HB   HIS  52          2HB       HIS  52  -0.471 -13.168   1.605
  391   2HB   HIS  52          1HB       HIS  52  -0.757 -11.565   0.938
  392    HD1  HIS  52           1HD      HIS  52   1.926 -13.826   2.106
  393    HD2  HIS  52           2HD      HIS  52   1.524  -9.852   0.959
  394    HE1  HIS  52           1HE      HIS  52   4.270 -12.994   1.727
  395    HE2  HIS  52           2HE      HIS  52   4.005 -10.566   1.108
  396    HA   PRO  53           HA       PRO  53  -1.324  -7.595   3.915
  397   1HB   PRO  53          2HB       PRO  53   0.985  -6.521   4.739
  398   2HB   PRO  53          1HB       PRO  53   0.011  -7.538   5.809
  399   1HG   PRO  53          2HG       PRO  53   2.462  -8.239   4.242
  400   2HG   PRO  53          1HG       PRO  53   2.030  -8.684   5.902
  401   1HD   PRO  53          2HD       PRO  53   1.703 -10.329   3.721
  402   2HD   PRO  53          1HD       PRO  53   0.761 -10.458   5.219
  403    H    ILE  54           H        ILE  54  -1.567  -6.292   2.220
  404    HA   ILE  54           HA       ILE  54   0.738  -5.757   0.476
  405    HB   ILE  54           HB       ILE  54  -2.063  -6.287  -0.529
  406   1HG1  ILE  54          2HG1      ILE  54  -0.855  -8.332   0.236
  407   2HG1  ILE  54          1HG1      ILE  54  -1.198  -8.328  -1.490
  408   1HG2  ILE  54          1HG2      ILE  54  -1.231  -4.808  -2.069
  409   2HG2  ILE  54          2HG2      ILE  54  -0.660  -6.334  -2.745
  410   3HG2  ILE  54          3HG2      ILE  54   0.440  -5.315  -1.817
  411   1HD1  ILE  54          1HD1      ILE  54   1.218  -7.344  -1.652
  412   2HD1  ILE  54          2HD1      ILE  54   0.949  -9.077  -1.478
  413   3HD1  ILE  54          3HD1      ILE  54   1.400  -8.109  -0.074
  414    H    VAL  55           H        VAL  55   0.764  -3.707  -0.486
  415    HA   VAL  55           HA       VAL  55  -1.270  -1.812   0.481
  416    HB   VAL  55           HB       VAL  55   1.691  -1.286   0.303
  417   1HG1  VAL  55          1HG1      VAL  55  -0.650   0.462   1.010
  418   2HG1  VAL  55          2HG1      VAL  55   0.611   0.746  -0.191
  419   3HG1  VAL  55          3HG1      VAL  55   0.994   0.837   1.528
  420   1HG2  VAL  55          1HG2      VAL  55   0.106  -1.191   2.829
  421   2HG2  VAL  55          2HG2      VAL  55   1.832  -1.467   2.595
  422   3HG2  VAL  55          3HG2      VAL  55   0.675  -2.743   2.214
  423    H    VAL  56           H        VAL  56  -1.681   0.013  -0.834
  424    HA   VAL  56           HA       VAL  56  -0.698  -0.250  -3.595
  425    HB   VAL  56           HB       VAL  56  -3.450   0.729  -2.862
  426   1HG1  VAL  56          1HG1      VAL  56  -2.901  -0.367  -5.530
  427   2HG1  VAL  56          2HG1      VAL  56  -2.041   1.124  -5.149
  428   3HG1  VAL  56          3HG1      VAL  56  -3.802   1.073  -5.057
  429   1HG2  VAL  56          1HG2      VAL  56  -4.106  -1.539  -3.933
  430   2HG2  VAL  56          2HG2      VAL  56  -3.602  -1.497  -2.243
  431   3HG2  VAL  56          3HG2      VAL  56  -2.470  -2.026  -3.489
  432    H    VAL  57           H        VAL  57   0.141   1.540  -4.491
  433    HA   VAL  57           HA       VAL  57  -0.523   4.159  -3.372
  434    HB   VAL  57           HB       VAL  57   1.949   4.751  -3.446
  435   1HG1  VAL  57          1HG1      VAL  57   1.206   2.724  -1.348
  436   2HG1  VAL  57          2HG1      VAL  57   0.563   4.365  -1.382
  437   3HG1  VAL  57          3HG1      VAL  57   2.296   4.102  -1.187
  438   1HG2  VAL  57          1HG2      VAL  57   2.712   2.800  -4.697
  439   2HG2  VAL  57          2HG2      VAL  57   2.220   1.748  -3.369
  440   3HG2  VAL  57          3HG2      VAL  57   3.527   2.910  -3.137
  441    H    GLN  58           H        GLN  58  -1.029   5.470  -4.985
  442    HA   GLN  58           HA       GLN  58   0.528   5.376  -7.460
  443   1HB   GLN  58          2HB       GLN  58  -1.748   4.058  -7.517
  444   2HB   GLN  58          1HB       GLN  58  -2.441   5.666  -7.676
  445   1HG   GLN  58          2HG       GLN  58  -0.224   4.797  -9.479
  446   2HG   GLN  58          1HG       GLN  58  -1.884   4.295  -9.795
  447   1HE2  GLN  58          1HE2      GLN  58  -3.493   6.155  -9.703
  448   2HE2  GLN  58          2HE2      GLN  58  -3.019   7.611 -10.502
  449    HA   PRO  59           HA       PRO  59   0.015   9.701  -5.946
  450   1HB   PRO  59          2HB       PRO  59   2.410  10.542  -6.951
  451   2HB   PRO  59          1HB       PRO  59   2.227   9.803  -5.357
  452   1HG   PRO  59          2HG       PRO  59   3.119   8.563  -7.931
  453   2HG   PRO  59          1HG       PRO  59   3.776   8.349  -6.297
  454   1HD   PRO  59          2HD       PRO  59   2.139   6.532  -7.434
  455   2HD   PRO  59          1HD       PRO  59   2.116   6.860  -5.690
  456    H    ASP  60           H        ASP  60  -0.926  11.278  -7.090
  457    HA   ASP  60           HA       ASP  60  -0.224  12.082  -9.680
  458   1HB   ASP  60          2HB       ASP  60  -1.375   9.753 -10.023
  459   2HB   ASP  60          1HB       ASP  60  -2.862  10.661  -9.768
  460    H    ALA  61           H        ALA  61  -2.819  11.767  -7.323
  461    HA   ALA  61           HA       ALA  61  -3.795  14.440  -8.056
  462   1HB   ALA  61          1HB       ALA  61  -5.725  13.729  -6.488
  463   2HB   ALA  61          2HB       ALA  61  -5.072  12.103  -6.691
  464   3HB   ALA  61          3HB       ALA  61  -5.623  13.014  -8.097
  465    H    TRP  62           H        TRP  62  -1.361  13.951  -6.498
  466    HA   TRP  62           HA       TRP  62  -2.054  14.712  -3.783
  467   1HB   TRP  62          2HB       TRP  62   0.408  13.835  -5.192
  468   2HB   TRP  62          1HB       TRP  62   0.626  14.893  -3.802
  469    HD1  TRP  62           HD       TRP  62  -1.589  11.750  -4.434
  470    HE1  TRP  62           1HE      TRP  62  -1.313  10.181  -2.413
  471    HE3  TRP  62           3HE      TRP  62   1.713  14.529  -1.694
  472    HZ2  TRP  62           2HZ      TRP  62   0.114  10.129   0.022
  473    HZ3  TRP  62           3HZ      TRP  62   2.485  13.648   0.470
  474    HH2  TRP  62           HH       TRP  62   1.701  11.493   1.309
  475    H    THR  63           H        THR  63  -0.727  16.149  -6.692
  476    HA   THR  63           HA       THR  63  -0.456  18.317  -7.320
  477    HB   THR  63           HB       THR  63  -1.585  19.370  -4.769
  478    HG1  THR  63           1HG      THR  63  -3.181  18.151  -6.765
  479   1HG2  THR  63          1HG2      THR  63  -2.925  20.726  -6.435
  480   2HG2  THR  63          2HG2      THR  63  -1.845  20.077  -7.668
  481   3HG2  THR  63          3HG2      THR  63  -1.194  21.049  -6.348
  482    H    GLU  64           H        GLU  64  -0.118  18.487  -3.788
  483    HA   GLU  64           HA       GLU  64   2.406  19.897  -4.106
  484   1HB   GLU  64          2HB       GLU  64   0.547  19.384  -1.814
  485   2HB   GLU  64          1HB       GLU  64   2.209  19.861  -1.493
  486   1HG   GLU  64          2HG       GLU  64   1.587  21.748  -3.259
  487   2HG   GLU  64          1HG       GLU  64  -0.030  21.417  -2.641
  488    H    ASP  65           H        ASP  65   4.254  19.276  -2.688
  489    HA   ASP  65           HA       ASP  65   4.599  16.361  -2.765
  490   1HB   ASP  65          2HB       ASP  65   6.169  18.209  -3.907
  491   2HB   ASP  65          1HB       ASP  65   6.927  18.155  -2.319
  492    H    ASN  66           H        ASN  66   3.219  16.566  -0.703
  493    HA   ASN  66           HA       ASN  66   4.255  17.610   1.673
  494   1HB   ASN  66          2HB       ASN  66   1.961  16.239   0.925
  495   2HB   ASN  66          1HB       ASN  66   2.739  15.148   2.068
  496   1HD2  ASN  66          1HD2      ASN  66   0.279  16.512   2.446
  497   2HD2  ASN  66          2HD2      ASN  66   0.472  17.568   3.799
  498    H    GLY  67           H        GLY  67   4.947  14.640  -0.022
  499   1HA   GLY  67          2HA       GLY  67   7.257  13.806   0.480
  500   2HA   GLY  67          1HA       GLY  67   6.775  13.864   2.169
  501    H    PHE  68           H        PHE  68   6.251  12.251  -0.909
  502    HA   PHE  68           HA       PHE  68   4.801  10.100   0.453
  503   1HB   PHE  68          2HB       PHE  68   4.017  11.245  -1.745
  504   2HB   PHE  68          1HB       PHE  68   5.237  10.235  -2.514
  505    HD1  PHE  68           1HD      PHE  68   2.679   9.697   0.155
  506    HD2  PHE  68           2HD      PHE  68   4.323   8.420  -3.556
  507    HE1  PHE  68           1HE      PHE  68   1.085   7.823   0.098
  508    HE2  PHE  68           2HE      PHE  68   2.733   6.545  -3.621
  509    HZ   PHE  68           HZ       PHE  68   1.111   6.243  -1.791
  510    H    HIS  69           H        HIS  69   7.906  10.780   0.042
  511    HA   HIS  69           HA       HIS  69   8.766   8.196  -0.990
  512   1HB   HIS  69          2HB       HIS  69   9.862  10.552  -1.424
  513   2HB   HIS  69          1HB       HIS  69  10.665  10.231   0.108
  514    HD1  HIS  69           1HD      HIS  69  12.761  10.347  -1.712
  515    HD2  HIS  69           2HD      HIS  69  10.365   6.953  -1.702
  516    HE1  HIS  69           1HE      HIS  69  14.114   8.567  -2.863
  517    HE2  HIS  69           2HE      HIS  69  12.607   6.547  -2.925
  518    H    ALA  70           H        ALA  70   7.349   7.758   1.241
  519    HA   ALA  70           HA       ALA  70   9.315   6.603   3.003
  520   1HB   ALA  70          1HB       ALA  70   7.938   7.716   4.990
  521   2HB   ALA  70          2HB       ALA  70   7.756   8.996   3.791
  522   3HB   ALA  70          3HB       ALA  70   9.366   8.476   4.288
  523    H    ILE  71           H        ILE  71   7.129   5.744   1.243
  524    HA   ILE  71           HA       ILE  71   4.865   4.954   2.711
  525    HB   ILE  71           HB       ILE  71   5.982   3.403   0.385
  526   1HG1  ILE  71          2HG1      ILE  71   6.030   5.696  -0.338
  527   2HG1  ILE  71          1HG1      ILE  71   4.614   4.941  -1.055
  528   1HG2  ILE  71          1HG2      ILE  71   3.724   2.796  -0.039
  529   2HG2  ILE  71          2HG2      ILE  71   3.123   3.960   1.142
  530   3HG2  ILE  71          3HG2      ILE  71   4.017   2.538   1.680
  531   1HD1  ILE  71          1HD1      ILE  71   4.398   6.477   1.500
  532   2HD1  ILE  71          2HD1      ILE  71   3.149   6.103   0.313
  533   3HD1  ILE  71          3HD1      ILE  71   4.394   7.293  -0.062
  534    H    GLY  72           H        GLY  72   7.974   3.381   2.133
  535   1HA   GLY  72          2HA       GLY  72   7.210   0.948   3.470
  536   2HA   GLY  72          1HA       GLY  72   8.824   1.377   2.923
  537    H    GLN  73           H        GLN  73   8.627   3.973   4.423
  538    HA   GLN  73           HA       GLN  73   9.851   3.083   6.820
  539   1HB   GLN  73          2HB       GLN  73   9.728   5.469   5.403
  540   2HB   GLN  73          1HB       GLN  73   8.895   5.834   6.908
  541   1HG   GLN  73          2HG       GLN  73  10.981   4.672   7.983
  542   2HG   GLN  73          1HG       GLN  73  11.735   5.082   6.443
  543   1HE2  GLN  73          1HE2      GLN  73   9.601   6.620   8.832
  544   2HE2  GLN  73          2HE2      GLN  73  10.448   8.126   8.869
  545    H    MET  74           H        MET  74   6.591   3.940   5.965
  546    HA   MET  74           HA       MET  74   5.756   4.012   8.761
  547   1HB   MET  74          2HB       MET  74   4.116   4.395   6.250
  548   2HB   MET  74          1HB       MET  74   3.574   4.685   7.897
  549   1HG   MET  74          2HG       MET  74   5.005   6.545   8.143
  550   2HG   MET  74          1HG       MET  74   5.891   6.147   6.673
  551   1HE   MET  74          1HE       MET  74   1.469   7.449   6.530
  552   2HE   MET  74          2HE       MET  74   2.327   7.203   8.051
  553   3HE   MET  74          3HE       MET  74   2.026   5.836   6.979
  554    H    CYS  75           H        CYS  75   5.594   1.971   5.932
  555    HA   CYS  75           HA       CYS  75   4.353  -0.118   7.582
  556   1HB   CYS  75          2HB       CYS  75   2.620   0.850   6.112
  557   2HB   CYS  75          1HB       CYS  75   3.614   0.475   4.709
  558    HG   CYS  75           HG       CYS  75   2.914  -1.993   6.341
  559    H    GLU  76           H        GLU  76   5.026  -2.215   7.166
  560    HA   GLU  76           HA       GLU  76   7.454  -2.411   5.527
  561   1HB   GLU  76          2HB       GLU  76   6.502  -3.740   8.004
  562   2HB   GLU  76          1HB       GLU  76   7.454  -4.723   6.899
  563   1HG   GLU  76          2HG       GLU  76   9.254  -3.882   7.872
  564   2HG   GLU  76          1HG       GLU  76   8.873  -2.358   7.073
  565    H    ALA  77           H        ALA  77   4.778  -2.482   4.386
  566    HA   ALA  77           HA       ALA  77   4.693  -5.262   3.410
  567   1HB   ALA  77          1HB       ALA  77   2.381  -3.524   2.865
  568   2HB   ALA  77          2HB       ALA  77   2.659  -3.915   4.562
  569   3HB   ALA  77          3HB       ALA  77   2.442  -5.209   3.383
  570    HA   PRO  78           HA       PRO  78   5.564  -3.868  -0.690
  571   1HB   PRO  78          2HB       PRO  78   4.131  -5.508  -2.243
  572   2HB   PRO  78          1HB       PRO  78   5.435  -6.124  -1.219
  573   1HG   PRO  78          2HG       PRO  78   2.479  -6.139  -0.729
  574   2HG   PRO  78          1HG       PRO  78   3.654  -7.444  -0.490
  575   1HD   PRO  78          2HD       PRO  78   2.749  -5.845   1.531
  576   2HD   PRO  78          1HD       PRO  78   4.349  -6.614   1.536
  577    H    VAL  79           H        VAL  79   4.866  -1.832  -1.154
  578    HA   VAL  79           HA       VAL  79   2.033  -1.342  -1.595
  579    HB   VAL  79           HB       VAL  79   2.498   0.970  -1.546
  580   1HG1  VAL  79          1HG1      VAL  79   2.797   0.866   0.651
  581   2HG1  VAL  79          2HG1      VAL  79   4.534   0.715   0.395
  582   3HG1  VAL  79          3HG1      VAL  79   3.532  -0.730   0.505
  583   1HG2  VAL  79          1HG2      VAL  79   4.802   1.875  -1.594
  584   2HG2  VAL  79          2HG2      VAL  79   4.335   1.067  -3.090
  585   3HG2  VAL  79          3HG2      VAL  79   5.396   0.252  -1.942
  586    H    VAL  80           H        VAL  80   1.113  -1.261  -3.573
  587    HA   VAL  80           HA       VAL  80   2.848  -0.804  -5.901
  588    HB   VAL  80           HB       VAL  80   1.699  -2.581  -7.160
  589   1HG1  VAL  80          1HG1      VAL  80   3.108  -3.395  -4.628
  590   2HG1  VAL  80          2HG1      VAL  80   3.801  -3.176  -6.236
  591   3HG1  VAL  80          3HG1      VAL  80   2.711  -4.524  -5.923
  592   1HG2  VAL  80          1HG2      VAL  80  -0.348  -3.043  -6.292
  593   2HG2  VAL  80          2HG2      VAL  80   0.183  -2.807  -4.626
  594   3HG2  VAL  80          3HG2      VAL  80   0.565  -4.308  -5.470
  595    H    THR  81           H        THR  81   1.935   0.357  -7.549
  596    HA   THR  81           HA       THR  81  -0.207   2.044  -7.075
  597    HB   THR  81           HB       THR  81  -0.076   2.698  -9.343
  598    HG1  THR  81           1HG      THR  81   0.826   0.067  -9.798
  599   1HG2  THR  81          1HG2      THR  81   2.095   3.245  -9.584
  600   2HG2  THR  81          2HG2      THR  81   2.659   1.603  -9.277
  601   3HG2  THR  81          3HG2      THR  81   2.183   2.638  -7.931
  602    H    ARG  82           H        ARG  82  -2.307   2.150  -8.217
  603    HA   ARG  82           HA       ARG  82  -3.912  -0.036  -7.652
  604   1HB   ARG  82          2HB       ARG  82  -5.541   1.099  -9.322
  605   2HB   ARG  82          1HB       ARG  82  -5.087   1.948  -7.851
  606   1HG   ARG  82          2HG       ARG  82  -4.379   3.663  -9.051
  607   2HG   ARG  82          1HG       ARG  82  -3.208   2.629  -9.865
  608   1HD   ARG  82          2HD       ARG  82  -4.631   3.704 -11.494
  609   2HD   ARG  82          1HD       ARG  82  -4.942   1.969 -11.479
  610    HE   ARG  82           HE       ARG  82  -7.076   2.390 -10.757
  611   1HH1  ARG  82          1HH1      ARG  82  -5.159   5.281 -10.383
  612   2HH1  ARG  82          2HH1      ARG  82  -6.515   6.279  -9.980
  613   1HH2  ARG  82          1HH2      ARG  82  -8.862   3.700 -10.228
  614   2HH2  ARG  82          2HH2      ARG  82  -8.618   5.382  -9.892
  615    H    GLU  83           H        GLU  83  -1.907   0.498 -10.409
  616    HA   GLU  83           HA       GLU  83  -3.113  -0.870 -12.447
  617   1HB   GLU  83          2HB       GLU  83  -0.286  -0.522 -11.600
  618   2HB   GLU  83          1HB       GLU  83  -0.610  -1.770 -12.795
  619   1HG   GLU  83          2HG       GLU  83  -0.329  -0.094 -14.251
  620   2HG   GLU  83          1HG       GLU  83  -2.005   0.278 -13.851
  621    H    TRP  84           H        TRP  84  -1.353  -2.251  -9.703
  622    HA   TRP  84           HA       TRP  84  -1.437  -4.947 -10.424
  623   1HB   TRP  84          2HB       TRP  84  -0.148  -4.101  -8.514
  624   2HB   TRP  84          1HB       TRP  84  -1.635  -3.707  -7.670
  625    HD1  TRP  84           HD       TRP  84   0.266  -6.829  -8.950
  626    HE1  TRP  84           1HE      TRP  84  -0.348  -8.809  -7.423
  627    HE3  TRP  84           3HE      TRP  84  -3.231  -4.535  -6.012
  628    HZ2  TRP  84           2HZ      TRP  84  -2.089  -9.328  -5.257
  629    HZ3  TRP  84           3HZ      TRP  84  -4.325  -5.842  -4.239
  630    HH2  TRP  84           HH       TRP  84  -3.768  -8.186  -3.869
  631    H    VAL  85           H        VAL  85  -3.608  -3.169  -8.292
  632    HA   VAL  85           HA       VAL  85  -5.524  -5.124  -7.874
  633    HB   VAL  85           HB       VAL  85  -6.017  -2.150  -8.063
  634   1HG1  VAL  85          1HG1      VAL  85  -7.695  -3.046  -6.152
  635   2HG1  VAL  85          2HG1      VAL  85  -7.675  -4.437  -7.235
  636   3HG1  VAL  85          3HG1      VAL  85  -8.146  -2.851  -7.845
  637   1HG2  VAL  85          1HG2      VAL  85  -4.236  -2.523  -6.517
  638   2HG2  VAL  85          2HG2      VAL  85  -5.095  -3.869  -5.767
  639   3HG2  VAL  85          3HG2      VAL  85  -5.701  -2.222  -5.584
  640    H    LEU  86           H        LEU  86  -5.349  -2.707 -10.454
  641    HA   LEU  86           HA       LEU  86  -7.813  -3.431 -11.664
  642   1HB   LEU  86          2HB       LEU  86  -6.161  -1.329 -11.937
  643   2HB   LEU  86          1HB       LEU  86  -5.672  -2.258 -13.341
  644    HG   LEU  86           HG       LEU  86  -7.362  -0.620 -13.947
  645   1HD1  LEU  86          1HD1      LEU  86  -7.276  -2.932 -14.992
  646   2HD1  LEU  86          2HD1      LEU  86  -8.776  -2.025 -15.193
  647   3HD1  LEU  86          3HD1      LEU  86  -8.680  -3.318 -13.998
  648   1HD2  LEU  86          1HD2      LEU  86  -8.415  -0.989 -11.501
  649   2HD2  LEU  86          2HD2      LEU  86  -9.518  -1.976 -12.461
  650   3HD2  LEU  86          3HD2      LEU  86  -9.299  -0.268 -12.845
  651    H    ASP  87           H        ASP  87  -4.447  -4.058 -12.664
  652    HA   ASP  87           HA       ASP  87  -5.016  -5.727 -14.814
  653   1HB   ASP  87          2HB       ASP  87  -2.783  -4.795 -14.367
  654   2HB   ASP  87          1HB       ASP  87  -2.627  -5.836 -12.955
  655    H    SER  88           H        SER  88  -4.939  -6.398 -11.387
  656    HA   SER  88           HA       SER  88  -4.987  -9.253 -11.681
  657   1HB   SER  88          2HB       SER  88  -5.530  -7.458  -9.308
  658   2HB   SER  88          1HB       SER  88  -5.510  -9.219  -9.225
  659    HG   SER  88           HG       SER  88  -3.328  -7.729 -10.235
  660    H    VAL  89           H        VAL  89  -7.401  -6.799 -10.761
  661    HA   VAL  89           HA       VAL  89  -9.547  -8.664 -10.609
  662    HB   VAL  89           HB       VAL  89  -9.703  -5.667 -10.956
  663   1HG1  VAL  89          1HG1      VAL  89 -11.922  -5.829 -10.079
  664   2HG1  VAL  89          2HG1      VAL  89 -11.728  -7.552  -9.761
  665   3HG1  VAL  89          3HG1      VAL  89 -11.788  -6.963 -11.422
  666   1HG2  VAL  89          1HG2      VAL  89  -8.589  -7.094  -8.838
  667   2HG2  VAL  89          2HG2      VAL  89 -10.208  -6.664  -8.290
  668   3HG2  VAL  89          3HG2      VAL  89  -9.098  -5.405  -8.829
  669    H    ALA  90           H        ALA  90  -8.137  -6.809 -13.192
  670    HA   ALA  90           HA       ALA  90 -10.330  -6.876 -14.981
  671   1HB   ALA  90          1HB       ALA  90  -8.543  -5.306 -15.329
  672   2HB   ALA  90          2HB       ALA  90  -8.628  -6.387 -16.721
  673   3HB   ALA  90          3HB       ALA  90  -7.372  -6.613 -15.503
  674    H    LEU  91           H        LEU  91  -7.343  -8.825 -14.940
  675    HA   LEU  91           HA       LEU  91  -8.566 -10.772 -16.718
  676   1HB   LEU  91          2HB       LEU  91  -6.280 -10.123 -17.162
  677   2HB   LEU  91          1HB       LEU  91  -5.799 -10.566 -15.537
  678    HG   LEU  91           HG       LEU  91  -6.321 -12.934 -16.059
  679   1HD1  LEU  91          1HD1      LEU  91  -7.182 -11.697 -18.611
  680   2HD1  LEU  91          2HD1      LEU  91  -7.841 -13.082 -17.740
  681   3HD1  LEU  91          3HD1      LEU  91  -6.367 -13.258 -18.693
  682   1HD2  LEU  91          1HD2      LEU  91  -4.426 -13.207 -17.734
  683   2HD2  LEU  91          2HD2      LEU  91  -4.053 -12.349 -16.239
  684   3HD2  LEU  91          3HD2      LEU  91  -4.318 -11.447 -17.731
  685    H    TYR  92           H        TYR  92  -8.284 -10.281 -13.387
  686    HA   TYR  92           HA       TYR  92  -8.861 -11.534 -11.583
  687   1HB   TYR  92          2HB       TYR  92 -10.289 -12.726 -13.779
  688   2HB   TYR  92          1HB       TYR  92  -9.784 -13.981 -12.653
  689    HD1  TYR  92           1HD      TYR  92  -9.948 -12.377 -10.095
  690    HD2  TYR  92           2HD      TYR  92 -12.609 -12.694 -13.402
  691    HE1  TYR  92           1HE      TYR  92 -11.835 -11.815  -8.624
  692    HE2  TYR  92           2HE      TYR  92 -14.502 -12.130 -11.938
  693    HH   TYR  92           HH       TYR  92 -14.594 -12.400  -8.864
  694    H    GLN  93           H        GLN  93  -6.536 -11.656 -11.247
  695    HA   GLN  93           HA       GLN  93  -5.668 -14.244 -10.625
  696   1HB   GLN  93          2HB       GLN  93  -5.419 -14.450 -13.075
  697   2HB   GLN  93          1HB       GLN  93  -4.332 -13.069 -13.071
  698   1HG   GLN  93          2HG       GLN  93  -2.610 -14.249 -12.144
  699   2HG   GLN  93          1HG       GLN  93  -3.682 -15.391 -11.335
  700   1HE2  GLN  93          1HE2      GLN  93  -3.499 -17.355 -12.112
  701   2HE2  GLN  93          2HE2      GLN  93  -3.209 -17.783 -13.760
  702    H    CYS  94           H        CYS  94  -4.080 -14.128  -9.137
  703    HA   CYS  94           HA       CYS  94  -3.288 -11.662  -8.078
  704   1HB   CYS  94          2HB       CYS  94  -3.283 -14.058  -7.032
  705   2HB   CYS  94          1HB       CYS  94  -1.643 -14.137  -7.666
  706    HG   CYS  94           HG       CYS  94  -2.498 -11.983  -5.587
  707    H    GLN  95           H        GLN  95  -2.414 -10.378  -9.721
  708    HA   GLN  95           HA       GLN  95  -0.195 -11.218 -11.307
  709   1HB   GLN  95          2HB       GLN  95  -1.067  -8.378 -10.773
  710   2HB   GLN  95          1HB       GLN  95  -0.158  -8.976 -12.154
  711   1HG   GLN  95          2HG       GLN  95  -3.028  -9.596 -11.498
  712   2HG   GLN  95          1HG       GLN  95  -2.447  -8.530 -12.777
  713   1HE2  GLN  95          1HE2      GLN  95  -1.826  -9.380 -14.689
  714   2HE2  GLN  95          2HE2      GLN  95  -1.890 -11.063 -15.072
  715    H    GLU  96           H        GLU  96   1.930 -10.207 -11.288
  716    HA   GLU  96           HA       GLU  96   3.164 -10.364  -8.761
  717   1HB   GLU  96          2HB       GLU  96   5.180  -9.496  -9.946
  718   2HB   GLU  96          1HB       GLU  96   4.427 -10.873 -10.741
  719   1HG   GLU  96          2HG       GLU  96   3.176  -8.831 -11.990
  720   2HG   GLU  96          1HG       GLU  96   4.746  -8.103 -11.651
  721    H    LEU  97           H        LEU  97   4.242  -8.728  -7.548
  722    HA   LEU  97           HA       LEU  97   2.876  -6.137  -7.706
  723   1HB   LEU  97          2HB       LEU  97   4.121  -7.709  -5.499
  724   2HB   LEU  97          1HB       LEU  97   4.052  -5.963  -5.349
  725    HG   LEU  97           HG       LEU  97   1.486  -6.459  -6.009
  726   1HD1  LEU  97          1HD1      LEU  97   2.099  -8.944  -5.988
  727   2HD1  LEU  97          2HD1      LEU  97   0.659  -8.442  -5.103
  728   3HD1  LEU  97          3HD1      LEU  97   2.156  -8.778  -4.233
  729   1HD2  LEU  97          1HD2      LEU  97   0.970  -5.921  -3.818
  730   2HD2  LEU  97          2HD2      LEU  97   2.606  -5.288  -3.991
  731   3HD2  LEU  97          3HD2      LEU  97   2.338  -6.823  -3.167
  732    H    ASP  98           H        ASP  98   6.047  -7.622  -7.690
  733    HA   ASP  98           HA       ASP  98   7.646  -5.379  -7.312
  734   1HB   ASP  98          2HB       ASP  98   8.257  -7.909  -7.531
  735   2HB   ASP  98          1HB       ASP  98   8.452  -7.529  -9.240
  736    H    THR  99           H        THR  99   5.719  -6.251 -10.037
  737    HA   THR  99           HA       THR  99   7.185  -4.650 -11.930
  738    HB   THR  99           HB       THR  99   4.474  -5.976 -12.091
  739    HG1  THR  99           1HG      THR  99   5.632  -7.418 -13.442
  740   1HG2  THR  99          1HG2      THR  99   6.046  -4.577 -14.234
  741   2HG2  THR  99          2HG2      THR  99   4.413  -4.207 -13.680
  742   3HG2  THR  99          3HG2      THR  99   4.731  -5.708 -14.550
  743    H    TYR 100           H        TYR 100   4.718  -4.072  -9.598
  744    HA   TYR 100           HA       TYR 100   4.431  -1.340 -10.643
  745   1HB   TYR 100          2HB       TYR 100   2.106  -2.682  -9.307
  746   2HB   TYR 100          1HB       TYR 100   2.116  -1.305 -10.400
  747    HD1  TYR 100           1HD      TYR 100   2.536  -1.700 -12.851
  748    HD2  TYR 100           2HD      TYR 100   1.828  -4.884 -10.120
  749    HE1  TYR 100           1HE      TYR 100   1.995  -3.188 -14.734
  750    HE2  TYR 100           2HE      TYR 100   1.285  -6.379 -11.994
  751    HH   TYR 100           HH       TYR 100   2.115  -6.067 -14.897
  752    H    LEU 101           H        LEU 101   6.025  -2.641  -8.454
  753    HA   LEU 101           HA       LEU 101   4.845  -1.532  -6.042
  754   1HB   LEU 101          2HB       LEU 101   6.546  -3.661  -6.565
  755   2HB   LEU 101          1HB       LEU 101   7.590  -2.467  -5.821
  756    HG   LEU 101           HG       LEU 101   5.016  -2.988  -4.454
  757   1HD1  LEU 101          1HD1      LEU 101   6.285  -5.202  -5.302
  758   2HD1  LEU 101          2HD1      LEU 101   5.398  -5.104  -3.782
  759   3HD1  LEU 101          3HD1      LEU 101   7.150  -4.907  -3.793
  760   1HD2  LEU 101          1HD2      LEU 101   6.326  -1.491  -3.299
  761   2HD2  LEU 101          2HD2      LEU 101   7.830  -2.298  -3.743
  762   3HD2  LEU 101          3HD2      LEU 101   6.772  -3.012  -2.526
  763    H    ILE 102           H        ILE 102   5.688   0.161  -4.848
  764    HA   ILE 102           HA       ILE 102   6.727   2.144  -4.451
  765    HB   ILE 102           HB       ILE 102   8.886   1.199  -6.334
  766   1HG1  ILE 102          2HG1      ILE 102   9.616   0.824  -3.610
  767   2HG1  ILE 102          1HG1      ILE 102   8.041   0.070  -3.842
  768   1HG2  ILE 102          1HG2      ILE 102   8.963   3.573  -5.716
  769   2HG2  ILE 102          2HG2      ILE 102  10.329   2.674  -5.055
  770   3HG2  ILE 102          3HG2      ILE 102   8.978   3.120  -4.012
  771   1HD1  ILE 102          1HD1      ILE 102   9.047  -1.098  -5.843
  772   2HD1  ILE 102          2HD1      ILE 102   9.637  -1.600  -4.258
  773   3HD1  ILE 102          3HD1      ILE 102  10.613  -0.528  -5.263
  774    HA   PRO 103           HA       PRO 103   5.222   4.621  -7.821
  775   1HB   PRO 103          2HB       PRO 103   6.014   7.062  -6.911
  776   2HB   PRO 103          1HB       PRO 103   4.616   6.196  -6.266
  777   1HG   PRO 103          2HG       PRO 103   7.396   6.383  -5.173
  778   2HG   PRO 103          1HG       PRO 103   5.847   6.485  -4.316
  779   1HD   PRO 103          2HD       PRO 103   7.336   4.235  -4.332
  780   2HD   PRO 103          1HD       PRO 103   5.561   4.195  -4.296
  781    H    GLN 104           H        GLN 104   6.208   6.745  -8.995
  782    HA   GLN 104           HA       GLN 104   7.721   7.489 -10.520
  783   1HB   GLN 104          2HB       GLN 104   9.091   7.250  -8.127
  784   2HB   GLN 104          1HB       GLN 104  10.119   6.391  -9.265
  785   1HG   GLN 104          2HG       GLN 104   9.360   8.753 -10.559
  786   2HG   GLN 104          1HG       GLN 104   9.756   9.211  -8.903
  787   1HE2  GLN 104          1HE2      GLN 104  11.637  10.260  -9.376
  788   2HE2  GLN 104          2HE2      GLN 104  13.052   9.462  -9.963
  789    H    ILE 105           H        ILE 105   6.987   6.029 -12.114
  790    HA   ILE 105           HA       ILE 105   9.025   4.150 -12.963
  791    HB   ILE 105           HB       ILE 105   7.334   2.342 -13.367
  792   1HG1  ILE 105          2HG1      ILE 105   5.448   2.733 -11.417
  793   2HG1  ILE 105          1HG1      ILE 105   5.624   4.357 -12.075
  794   1HG2  ILE 105          1HG2      ILE 105   7.580   1.391 -11.222
  795   2HG2  ILE 105          2HG2      ILE 105   7.631   2.972 -10.442
  796   3HG2  ILE 105          3HG2      ILE 105   8.979   2.440 -11.446
  797   1HD1  ILE 105          1HD1      ILE 105   4.417   1.965 -13.248
  798   2HD1  ILE 105          2HD1      ILE 105   5.443   2.891 -14.344
  799   3HD1  ILE 105          3HD1      ILE 105   4.082   3.673 -13.539
  800    HA   PRO 106           HA       PRO 106   7.579   6.136 -16.721
  801   1HB   PRO 106          2HB       PRO 106   9.358   4.973 -18.406
  802   2HB   PRO 106          1HB       PRO 106   9.791   6.306 -17.331
  803   1HG   PRO 106          2HG       PRO 106  10.243   3.367 -16.979
  804   2HG   PRO 106          1HG       PRO 106  11.349   4.716 -16.658
  805   1HD   PRO 106          2HD       PRO 106   9.954   3.478 -14.696
  806   2HD   PRO 106          1HD       PRO 106  10.370   5.202 -14.629
  807    H    HIS 107           H        HIS 107   5.783   5.498 -17.716
  808    HA   HIS 107           HA       HIS 107   5.692   3.059 -19.219
  809   1HB   HIS 107          2HB       HIS 107   4.541   3.153 -16.540
  810   2HB   HIS 107          1HB       HIS 107   3.356   2.715 -17.764
  811    HD1  HIS 107           1HD      HIS 107   4.861   0.898 -19.590
  812    HD2  HIS 107           2HD      HIS 107   5.368   0.819 -15.467
  813    HE1  HIS 107           1HE      HIS 107   5.771  -1.388 -19.068
  814    HE2  HIS 107           2HE      HIS 107   6.153  -1.381 -16.578
  815    H    SER 108           H        SER 108   5.401   5.935 -19.630
  816    HA   SER 108           HA       SER 108   2.814   5.867 -20.997
  817   1HB   SER 108          2HB       SER 108   2.406   8.248 -20.309
  818   2HB   SER 108          1HB       SER 108   2.317   7.091 -18.980
  819    HG   SER 108           HG       SER 108   3.716   9.212 -18.948
  820    H    HIS 109           H        HIS 109   5.432   5.485 -22.023
  821    HA   HIS 109           HA       HIS 109   5.488   7.677 -23.948
  822   1HB   HIS 109          2HB       HIS 109   7.151   8.212 -22.149
  823   2HB   HIS 109          1HB       HIS 109   8.005   6.730 -22.568
  824    HD1  HIS 109           1HD      HIS 109  10.116   7.962 -23.340
  825    HD2  HIS 109           2HD      HIS 109   6.685   9.076 -25.402
  826    HE1  HIS 109           1HE      HIS 109  10.921   9.303 -25.309
  827    HE2  HIS 109           2HE      HIS 109   8.833   9.891 -26.590
  828    H    TYR 110           H        TYR 110   4.744   6.286 -25.526
  829    HA   TYR 110           HA       TYR 110   6.112   3.784 -26.031
  830   1HB   TYR 110          2HB       TYR 110   3.547   4.538 -26.412
  831   2HB   TYR 110          1HB       TYR 110   4.189   4.842 -28.023
  832    HD1  TYR 110           1HD      TYR 110   3.195   2.319 -25.620
  833    HD2  TYR 110           2HD      TYR 110   5.177   2.970 -29.328
  834    HE1  TYR 110           1HE      TYR 110   2.981  -0.073 -26.147
  835    HE2  TYR 110           2HE      TYR 110   4.966   0.579 -29.867
  836    HH   TYR 110           HH       TYR 110   2.916  -1.452 -28.450
  Start of MODEL    6
    1   1H    GLY   1          1HT       GLY   1 -25.252 -23.966  -3.355
    2   2H    GLY   1          2HT       GLY   1 -25.784 -25.503  -3.820
    3   3H    GLY   1          3HT       GLY   1 -26.828 -24.179  -3.931
    4   1HA   GLY   1          1HA       GLY   1 -24.748 -25.057  -5.739
    5   2HA   GLY   1          2HA       GLY   1 -26.225 -24.167  -6.077
    6    H    SER   2           H        SER   2 -23.155 -23.681  -4.326
    7    HA   SER   2           HA       SER   2 -22.954 -21.050  -5.632
    8   1HB   SER   2          2HB       SER   2 -21.779 -21.405  -2.915
    9   2HB   SER   2          1HB       SER   2 -22.456 -19.962  -3.668
   10    HG   SER   2           HG       SER   2 -24.244 -20.409  -2.683
   11    H    GLN   3           H        GLN   3 -21.306 -21.150  -7.005
   12    HA   GLN   3           HA       GLN   3 -18.837 -22.497  -6.124
   13   1HB   GLN   3          2HB       GLN   3 -20.380 -22.747  -8.621
   14   2HB   GLN   3          1HB       GLN   3 -18.648 -22.545  -8.846
   15   1HG   GLN   3          2HG       GLN   3 -18.400 -24.435  -7.137
   16   2HG   GLN   3          1HG       GLN   3 -20.111 -24.739  -7.430
   17   1HE2  GLN   3          1HE2      GLN   3 -17.059 -25.564  -8.331
   18   2HE2  GLN   3          2HE2      GLN   3 -17.386 -26.222  -9.894
   19    H    ASP   4           H        ASP   4 -17.187 -21.155  -5.889
   20    HA   ASP   4           HA       ASP   4 -16.896 -18.893  -7.725
   21   1HB   ASP   4          2HB       ASP   4 -16.988 -18.722  -4.718
   22   2HB   ASP   4          1HB       ASP   4 -16.186 -17.495  -5.694
   23    H    ARG   5           H        ARG   5 -14.680 -17.762  -7.167
   24    HA   ARG   5           HA       ARG   5 -12.627 -19.416  -6.087
   25   1HB   ARG   5          2HB       ARG   5 -13.348 -19.942  -8.764
   26   2HB   ARG   5          1HB       ARG   5 -11.825 -19.067  -8.829
   27   1HG   ARG   5          2HG       ARG   5 -12.273 -21.495  -7.112
   28   2HG   ARG   5          1HG       ARG   5 -11.625 -21.558  -8.752
   29   1HD   ARG   5          2HD       ARG   5  -9.737 -20.203  -8.107
   30   2HD   ARG   5          1HD       ARG   5 -10.412 -19.970  -6.495
   31    HE   ARG   5           HE       ARG   5 -10.028 -22.730  -7.135
   32   1HH1  ARG   5          1HH1      ARG   5  -8.418 -19.849  -6.001
   33   2HH1  ARG   5          2HH1      ARG   5  -7.184 -20.720  -5.154
   34   1HH2  ARG   5          1HH2      ARG   5  -8.407 -23.878  -6.021
   35   2HH2  ARG   5          2HH2      ARG   5  -7.178 -23.008  -5.166
   36    H    LYS   6           H        LYS   6 -12.105 -17.551  -4.955
   37    HA   LYS   6           HA       LYS   6 -11.567 -15.065  -6.272
   38   1HB   LYS   6          2HB       LYS   6 -10.598 -15.799  -3.517
   39   2HB   LYS   6          1HB       LYS   6 -11.028 -14.218  -4.138
   40   1HG   LYS   6          2HG       LYS   6 -13.223 -16.153  -4.171
   41   2HG   LYS   6          1HG       LYS   6 -12.615 -15.750  -2.565
   42   1HD   LYS   6          2HD       LYS   6 -12.748 -13.288  -3.603
   43   2HD   LYS   6          1HD       LYS   6 -14.020 -14.061  -4.551
   44   1HE   LYS   6          2HE       LYS   6 -14.709 -14.968  -2.146
   45   2HE   LYS   6          1HE       LYS   6 -13.889 -13.492  -1.642
   46   1HZ   LYS   6          1HZ       LYS   6 -15.396 -12.511  -3.563
   47   2HZ   LYS   6          2HZ       LYS   6 -15.952 -12.659  -1.972
   48   3HZ   LYS   6          3HZ       LYS   6 -16.376 -13.820  -3.127
   49    H    ILE   7           H        ILE   7  -9.650 -14.233  -6.957
   50    HA   ILE   7           HA       ILE   7  -7.496 -16.069  -7.406
   51    HB   ILE   7           HB       ILE   7  -6.352 -14.112  -8.442
   52   1HG1  ILE   7          2HG1      ILE   7  -8.581 -12.367  -8.694
   53   2HG1  ILE   7          1HG1      ILE   7  -8.354 -12.682  -6.979
   54   1HG2  ILE   7          1HG2      ILE   7  -8.254 -13.809 -10.209
   55   2HG2  ILE   7          2HG2      ILE   7  -9.050 -15.068  -9.267
   56   3HG2  ILE   7          3HG2      ILE   7  -7.473 -15.374  -9.996
   57   1HD1  ILE   7          1HD1      ILE   7  -6.514 -11.372  -8.922
   58   2HD1  ILE   7          2HD1      ILE   7  -5.870 -12.143  -7.471
   59   3HD1  ILE   7          3HD1      ILE   7  -7.038 -10.830  -7.327
   60    H    PHE   8           H        PHE   8  -8.198 -13.675  -5.012
   61    HA   PHE   8           HA       PHE   8  -5.418 -13.570  -4.130
   62   1HB   PHE   8          2HB       PHE   8  -7.901 -12.098  -3.246
   63   2HB   PHE   8          1HB       PHE   8  -6.362 -11.956  -2.418
   64    HD1  PHE   8           1HD      PHE   8  -7.984  -9.738  -3.724
   65    HD2  PHE   8           2HD      PHE   8  -4.761 -12.138  -5.132
   66    HE1  PHE   8           1HE      PHE   8  -7.324  -7.941  -5.269
   67    HE2  PHE   8           2HE      PHE   8  -4.100 -10.346  -6.679
   68    HZ   PHE   8           HZ       PHE   8  -5.382  -8.245  -6.749
   69    H    ARG   9           H        ARG   9  -8.608 -14.493  -2.870
   70    HA   ARG   9           HA       ARG   9  -9.223 -15.731  -1.048
   71   1HB   ARG   9          2HB       ARG   9  -8.502 -17.463  -2.628
   72   2HB   ARG   9          1HB       ARG   9  -6.862 -17.357  -2.004
   73   1HG   ARG   9          2HG       ARG   9  -7.797 -18.022   0.239
   74   2HG   ARG   9          1HG       ARG   9  -9.312 -18.375  -0.596
   75   1HD   ARG   9          2HD       ARG   9  -7.795 -19.796  -2.165
   76   2HD   ARG   9          1HD       ARG   9  -6.658 -19.736  -0.818
   77    HE   ARG   9           HE       ARG   9  -9.290 -20.547  -0.027
   78   1HH1  ARG   9          1HH1      ARG   9  -6.267 -21.655  -1.376
   79   2HH1  ARG   9          2HH1      ARG   9  -6.489 -23.290  -0.852
   80   1HH2  ARG   9          1HH2      ARG   9  -9.583 -22.698   0.663
   81   2HH2  ARG   9          2HH2      ARG   9  -8.372 -23.883   0.305
   82    H    GLY  10           H        GLY  10  -8.808 -14.335   0.654
   83   1HA   GLY  10          2HA       GLY  10  -7.938 -13.926   2.761
   84   2HA   GLY  10          1HA       GLY  10  -6.793 -15.231   2.497
   85    H    LEU  11           H        LEU  11  -7.484 -11.879   1.647
   86    HA   LEU  11           HA       LEU  11  -4.634 -11.280   1.808
   87   1HB   LEU  11          2HB       LEU  11  -6.009 -11.570  -0.648
   88   2HB   LEU  11          1HB       LEU  11  -5.707  -9.859  -0.434
   89    HG   LEU  11           HG       LEU  11  -3.411 -11.665   0.049
   90   1HD1  LEU  11          1HD1      LEU  11  -2.923 -11.995  -2.263
   91   2HD1  LEU  11          2HD1      LEU  11  -4.333 -11.054  -2.751
   92   3HD1  LEU  11          3HD1      LEU  11  -4.545 -12.616  -1.961
   93   1HD2  LEU  11          1HD2      LEU  11  -3.728  -8.990  -0.081
   94   2HD2  LEU  11          2HD2      LEU  11  -3.257  -9.340  -1.744
   95   3HD2  LEU  11          3HD2      LEU  11  -2.208  -9.822  -0.409
   96    H    GLU  12           H        GLU  12  -4.215  -8.932   1.834
   97    HA   GLU  12           HA       GLU  12  -6.522  -7.284   2.552
   98   1HB   GLU  12          2HB       GLU  12  -4.499  -8.256   4.401
   99   2HB   GLU  12          1HB       GLU  12  -4.560  -6.500   4.371
  100   1HG   GLU  12          2HG       GLU  12  -7.034  -6.677   4.733
  101   2HG   GLU  12          1HG       GLU  12  -6.799  -8.403   4.995
  102    H    ILE  13           H        ILE  13  -6.410  -5.691   1.101
  103    HA   ILE  13           HA       ILE  13  -3.778  -4.467   0.588
  104    HB   ILE  13           HB       ILE  13  -6.077  -4.553  -1.360
  105   1HG1  ILE  13          2HG1      ILE  13  -3.753  -6.078  -2.154
  106   2HG1  ILE  13          1HG1      ILE  13  -4.387  -6.675  -0.623
  107   1HG2  ILE  13          1HG2      ILE  13  -3.269  -3.530  -1.465
  108   2HG2  ILE  13          2HG2      ILE  13  -4.768  -2.736  -1.950
  109   3HG2  ILE  13          3HG2      ILE  13  -4.098  -4.035  -2.938
  110   1HD1  ILE  13          1HD1      ILE  13  -5.527  -7.930  -2.182
  111   2HD1  ILE  13          2HD1      ILE  13  -5.697  -6.578  -3.300
  112   3HD1  ILE  13          3HD1      ILE  13  -6.667  -6.631  -1.830
  113    H    CYS  14           H        CYS  14  -3.578  -2.351   0.957
  114    HA   CYS  14           HA       CYS  14  -6.030  -0.801   1.455
  115   1HB   CYS  14          2HB       CYS  14  -4.811   0.516   3.060
  116   2HB   CYS  14          1HB       CYS  14  -4.592  -1.184   3.451
  117    HG   CYS  14           HG       CYS  14  -2.196  -0.726   3.422
  118    H    CYS  15           H        CYS  15  -6.299   1.145   0.495
  119    HA   CYS  15           HA       CYS  15  -4.282   1.901  -1.506
  120   1HB   CYS  15          2HB       CYS  15  -6.196   3.155  -2.574
  121   2HB   CYS  15          1HB       CYS  15  -6.365   1.403  -2.563
  122    HG   CYS  15           HG       CYS  15  -7.888   2.095  -0.262
  123    H    TYR  16           H        TYR  16  -2.988   3.444  -0.740
  124    HA   TYR  16           HA       TYR  16  -4.046   5.458   1.089
  125   1HB   TYR  16          2HB       TYR  16  -1.751   4.135   1.244
  126   2HB   TYR  16          1HB       TYR  16  -1.194   5.447   0.212
  127    HD1  TYR  16           1HD      TYR  16  -2.641   7.758   1.259
  128    HD2  TYR  16           2HD      TYR  16  -0.829   4.519   3.339
  129    HE1  TYR  16           1HE      TYR  16  -2.356   9.194   3.234
  130    HE2  TYR  16           2HE      TYR  16  -0.538   5.946   5.320
  131    HH   TYR  16           HH       TYR  16  -0.421   8.271   5.913
  132    H    GLY  17           H        GLY  17  -4.759   7.340   0.356
  133   1HA   GLY  17          2HA       GLY  17  -4.333   9.417  -0.767
  134   2HA   GLY  17          1HA       GLY  17  -3.444   8.529  -1.993
  135    HA   PRO  18           HA       PRO  18  -7.934   9.118  -3.306
  136   1HB   PRO  18          2HB       PRO  18  -7.867  11.383  -4.717
  137   2HB   PRO  18          1HB       PRO  18  -8.010  11.411  -2.954
  138   1HG   PRO  18          2HG       PRO  18  -5.602  11.874  -4.667
  139   2HG   PRO  18          1HG       PRO  18  -6.123  12.738  -3.210
  140   1HD   PRO  18          2HD       PRO  18  -4.202  10.750  -3.262
  141   2HD   PRO  18          1HD       PRO  18  -5.126  11.224  -1.824
  142    H    PHE  19           H        PHE  19  -4.860   9.030  -4.796
  143    HA   PHE  19           HA       PHE  19  -4.109   8.215  -6.776
  144   1HB   PHE  19          2HB       PHE  19  -6.908   7.094  -6.846
  145   2HB   PHE  19          1HB       PHE  19  -5.715   6.753  -8.093
  146    HD1  PHE  19           1HD      PHE  19  -5.815   6.791  -4.362
  147    HD2  PHE  19           2HD      PHE  19  -4.683   4.721  -7.901
  148    HE1  PHE  19           1HE      PHE  19  -4.929   4.947  -2.994
  149    HE2  PHE  19           2HE      PHE  19  -3.795   2.873  -6.543
  150    HZ   PHE  19           HZ       PHE  19  -3.917   2.984  -4.084
  151    H    THR  20           H        THR  20  -7.429   8.731  -7.864
  152    HA   THR  20           HA       THR  20  -6.468  10.942  -9.557
  153    HB   THR  20           HB       THR  20  -8.149  10.151 -11.261
  154    HG1  THR  20           1HG      THR  20  -8.142   7.816  -9.654
  155   1HG2  THR  20          1HG2      THR  20  -6.678   7.811 -11.454
  156   2HG2  THR  20          2HG2      THR  20  -5.598   8.956 -10.659
  157   3HG2  THR  20          3HG2      THR  20  -6.318   9.359 -12.217
  158    H    ASN  21           H        ASN  21  -9.636   9.459  -8.888
  159    HA   ASN  21           HA       ASN  21 -10.625  12.136  -8.162
  160   1HB   ASN  21          2HB       ASN  21 -11.577  10.446 -10.110
  161   2HB   ASN  21          1HB       ASN  21 -12.645  10.089  -8.755
  162   1HD2  ASN  21          1HD2      ASN  21 -13.042  11.500 -11.355
  163   2HD2  ASN  21          2HD2      ASN  21 -13.747  13.018 -10.927
  164    H    MET  22           H        MET  22 -11.734   8.805  -7.542
  165    HA   MET  22           HA       MET  22 -11.255   8.940  -4.745
  166   1HB   MET  22          2HB       MET  22 -13.222  10.491  -5.006
  167   2HB   MET  22          1HB       MET  22 -14.158   9.109  -5.559
  168   1HG   MET  22          2HG       MET  22 -12.819   8.547  -3.064
  169   2HG   MET  22          1HG       MET  22 -13.836   9.980  -2.947
  170   1HE   MET  22          1HE       MET  22 -14.540   8.332  -1.062
  171   2HE   MET  22          2HE       MET  22 -15.910   7.236  -1.243
  172   3HE   MET  22          3HE       MET  22 -16.142   8.975  -1.423
  173    HA   PRO  23           HA       PRO  23 -12.272   4.753  -6.565
  174   1HB   PRO  23          2HB       PRO  23  -9.870   3.824  -7.229
  175   2HB   PRO  23          1HB       PRO  23 -10.724   4.954  -8.288
  176   1HG   PRO  23          2HG       PRO  23  -8.477   5.467  -6.385
  177   2HG   PRO  23          1HG       PRO  23  -8.747   6.132  -8.005
  178   1HD   PRO  23          2HD       PRO  23  -9.363   7.414  -5.610
  179   2HD   PRO  23          1HD       PRO  23 -10.027   7.831  -7.201
  180    H    THR  24           H        THR  24 -11.172   5.941  -3.835
  181    HA   THR  24           HA       THR  24  -9.594   3.939  -2.657
  182    HB   THR  24           HB       THR  24 -11.184   5.088  -0.625
  183    HG1  THR  24           1HG      THR  24 -11.784   6.929  -1.383
  184   1HG2  THR  24          1HG2      THR  24  -8.891   4.792  -0.238
  185   2HG2  THR  24          2HG2      THR  24  -9.148   6.536  -0.273
  186   3HG2  THR  24          3HG2      THR  24  -8.446   5.719  -1.670
  187    H    ASP  25           H        ASP  25 -13.105   4.371  -2.806
  188    HA   ASP  25           HA       ASP  25 -13.528   1.917  -1.302
  189   1HB   ASP  25          2HB       ASP  25 -14.973   3.940  -0.957
  190   2HB   ASP  25          1HB       ASP  25 -15.594   3.715  -2.590
  191    H    GLN  26           H        GLN  26 -13.448   3.047  -4.556
  192    HA   GLN  26           HA       GLN  26 -14.888   0.818  -5.666
  193   1HB   GLN  26          2HB       GLN  26 -14.299   3.327  -6.559
  194   2HB   GLN  26          1HB       GLN  26 -13.106   2.373  -7.426
  195   1HG   GLN  26          2HG       GLN  26 -15.300   0.889  -7.872
  196   2HG   GLN  26          1HG       GLN  26 -16.031   2.485  -7.717
  197   1HE2  GLN  26          1HE2      GLN  26 -13.937   4.010  -8.778
  198   2HE2  GLN  26          2HE2      GLN  26 -13.816   3.670 -10.467
  199    H    LEU  27           H        LEU  27 -11.570   1.670  -4.998
  200    HA   LEU  27           HA       LEU  27 -10.429  -0.453  -6.550
  201   1HB   LEU  27          2HB       LEU  27  -9.230   1.660  -5.978
  202   2HB   LEU  27          1HB       LEU  27  -9.184   1.137  -4.305
  203    HG   LEU  27           HG       LEU  27  -7.867  -0.864  -5.040
  204   1HD1  LEU  27          1HD1      LEU  27  -6.730  -0.598  -7.278
  205   2HD1  LEU  27          2HD1      LEU  27  -7.963   0.603  -7.662
  206   3HD1  LEU  27          3HD1      LEU  27  -8.430  -1.064  -7.324
  207   1HD2  LEU  27          1HD2      LEU  27  -7.032   1.648  -4.427
  208   2HD2  LEU  27          2HD2      LEU  27  -6.233   1.385  -5.977
  209   3HD2  LEU  27          3HD2      LEU  27  -5.966   0.261  -4.645
  210    H    GLU  28           H        GLU  28 -11.136   0.079  -3.113
  211    HA   GLU  28           HA       GLU  28 -10.071  -2.386  -2.229
  212   1HB   GLU  28          2HB       GLU  28 -11.413  -1.982  -0.181
  213   2HB   GLU  28          1HB       GLU  28 -10.428  -0.608  -0.651
  214   1HG   GLU  28          2HG       GLU  28 -12.239   0.650  -0.518
  215   2HG   GLU  28          1HG       GLU  28 -12.881  -0.214  -1.913
  216    H    TRP  29           H        TRP  29 -13.083  -1.481  -3.681
  217    HA   TRP  29           HA       TRP  29 -14.603  -3.758  -2.915
  218   1HB   TRP  29          2HB       TRP  29 -15.846  -1.911  -3.699
  219   2HB   TRP  29          1HB       TRP  29 -14.806  -1.693  -5.100
  220    HD1  TRP  29           HD       TRP  29 -17.234  -4.437  -3.827
  221    HE1  TRP  29           1HE      TRP  29 -18.571  -5.309  -5.848
  222    HE3  TRP  29           3HE      TRP  29 -15.044  -1.646  -7.498
  223    HZ2  TRP  29           2HZ      TRP  29 -18.672  -4.872  -8.637
  224    HZ3  TRP  29           3HZ      TRP  29 -15.815  -1.931  -9.817
  225    HH2  TRP  29           HH       TRP  29 -17.591  -3.513 -10.374
  226    H    MET  30           H        MET  30 -12.836  -2.935  -5.863
  227    HA   MET  30           HA       MET  30 -13.226  -5.306  -7.267
  228   1HB   MET  30          2HB       MET  30 -10.789  -3.511  -7.288
  229   2HB   MET  30          1HB       MET  30 -11.187  -4.706  -8.510
  230   1HG   MET  30          2HG       MET  30 -13.460  -3.222  -8.454
  231   2HG   MET  30          1HG       MET  30 -12.231  -2.007  -8.104
  232   1HE   MET  30          1HE       MET  30  -9.814  -3.175  -9.380
  233   2HE   MET  30          2HE       MET  30 -10.032  -1.567 -10.069
  234   3HE   MET  30          3HE       MET  30  -9.762  -2.950 -11.129
  235    H    VAL  31           H        VAL  31 -10.526  -4.445  -5.067
  236    HA   VAL  31           HA       VAL  31  -9.181  -6.906  -5.261
  237    HB   VAL  31           HB       VAL  31  -8.197  -6.376  -3.047
  238   1HG1  VAL  31          1HG1      VAL  31  -7.723  -3.791  -4.017
  239   2HG1  VAL  31          2HG1      VAL  31  -8.043  -4.790  -5.436
  240   3HG1  VAL  31          3HG1      VAL  31  -6.762  -5.241  -4.311
  241   1HG2  VAL  31          1HG2      VAL  31 -10.074  -5.365  -1.949
  242   2HG2  VAL  31          2HG2      VAL  31 -10.100  -4.056  -3.130
  243   3HG2  VAL  31          3HG2      VAL  31  -8.749  -4.201  -2.008
  244    H    GLN  32           H        GLN  32 -11.698  -5.772  -3.056
  245    HA   GLN  32           HA       GLN  32 -11.913  -8.036  -1.432
  246   1HB   GLN  32          2HB       GLN  32 -13.512  -5.670  -2.034
  247   2HB   GLN  32          1HB       GLN  32 -14.514  -7.071  -1.694
  248   1HG   GLN  32          2HG       GLN  32 -12.478  -7.013   0.257
  249   2HG   GLN  32          1HG       GLN  32 -13.114  -5.377   0.115
  250   1HE2  GLN  32          1HE2      GLN  32 -14.547  -5.035   1.645
  251   2HE2  GLN  32          2HE2      GLN  32 -15.778  -6.134   2.156
  252    H    LEU  33           H        LEU  33 -13.128  -7.303  -4.605
  253    HA   LEU  33           HA       LEU  33 -14.901  -9.508  -4.859
  254   1HB   LEU  33          2HB       LEU  33 -13.954  -7.294  -6.473
  255   2HB   LEU  33          1HB       LEU  33 -14.068  -8.758  -7.424
  256    HG   LEU  33           HG       LEU  33 -16.137  -7.640  -7.676
  257   1HD1  LEU  33          1HD1      LEU  33 -17.048  -9.458  -5.544
  258   2HD1  LEU  33          2HD1      LEU  33 -16.029 -10.175  -6.792
  259   3HD1  LEU  33          3HD1      LEU  33 -17.529  -9.360  -7.238
  260   1HD2  LEU  33          1HD2      LEU  33 -16.138  -7.364  -4.676
  261   2HD2  LEU  33          2HD2      LEU  33 -17.504  -6.966  -5.718
  262   3HD2  LEU  33          3HD2      LEU  33 -15.991  -6.072  -5.867
  263    H    CYS  34           H        CYS  34 -11.491  -9.149  -5.114
  264    HA   CYS  34           HA       CYS  34 -11.167 -11.595  -6.664
  265   1HB   CYS  34          2HB       CYS  34  -9.380  -9.357  -5.837
  266   2HB   CYS  34          1HB       CYS  34  -8.647 -10.921  -6.166
  267    HG   CYS  34           HG       CYS  34 -10.176  -9.247  -8.293
  268    H    GLY  35           H        GLY  35 -11.643 -10.883  -3.464
  269   1HA   GLY  35          2HA       GLY  35 -11.694 -12.825  -1.972
  270   2HA   GLY  35          1HA       GLY  35 -10.140 -13.289  -2.644
  271    H    ALA  36           H        ALA  36  -9.479 -10.271  -2.540
  272    HA   ALA  36           HA       ALA  36  -8.105 -10.384  -0.044
  273   1HB   ALA  36          1HB       ALA  36  -7.113  -9.268  -1.947
  274   2HB   ALA  36          2HB       ALA  36  -7.330  -8.124  -0.623
  275   3HB   ALA  36          3HB       ALA  36  -8.443  -8.111  -1.992
  276    H    SER  37           H        SER  37  -8.164  -8.228   1.295
  277    HA   SER  37           HA       SER  37 -10.960  -7.505   1.844
  278   1HB   SER  37          2HB       SER  37  -9.344  -9.122   3.497
  279   2HB   SER  37          1HB       SER  37  -9.419  -7.545   4.283
  280    HG   SER  37           HG       SER  37 -11.727  -8.860   3.313
  281    H    VAL  38           H        VAL  38 -11.311  -5.397   2.376
  282    HA   VAL  38           HA       VAL  38  -9.259  -3.521   1.750
  283    HB   VAL  38           HB       VAL  38 -11.645  -3.101   1.270
  284   1HG1  VAL  38          1HG1      VAL  38 -13.241  -2.635   2.926
  285   2HG1  VAL  38          2HG1      VAL  38 -12.017  -2.528   4.194
  286   3HG1  VAL  38          3HG1      VAL  38 -12.415  -4.092   3.481
  287   1HG2  VAL  38          1HG2      VAL  38 -10.794  -0.954   3.163
  288   2HG2  VAL  38          2HG2      VAL  38 -11.511  -0.816   1.557
  289   3HG2  VAL  38          3HG2      VAL  38  -9.822  -1.294   1.731
  290    H    VAL  39           H        VAL  39  -7.751  -2.717   3.051
  291    HA   VAL  39           HA       VAL  39  -7.972  -3.166   5.929
  292    HB   VAL  39           HB       VAL  39  -5.581  -1.926   4.626
  293   1HG1  VAL  39          1HG1      VAL  39  -5.660  -3.967   6.817
  294   2HG1  VAL  39          2HG1      VAL  39  -5.895  -2.248   7.137
  295   3HG1  VAL  39          3HG1      VAL  39  -4.385  -2.813   6.421
  296   1HG2  VAL  39          1HG2      VAL  39  -4.983  -4.610   4.683
  297   2HG2  VAL  39          2HG2      VAL  39  -5.370  -3.670   3.242
  298   3HG2  VAL  39          3HG2      VAL  39  -6.633  -4.584   4.065
  299    H    LYS  40           H        LYS  40  -8.336  -1.595   7.373
  300    HA   LYS  40           HA       LYS  40  -9.178   0.967   6.546
  301   1HB   LYS  40          2HB       LYS  40  -9.562  -0.492   8.778
  302   2HB   LYS  40          1HB       LYS  40  -8.327   0.615   9.362
  303   1HG   LYS  40          2HG       LYS  40 -10.385   1.606   9.903
  304   2HG   LYS  40          1HG       LYS  40  -9.785   2.491   8.499
  305   1HD   LYS  40          2HD       LYS  40 -11.276   1.344   7.039
  306   2HD   LYS  40          1HD       LYS  40 -11.722   0.193   8.300
  307   1HE   LYS  40          2HE       LYS  40 -13.506   1.560   8.517
  308   2HE   LYS  40          1HE       LYS  40 -12.392   2.485   9.524
  309   1HZ   LYS  40          1HZ       LYS  40 -13.741   3.531   7.490
  310   2HZ   LYS  40          2HZ       LYS  40 -12.327   3.079   6.681
  311   3HZ   LYS  40          3HZ       LYS  40 -12.244   4.123   8.009
  312    H    GLU  41           H        GLU  41  -6.187  -0.192   8.016
  313    HA   GLU  41           HA       GLU  41  -4.808   2.169   7.019
  314   1HB   GLU  41          2HB       GLU  41  -5.119   1.484   9.915
  315   2HB   GLU  41          1HB       GLU  41  -3.626   2.231   9.364
  316   1HG   GLU  41          2HG       GLU  41  -6.260   3.447   8.662
  317   2HG   GLU  41          1HG       GLU  41  -5.550   3.711  10.254
  318    H    LEU  42           H        LEU  42  -2.351   1.914   7.813
  319    HA   LEU  42           HA       LEU  42  -1.429  -0.471   6.561
  320   1HB   LEU  42          2HB       LEU  42   0.146   1.557   8.147
  321   2HB   LEU  42          1HB       LEU  42   0.805   0.374   7.034
  322    HG   LEU  42           HG       LEU  42  -1.098   2.547   6.173
  323   1HD1  LEU  42          1HD1      LEU  42   0.677   3.935   5.618
  324   2HD1  LEU  42          2HD1      LEU  42   1.861   2.635   5.740
  325   3HD1  LEU  42          3HD1      LEU  42   1.138   3.309   7.200
  326   1HD2  LEU  42          1HD2      LEU  42   0.815   0.809   4.619
  327   2HD2  LEU  42          2HD2      LEU  42  -0.271   2.029   3.952
  328   3HD2  LEU  42          3HD2      LEU  42  -0.932   0.580   4.711
  329    H    SER  43           H        SER  43  -1.538   0.675   9.903
  330    HA   SER  43           HA       SER  43  -0.149  -1.574  10.976
  331   1HB   SER  43          2HB       SER  43  -0.148   0.520  12.192
  332   2HB   SER  43          1HB       SER  43  -1.909   0.500  12.302
  333    HG   SER  43           HG       SER  43  -0.216  -0.513  14.013
  334    H    SER  44           H        SER  44  -3.248  -1.254   9.725
  335    HA   SER  44           HA       SER  44  -4.656  -2.964  11.528
  336   1HB   SER  44          2HB       SER  44  -5.214  -1.661   8.923
  337   2HB   SER  44          1HB       SER  44  -6.145  -3.114   9.290
  338    HG   SER  44           HG       SER  44  -5.904  -0.860  10.998
  339    H    PHE  45           H        PHE  45  -2.448  -3.511   8.959
  340    HA   PHE  45           HA       PHE  45  -3.277  -5.926   7.895
  341   1HB   PHE  45          2HB       PHE  45  -0.506  -4.862   8.438
  342   2HB   PHE  45          1HB       PHE  45  -0.790  -6.372   7.578
  343    HD1  PHE  45           1HD      PHE  45   0.219  -3.274   6.951
  344    HD2  PHE  45           2HD      PHE  45  -2.986  -5.840   5.830
  345    HE1  PHE  45           1HE      PHE  45  -0.050  -2.017   4.853
  346    HE2  PHE  45           2HE      PHE  45  -3.257  -4.588   3.728
  347    HZ   PHE  45           HZ       PHE  45  -1.788  -2.673   3.241
  348    H    THR  46           H        THR  46  -3.850  -7.720   8.915
  349    HA   THR  46           HA       THR  46  -2.406  -8.478  11.367
  350    HB   THR  46           HB       THR  46  -4.519 -10.002  11.623
  351    HG1  THR  46           1HG      THR  46  -5.710  -9.709   9.886
  352   1HG2  THR  46          1HG2      THR  46  -3.857  -7.767  12.858
  353   2HG2  THR  46          2HG2      THR  46  -5.435  -8.523  13.076
  354   3HG2  THR  46          3HG2      THR  46  -5.255  -7.156  11.976
  355    H    LEU  47           H        LEU  47  -1.210 -10.267  11.355
  356    HA   LEU  47           HA       LEU  47  -1.263 -11.959   8.973
  357   1HB   LEU  47          2HB       LEU  47   0.810 -10.900  10.421
  358   2HB   LEU  47          1HB       LEU  47   0.736 -12.539  11.038
  359    HG   LEU  47           HG       LEU  47   0.667 -13.093   8.422
  360   1HD1  LEU  47          1HD1      LEU  47   2.641 -10.908   8.282
  361   2HD1  LEU  47          2HD1      LEU  47   0.945 -10.427   8.235
  362   3HD1  LEU  47          3HD1      LEU  47   1.572 -11.560   7.039
  363   1HD2  LEU  47          1HD2      LEU  47   2.841 -12.775  10.396
  364   2HD2  LEU  47          2HD2      LEU  47   3.326 -12.963   8.712
  365   3HD2  LEU  47          3HD2      LEU  47   2.331 -14.197   9.485
  366    H    GLY  48           H        GLY  48  -2.143 -13.922   8.968
  367   1HA   GLY  48          2HA       GLY  48  -2.354 -15.410  11.484
  368   2HA   GLY  48          1HA       GLY  48  -3.835 -15.074  10.602
  369    H    THR  49           H        THR  49  -0.827 -15.704   8.953
  370    HA   THR  49           HA       THR  49  -0.172 -17.363   7.541
  371    HB   THR  49           HB       THR  49  -1.838 -19.403   8.922
  372    HG1  THR  49           1HG      THR  49  -1.264 -18.611  10.782
  373   1HG2  THR  49          1HG2      THR  49   0.776 -20.167   9.092
  374   2HG2  THR  49          2HG2      THR  49   0.735 -19.275   7.570
  375   3HG2  THR  49          3HG2      THR  49  -0.353 -20.639   7.822
  376    H    GLY  50           H        GLY  50  -2.471 -15.850   6.827
  377   1HA   GLY  50          2HA       GLY  50  -3.536 -17.593   4.796
  378   2HA   GLY  50          1HA       GLY  50  -4.729 -17.110   5.992
  379    H    VAL  51           H        VAL  51  -3.880 -14.499   6.468
  380    HA   VAL  51           HA       VAL  51  -4.719 -13.235   3.964
  381    HB   VAL  51           HB       VAL  51  -4.534 -11.982   6.707
  382   1HG1  VAL  51          1HG1      VAL  51  -4.687 -10.722   4.324
  383   2HG1  VAL  51          2HG1      VAL  51  -5.372 -10.089   5.820
  384   3HG1  VAL  51          3HG1      VAL  51  -6.399 -10.954   4.677
  385   1HG2  VAL  51          1HG2      VAL  51  -6.242 -13.996   6.051
  386   2HG2  VAL  51          2HG2      VAL  51  -7.187 -12.576   5.605
  387   3HG2  VAL  51          3HG2      VAL  51  -6.576 -12.746   7.250
  388    H    HIS  52           H        HIS  52  -3.236 -12.338   2.702
  389    HA   HIS  52           HA       HIS  52  -0.615 -11.675   3.800
  390   1HB   HIS  52          2HB       HIS  52  -1.486 -11.597   0.908
  391   2HB   HIS  52          1HB       HIS  52   0.161 -11.608   1.528
  392    HD1  HIS  52           1HD      HIS  52   1.024 -13.890   2.526
  393    HD2  HIS  52           2HD      HIS  52  -2.660 -14.079   0.613
  394    HE1  HIS  52           1HE      HIS  52   0.593 -16.337   2.136
  395    HE2  HIS  52           2HE      HIS  52  -1.600 -16.420   0.899
  396    HA   PRO  53           HA       PRO  53  -1.807  -7.367   3.829
  397   1HB   PRO  53          2HB       PRO  53   0.478  -6.352   4.802
  398   2HB   PRO  53          1HB       PRO  53  -0.618  -7.303   5.812
  399   1HG   PRO  53          2HG       PRO  53   1.914  -8.140   4.454
  400   2HG   PRO  53          1HG       PRO  53   1.343  -8.520   6.090
  401   1HD   PRO  53          2HD       PRO  53   1.115 -10.228   3.957
  402   2HD   PRO  53          1HD       PRO  53   0.026 -10.245   5.359
  403    H    ILE  54           H        ILE  54  -1.828  -5.941   2.221
  404    HA   ILE  54           HA       ILE  54   0.581  -5.531   0.598
  405    HB   ILE  54           HB       ILE  54  -2.105  -5.688  -0.737
  406   1HG1  ILE  54          2HG1      ILE  54  -1.714  -7.871   0.345
  407   2HG1  ILE  54          1HG1      ILE  54  -1.625  -7.985  -1.410
  408   1HG2  ILE  54          1HG2      ILE  54  -0.909  -4.983  -2.464
  409   2HG2  ILE  54          2HG2      ILE  54  -0.020  -6.505  -2.424
  410   3HG2  ILE  54          3HG2      ILE  54   0.586  -5.106  -1.538
  411   1HD1  ILE  54          1HD1      ILE  54   0.421  -8.810  -1.304
  412   2HD1  ILE  54          2HD1      ILE  54   0.243  -8.880   0.449
  413   3HD1  ILE  54          3HD1      ILE  54   0.973  -7.464  -0.307
  414    H    VAL  55           H        VAL  55   0.757  -3.463  -0.316
  415    HA   VAL  55           HA       VAL  55  -1.271  -1.520   0.586
  416    HB   VAL  55           HB       VAL  55   1.698  -1.000   0.385
  417   1HG1  VAL  55          1HG1      VAL  55   0.844   0.997   1.874
  418   2HG1  VAL  55          2HG1      VAL  55  -0.674   0.675   1.037
  419   3HG1  VAL  55          3HG1      VAL  55   0.773   1.077   0.113
  420   1HG2  VAL  55          1HG2      VAL  55   1.979  -1.595   2.524
  421   2HG2  VAL  55          2HG2      VAL  55   0.463  -2.475   2.336
  422   3HG2  VAL  55          3HG2      VAL  55   0.461  -0.852   3.026
  423    H    VAL  56           H        VAL  56  -1.636   0.295  -0.754
  424    HA   VAL  56           HA       VAL  56  -0.521   0.083  -3.469
  425    HB   VAL  56           HB       VAL  56  -3.382   0.820  -2.905
  426   1HG1  VAL  56          1HG1      VAL  56  -1.964   1.409  -5.089
  427   2HG1  VAL  56          2HG1      VAL  56  -3.683   1.020  -5.141
  428   3HG1  VAL  56          3HG1      VAL  56  -2.488  -0.218  -5.524
  429   1HG2  VAL  56          1HG2      VAL  56  -3.850  -1.470  -3.930
  430   2HG2  VAL  56          2HG2      VAL  56  -3.299  -1.423  -2.255
  431   3HG2  VAL  56          3HG2      VAL  56  -2.170  -1.846  -3.542
  432    H    VAL  57           H        VAL  57  -0.159   2.002  -4.555
  433    HA   VAL  57           HA       VAL  57  -0.770   4.496  -3.127
  434    HB   VAL  57           HB       VAL  57   1.544   5.297  -3.937
  435   1HG1  VAL  57          1HG1      VAL  57   1.062   3.440  -1.631
  436   2HG1  VAL  57          2HG1      VAL  57   1.183   5.199  -1.629
  437   3HG1  VAL  57          3HG1      VAL  57   2.625   4.216  -1.880
  438   1HG2  VAL  57          1HG2      VAL  57   3.239   3.441  -3.933
  439   2HG2  VAL  57          2HG2      VAL  57   2.187   3.496  -5.347
  440   3HG2  VAL  57          3HG2      VAL  57   1.893   2.311  -4.076
  441    H    GLN  58           H        GLN  58   0.132   6.388  -4.688
  442    HA   GLN  58           HA       GLN  58   0.145   6.154  -7.429
  443   1HB   GLN  58          2HB       GLN  58  -2.468   5.675  -6.382
  444   2HB   GLN  58          1HB       GLN  58  -2.499   7.198  -7.257
  445   1HG   GLN  58          2HG       GLN  58  -1.055   5.292  -8.798
  446   2HG   GLN  58          1HG       GLN  58  -2.584   4.576  -8.291
  447   1HE2  GLN  58          1HE2      GLN  58  -1.845   7.953  -8.990
  448   2HE2  GLN  58          2HE2      GLN  58  -2.948   8.110 -10.310
  449    HA   PRO  59           HA       PRO  59   0.809  10.380  -5.664
  450   1HB   PRO  59          2HB       PRO  59   3.260  10.765  -6.724
  451   2HB   PRO  59          1HB       PRO  59   3.015   9.878  -5.216
  452   1HG   PRO  59          2HG       PRO  59   3.458   8.824  -7.983
  453   2HG   PRO  59          1HG       PRO  59   4.164   8.276  -6.451
  454   1HD   PRO  59          2HD       PRO  59   2.068   7.026  -7.654
  455   2HD   PRO  59          1HD       PRO  59   2.310   7.038  -5.896
  456    H    ASP  60           H        ASP  60  -0.889  11.042  -7.118
  457    HA   ASP  60           HA       ASP  60   0.158  12.440  -9.441
  458   1HB   ASP  60          2HB       ASP  60  -0.767  10.085 -10.068
  459   2HB   ASP  60          1HB       ASP  60  -2.344  10.830  -9.822
  460    H    ALA  61           H        ALA  61  -2.809  11.641  -7.674
  461    HA   ALA  61           HA       ALA  61  -3.759  14.385  -8.074
  462   1HB   ALA  61          1HB       ALA  61  -5.924  13.627  -7.677
  463   2HB   ALA  61          2HB       ALA  61  -5.368  12.195  -6.811
  464   3HB   ALA  61          3HB       ALA  61  -5.180  12.296  -8.562
  465    H    TRP  62           H        TRP  62  -1.608  13.829  -6.232
  466    HA   TRP  62           HA       TRP  62  -2.739  13.945  -3.573
  467   1HB   TRP  62          2HB       TRP  62  -0.073  13.604  -4.747
  468   2HB   TRP  62          1HB       TRP  62  -0.080  14.600  -3.295
  469    HD1  TRP  62           HD       TRP  62  -2.292  11.489  -3.914
  470    HE1  TRP  62           1HE      TRP  62  -1.770   9.761  -2.080
  471    HE3  TRP  62           3HE      TRP  62   1.549  13.923  -1.574
  472    HZ2  TRP  62           2HZ      TRP  62   0.032   9.468   0.073
  473    HZ3  TRP  62           3HZ      TRP  62   2.616  12.850   0.366
  474    HH2  TRP  62           HH       TRP  62   1.872  10.669   1.171
  475    H    THR  63           H        THR  63  -1.492  16.157  -5.962
  476    HA   THR  63           HA       THR  63  -1.499  18.422  -6.100
  477    HB   THR  63           HB       THR  63  -3.310  18.258  -3.686
  478    HG1  THR  63           1HG      THR  63  -4.957  18.310  -5.164
  479   1HG2  THR  63          1HG2      THR  63  -3.718  20.447  -3.793
  480   2HG2  THR  63          2HG2      THR  63  -3.642  20.477  -5.554
  481   3HG2  THR  63          3HG2      THR  63  -2.156  20.532  -4.606
  482    H    GLU  64           H        GLU  64  -1.740  18.135  -2.578
  483    HA   GLU  64           HA       GLU  64   0.457  19.933  -2.199
  484   1HB   GLU  64          2HB       GLU  64  -1.581  18.653  -0.537
  485   2HB   GLU  64          1HB       GLU  64  -0.019  18.773   0.263
  486   1HG   GLU  64          2HG       GLU  64  -0.318  20.928   0.658
  487   2HG   GLU  64          1HG       GLU  64  -0.653  21.248  -1.042
  488    H    ASP  65           H        ASP  65   2.373  19.426  -0.925
  489    HA   ASP  65           HA       ASP  65   3.323  16.691  -1.457
  490   1HB   ASP  65          2HB       ASP  65   5.011  19.170  -1.077
  491   2HB   ASP  65          1HB       ASP  65   5.561  17.583  -1.608
  492    H    ASN  66           H        ASN  66   2.565  15.817   0.492
  493    HA   ASN  66           HA       ASN  66   3.349  16.974   3.015
  494   1HB   ASN  66          2HB       ASN  66   1.714  14.650   2.135
  495   2HB   ASN  66          1HB       ASN  66   2.433  14.565   3.740
  496   1HD2  ASN  66          1HD2      ASN  66  -0.244  14.552   3.530
  497   2HD2  ASN  66          2HD2      ASN  66  -0.907  16.051   4.076
  498    H    GLY  67           H        GLY  67   4.169  14.037   1.184
  499   1HA   GLY  67          2HA       GLY  67   6.779  13.824   1.363
  500   2HA   GLY  67          1HA       GLY  67   6.369  13.502   3.041
  501    H    PHE  68           H        PHE  68   6.373  12.281  -0.199
  502    HA   PHE  68           HA       PHE  68   5.047   9.810   0.582
  503   1HB   PHE  68          2HB       PHE  68   4.617  10.968  -1.627
  504   2HB   PHE  68          1HB       PHE  68   6.240  10.481  -2.109
  505    HD1  PHE  68           1HD      PHE  68   2.924   9.206  -1.087
  506    HD2  PHE  68           2HD      PHE  68   6.674   8.309  -2.889
  507    HE1  PHE  68           1HE      PHE  68   2.046   7.028  -1.819
  508    HE2  PHE  68           2HE      PHE  68   5.802   6.130  -3.626
  509    HZ   PHE  68           HZ       PHE  68   3.488   5.487  -3.088
  510    H    HIS  69           H        HIS  69   8.016  10.883   1.137
  511    HA   HIS  69           HA       HIS  69   9.486   8.544   0.217
  512   1HB   HIS  69          2HB       HIS  69  10.234  11.177   1.421
  513   2HB   HIS  69          1HB       HIS  69  11.361   9.831   1.556
  514    HD1  HIS  69           1HD      HIS  69  12.884  11.460   0.027
  515    HD2  HIS  69           2HD      HIS  69   9.549   9.782  -1.798
  516    HE1  HIS  69           1HE      HIS  69  13.275  11.707  -2.445
  517    HE2  HIS  69           2HE      HIS  69  11.282  10.610  -3.530
  518    H    ALA  70           H        ALA  70   7.628   7.620   1.862
  519    HA   ALA  70           HA       ALA  70   9.114   6.404   3.948
  520   1HB   ALA  70          1HB       ALA  70   7.468   8.762   4.625
  521   2HB   ALA  70          2HB       ALA  70   8.902   8.108   5.419
  522   3HB   ALA  70          3HB       ALA  70   7.326   7.366   5.694
  523    H    ILE  71           H        ILE  71   7.430   5.647   1.733
  524    HA   ILE  71           HA       ILE  71   4.908   4.740   2.725
  525    HB   ILE  71           HB       ILE  71   6.353   3.696   0.296
  526   1HG1  ILE  71          2HG1      ILE  71   6.289   6.158   0.228
  527   2HG1  ILE  71          1HG1      ILE  71   5.227   5.452  -0.984
  528   1HG2  ILE  71          1HG2      ILE  71   4.186   2.659   1.315
  529   2HG2  ILE  71          2HG2      ILE  71   4.320   2.904  -0.426
  530   3HG2  ILE  71          3HG2      ILE  71   3.402   4.045   0.556
  531   1HD1  ILE  71          1HD1      ILE  71   4.412   7.457   0.430
  532   2HD1  ILE  71          2HD1      ILE  71   4.132   6.241   1.675
  533   3HD1  ILE  71          3HD1      ILE  71   3.316   6.112   0.117
  534    H    GLY  72           H        GLY  72   7.917   3.053   1.814
  535   1HA   GLY  72          2HA       GLY  72   7.013   0.571   2.961
  536   2HA   GLY  72          1HA       GLY  72   8.604   0.891   2.286
  537    H    GLN  73           H        GLN  73   8.701   3.342   4.124
  538    HA   GLN  73           HA       GLN  73   9.951   1.955   6.330
  539   1HB   GLN  73          2HB       GLN  73  10.001   4.670   5.202
  540   2HB   GLN  73          1HB       GLN  73  10.111   4.615   6.957
  541   1HG   GLN  73          2HG       GLN  73  12.292   4.325   6.653
  542   2HG   GLN  73          1HG       GLN  73  11.885   2.673   6.188
  543   1HE2  GLN  73          1HE2      GLN  73  10.936   2.776   3.759
  544   2HE2  GLN  73          2HE2      GLN  73  12.043   3.498   2.646
  545    H    MET  74           H        MET  74   6.915   3.377   5.667
  546    HA   MET  74           HA       MET  74   6.289   3.793   8.486
  547   1HB   MET  74          2HB       MET  74   5.546   5.497   6.904
  548   2HB   MET  74          1HB       MET  74   4.659   4.288   5.986
  549   1HG   MET  74          2HG       MET  74   3.024   4.066   7.612
  550   2HG   MET  74          1HG       MET  74   4.044   4.758   8.871
  551   1HE   MET  74          1HE       MET  74   2.292   7.288   5.433
  552   2HE   MET  74          2HE       MET  74   1.918   5.574   5.616
  553   3HE   MET  74          3HE       MET  74   3.567   6.083   5.246
  554    H    CYS  75           H        CYS  75   5.776   1.515   5.925
  555    HA   CYS  75           HA       CYS  75   4.207  -0.145   7.772
  556   1HB   CYS  75          2HB       CYS  75   2.667   0.851   6.126
  557   2HB   CYS  75          1HB       CYS  75   3.638   0.184   4.819
  558    HG   CYS  75           HG       CYS  75   2.886  -2.202   5.574
  559    H    GLU  76           H        GLU  76   4.350  -2.438   7.361
  560    HA   GLU  76           HA       GLU  76   6.915  -3.154   6.124
  561   1HB   GLU  76          2HB       GLU  76   5.357  -4.187   8.424
  562   2HB   GLU  76          1HB       GLU  76   6.221  -5.385   7.470
  563   1HG   GLU  76          2HG       GLU  76   8.216  -4.747   8.246
  564   2HG   GLU  76          1HG       GLU  76   7.814  -3.032   8.158
  565    H    ALA  77           H        ALA  77   4.520  -2.714   4.558
  566    HA   ALA  77           HA       ALA  77   4.166  -5.432   3.475
  567   1HB   ALA  77          1HB       ALA  77   2.173  -3.762   4.507
  568   2HB   ALA  77          2HB       ALA  77   1.955  -5.252   3.591
  569   3HB   ALA  77          3HB       ALA  77   1.986  -3.700   2.754
  570    HA   PRO  78           HA       PRO  78   5.422  -3.833  -0.439
  571   1HB   PRO  78          2HB       PRO  78   3.998  -5.280  -2.191
  572   2HB   PRO  78          1HB       PRO  78   5.216  -6.027  -1.149
  573   1HG   PRO  78          2HG       PRO  78   2.239  -5.959  -0.835
  574   2HG   PRO  78          1HG       PRO  78   3.358  -7.312  -0.592
  575   1HD   PRO  78          2HD       PRO  78   2.357  -5.781   1.445
  576   2HD   PRO  78          1HD       PRO  78   3.912  -6.631   1.524
  577    H    VAL  79           H        VAL  79   4.991  -1.871  -1.211
  578    HA   VAL  79           HA       VAL  79   2.220  -1.003  -1.547
  579    HB   VAL  79           HB       VAL  79   4.683   0.684  -1.962
  580   1HG1  VAL  79          1HG1      VAL  79   2.281   1.917  -0.876
  581   2HG1  VAL  79          2HG1      VAL  79   2.024   1.181  -2.458
  582   3HG1  VAL  79          3HG1      VAL  79   3.284   2.396  -2.244
  583   1HG2  VAL  79          1HG2      VAL  79   4.979   1.034   0.244
  584   2HG2  VAL  79          2HG2      VAL  79   4.191  -0.536   0.408
  585   3HG2  VAL  79          3HG2      VAL  79   3.253   0.944   0.595
  586    H    VAL  80           H        VAL  80   1.264  -1.102  -3.502
  587    HA   VAL  80           HA       VAL  80   2.953  -0.774  -5.891
  588    HB   VAL  80           HB       VAL  80   1.729  -2.577  -7.048
  589   1HG1  VAL  80          1HG1      VAL  80   2.793  -4.476  -5.845
  590   2HG1  VAL  80          2HG1      VAL  80   3.182  -3.369  -4.530
  591   3HG1  VAL  80          3HG1      VAL  80   3.875  -3.116  -6.133
  592   1HG2  VAL  80          1HG2      VAL  80   0.403  -4.179  -5.742
  593   2HG2  VAL  80          2HG2      VAL  80  -0.315  -2.567  -5.730
  594   3HG2  VAL  80          3HG2      VAL  80   0.572  -3.148  -4.320
  595    H    THR  81           H        THR  81   2.050   0.448  -7.477
  596    HA   THR  81           HA       THR  81  -0.100   2.112  -7.016
  597    HB   THR  81           HB       THR  81   0.032   2.778  -9.272
  598    HG1  THR  81           1HG      THR  81   0.758   0.112  -9.734
  599   1HG2  THR  81          1HG2      THR  81   2.282   3.103  -9.735
  600   2HG2  THR  81          2HG2      THR  81   2.755   1.577  -8.986
  601   3HG2  THR  81          3HG2      THR  81   2.230   2.928  -7.981
  602    H    ARG  82           H        ARG  82  -2.142   2.189  -8.445
  603    HA   ARG  82           HA       ARG  82  -3.751  -0.021  -7.778
  604   1HB   ARG  82          2HB       ARG  82  -5.414   1.099  -9.380
  605   2HB   ARG  82          1HB       ARG  82  -4.896   2.004  -7.964
  606   1HG   ARG  82          2HG       ARG  82  -4.069   3.640  -9.214
  607   2HG   ARG  82          1HG       ARG  82  -3.166   2.512 -10.217
  608   1HD   ARG  82          2HD       ARG  82  -6.059   2.515 -10.688
  609   2HD   ARG  82          1HD       ARG  82  -5.256   4.037 -11.069
  610    HE   ARG  82           HE       ARG  82  -3.690   2.178 -12.267
  611   1HH1  ARG  82          1HH1      ARG  82  -7.108   2.873 -12.375
  612   2HH1  ARG  82          2HH1      ARG  82  -7.297   2.318 -14.004
  613   1HH2  ARG  82          1HH2      ARG  82  -3.936   1.445 -14.411
  614   2HH2  ARG  82          2HH2      ARG  82  -5.496   1.506 -15.161
  615    H    GLU  83           H        GLU  83  -1.639   0.465 -10.417
  616    HA   GLU  83           HA       GLU  83  -2.837  -0.847 -12.522
  617   1HB   GLU  83          2HB       GLU  83  -0.343   0.138 -12.052
  618   2HB   GLU  83          1HB       GLU  83  -0.017  -1.590 -12.070
  619   1HG   GLU  83          2HG       GLU  83   0.018  -1.532 -14.276
  620   2HG   GLU  83          1HG       GLU  83  -1.684  -1.069 -14.272
  621    H    TRP  84           H        TRP  84  -1.181  -2.249  -9.731
  622    HA   TRP  84           HA       TRP  84  -1.254  -4.940 -10.513
  623   1HB   TRP  84          2HB       TRP  84   0.036  -4.134  -8.581
  624   2HB   TRP  84          1HB       TRP  84  -1.453  -3.751  -7.736
  625    HD1  TRP  84           HD       TRP  84   0.508  -6.830  -9.008
  626    HE1  TRP  84           1HE      TRP  84  -0.157  -8.850  -7.555
  627    HE3  TRP  84           3HE      TRP  84  -3.158  -4.641  -6.197
  628    HZ2  TRP  84           2HZ      TRP  84  -1.994  -9.437  -5.489
  629    HZ3  TRP  84           3HZ      TRP  84  -4.319  -5.999  -4.508
  630    HH2  TRP  84           HH       TRP  84  -3.751  -8.344  -4.161
  631    H    VAL  85           H        VAL  85  -3.411  -3.167  -8.363
  632    HA   VAL  85           HA       VAL  85  -5.355  -5.111  -7.996
  633    HB   VAL  85           HB       VAL  85  -5.766  -2.120  -8.096
  634   1HG1  VAL  85          1HG1      VAL  85  -7.925  -2.837  -8.045
  635   2HG1  VAL  85          2HG1      VAL  85  -7.568  -2.921  -6.320
  636   3HG1  VAL  85          3HG1      VAL  85  -7.511  -4.383  -7.304
  637   1HG2  VAL  85          1HG2      VAL  85  -5.057  -3.943  -5.802
  638   2HG2  VAL  85          2HG2      VAL  85  -5.492  -2.241  -5.644
  639   3HG2  VAL  85          3HG2      VAL  85  -4.030  -2.700  -6.519
  640    H    LEU  86           H        LEU  86  -5.120  -2.634 -10.513
  641    HA   LEU  86           HA       LEU  86  -7.591  -3.296 -11.753
  642   1HB   LEU  86          2HB       LEU  86  -5.459  -1.408 -12.144
  643   2HB   LEU  86          1HB       LEU  86  -5.880  -2.142 -13.679
  644    HG   LEU  86           HG       LEU  86  -7.138  -0.101 -13.378
  645   1HD1  LEU  86          1HD1      LEU  86  -9.284  -2.051 -12.848
  646   2HD1  LEU  86          2HD1      LEU  86  -8.182  -2.451 -14.166
  647   3HD1  LEU  86          3HD1      LEU  86  -9.070  -0.929 -14.192
  648   1HD2  LEU  86          1HD2      LEU  86  -8.765   0.124 -11.543
  649   2HD2  LEU  86          2HD2      LEU  86  -7.102   0.044 -10.960
  650   3HD2  LEU  86          3HD2      LEU  86  -8.150  -1.370 -10.835
  651    H    ASP  87           H        ASP  87  -4.219  -4.129 -12.462
  652    HA   ASP  87           HA       ASP  87  -4.753  -5.665 -14.765
  653   1HB   ASP  87          2HB       ASP  87  -2.509  -4.776 -14.123
  654   2HB   ASP  87          1HB       ASP  87  -2.441  -5.975 -12.836
  655    H    SER  88           H        SER  88  -4.776  -6.404 -11.345
  656    HA   SER  88           HA       SER  88  -4.941  -9.246 -11.705
  657   1HB   SER  88          2HB       SER  88  -5.412  -7.474  -9.301
  658   2HB   SER  88          1HB       SER  88  -5.520  -9.234  -9.251
  659    HG   SER  88           HG       SER  88  -3.334  -7.659  -9.179
  660    H    VAL  89           H        VAL  89  -7.266  -6.685 -10.852
  661    HA   VAL  89           HA       VAL  89  -9.490  -8.458 -10.696
  662    HB   VAL  89           HB       VAL  89  -9.529  -5.469 -11.131
  663   1HG1  VAL  89          1HG1      VAL  89 -11.617  -7.265 -11.244
  664   2HG1  VAL  89          2HG1      VAL  89 -11.754  -5.535 -10.928
  665   3HG1  VAL  89          3HG1      VAL  89 -11.681  -6.674  -9.583
  666   1HG2  VAL  89          1HG2      VAL  89  -9.163  -5.119  -8.933
  667   2HG2  VAL  89          2HG2      VAL  89  -8.350  -6.681  -9.031
  668   3HG2  VAL  89          3HG2      VAL  89 -10.012  -6.588  -8.448
  669    H    ALA  90           H        ALA  90  -8.011  -6.620 -13.275
  670    HA   ALA  90           HA       ALA  90 -10.168  -6.742 -15.107
  671   1HB   ALA  90          1HB       ALA  90  -7.227  -6.503 -15.723
  672   2HB   ALA  90          2HB       ALA  90  -8.283  -5.157 -15.293
  673   3HB   ALA  90          3HB       ALA  90  -8.570  -6.061 -16.779
  674    H    LEU  91           H        LEU  91  -7.142  -8.627 -14.980
  675    HA   LEU  91           HA       LEU  91  -8.237 -10.569 -16.838
  676   1HB   LEU  91          2HB       LEU  91  -5.925  -9.872 -17.098
  677   2HB   LEU  91          1HB       LEU  91  -5.557 -10.394 -15.464
  678    HG   LEU  91           HG       LEU  91  -6.164 -12.741 -16.200
  679   1HD1  LEU  91          1HD1      LEU  91  -6.362 -11.291 -18.799
  680   2HD1  LEU  91          2HD1      LEU  91  -7.385 -12.568 -18.142
  681   3HD1  LEU  91          3HD1      LEU  91  -5.784 -12.957 -18.770
  682   1HD2  LEU  91          1HD2      LEU  91  -3.810 -11.452 -16.198
  683   2HD2  LEU  91          2HD2      LEU  91  -3.900 -11.910 -17.898
  684   3HD2  LEU  91          3HD2      LEU  91  -3.989 -13.149 -16.646
  685    H    TYR  92           H        TYR  92  -8.034 -10.157 -13.458
  686    HA   TYR  92           HA       TYR  92  -8.708 -11.449 -11.713
  687   1HB   TYR  92          2HB       TYR  92 -10.161 -12.463 -13.941
  688   2HB   TYR  92          1HB       TYR  92  -9.627 -13.840 -12.985
  689    HD1  TYR  92           1HD      TYR  92 -12.470 -12.485 -13.497
  690    HD2  TYR  92           2HD      TYR  92  -9.713 -12.536 -10.252
  691    HE1  TYR  92           1HE      TYR  92 -14.321 -12.099 -11.924
  692    HE2  TYR  92           2HE      TYR  92 -11.557 -12.150  -8.675
  693    HH   TYR  92           HH       TYR  92 -14.195 -10.941  -9.182
  694    H    GLN  93           H        GLN  93  -6.399 -11.626 -11.323
  695    HA   GLN  93           HA       GLN  93  -5.585 -14.216 -10.706
  696   1HB   GLN  93          2HB       GLN  93  -5.286 -13.808 -13.408
  697   2HB   GLN  93          1HB       GLN  93  -3.690 -13.400 -12.794
  698   1HG   GLN  93          2HG       GLN  93  -4.821 -15.868 -11.698
  699   2HG   GLN  93          1HG       GLN  93  -4.522 -15.900 -13.435
  700   1HE2  GLN  93          1HE2      GLN  93  -2.295 -14.571 -13.831
  701   2HE2  GLN  93          2HE2      GLN  93  -0.969 -15.242 -12.950
  702    H    CYS  94           H        CYS  94  -3.943 -14.146  -9.262
  703    HA   CYS  94           HA       CYS  94  -3.110 -11.701  -8.197
  704   1HB   CYS  94          2HB       CYS  94  -3.079 -14.133  -7.206
  705   2HB   CYS  94          1HB       CYS  94  -1.440 -14.163  -7.846
  706    HG   CYS  94           HG       CYS  94  -1.883 -11.745  -6.087
  707    H    GLN  95           H        GLN  95  -2.242 -10.369  -9.777
  708    HA   GLN  95           HA       GLN  95  -0.068 -11.189 -11.447
  709   1HB   GLN  95          2HB       GLN  95  -0.870  -8.347 -10.837
  710   2HB   GLN  95          1HB       GLN  95  -0.063  -8.957 -12.275
  711   1HG   GLN  95          2HG       GLN  95  -2.898  -9.552 -11.463
  712   2HG   GLN  95          1HG       GLN  95  -2.395  -8.412 -12.709
  713   1HE2  GLN  95          1HE2      GLN  95  -0.481  -9.752 -14.046
  714   2HE2  GLN  95          2HE2      GLN  95  -1.133 -11.172 -14.782
  715    H    GLU  96           H        GLU  96   2.056 -10.139 -11.444
  716    HA   GLU  96           HA       GLU  96   3.294 -10.327  -8.900
  717   1HB   GLU  96          2HB       GLU  96   5.300  -9.351 -10.184
  718   2HB   GLU  96          1HB       GLU  96   4.681 -10.915 -10.690
  719   1HG   GLU  96          2HG       GLU  96   3.504  -8.593 -12.053
  720   2HG   GLU  96          1HG       GLU  96   5.216  -8.876 -12.363
  721    H    LEU  97           H        LEU  97   3.987  -8.783  -7.495
  722    HA   LEU  97           HA       LEU  97   2.798  -6.150  -7.789
  723   1HB   LEU  97          2HB       LEU  97   3.947  -7.744  -5.562
  724   2HB   LEU  97          1HB       LEU  97   4.008  -5.998  -5.413
  725    HG   LEU  97           HG       LEU  97   1.419  -6.304  -6.101
  726   1HD1  LEU  97          1HD1      LEU  97   1.821  -8.819  -6.078
  727   2HD1  LEU  97          2HD1      LEU  97   0.439  -8.214  -5.164
  728   3HD1  LEU  97          3HD1      LEU  97   1.921  -8.669  -4.322
  729   1HD2  LEU  97          1HD2      LEU  97   1.998  -6.758  -3.237
  730   2HD2  LEU  97          2HD2      LEU  97   0.990  -5.537  -4.013
  731   3HD2  LEU  97          3HD2      LEU  97   2.742  -5.345  -3.985
  732    H    ASP  98           H        ASP  98   5.967  -7.632  -7.735
  733    HA   ASP  98           HA       ASP  98   7.576  -5.405  -7.340
  734   1HB   ASP  98          2HB       ASP  98   7.920  -8.060  -8.605
  735   2HB   ASP  98          1HB       ASP  98   9.103  -6.833  -9.046
  736    H    THR  99           H        THR  99   5.653  -6.237 -10.083
  737    HA   THR  99           HA       THR  99   7.112  -4.646 -11.974
  738    HB   THR  99           HB       THR  99   4.336  -5.837 -12.094
  739    HG1  THR  99           1HG      THR  99   6.282  -7.228 -12.025
  740   1HG2  THR  99          1HG2      THR  99   5.958  -4.866 -14.425
  741   2HG2  THR  99          2HG2      THR  99   4.687  -3.909 -13.664
  742   3HG2  THR  99          3HG2      THR  99   4.295  -5.454 -14.419
  743    H    TYR 100           H        TYR 100   4.638  -4.038  -9.632
  744    HA   TYR 100           HA       TYR 100   4.426  -1.280 -10.645
  745   1HB   TYR 100          2HB       TYR 100   2.147  -2.607  -9.207
  746   2HB   TYR 100          1HB       TYR 100   2.122  -1.185 -10.241
  747    HD1  TYR 100           1HD      TYR 100   2.777  -1.619 -12.753
  748    HD2  TYR 100           2HD      TYR 100   1.415  -4.628 -10.071
  749    HE1  TYR 100           1HE      TYR 100   2.111  -3.013 -14.665
  750    HE2  TYR 100           2HE      TYR 100   0.745  -6.031 -11.976
  751    HH   TYR 100           HH       TYR 100   0.062  -5.517 -14.490
  752    H    LEU 101           H        LEU 101   5.993  -2.747  -8.452
  753    HA   LEU 101           HA       LEU 101   4.988  -1.485  -6.043
  754   1HB   LEU 101          2HB       LEU 101   6.494  -3.758  -6.579
  755   2HB   LEU 101          1HB       LEU 101   7.644  -2.645  -5.872
  756    HG   LEU 101           HG       LEU 101   5.094  -2.894  -4.419
  757   1HD1  LEU 101          1HD1      LEU 101   6.023  -5.247  -5.333
  758   2HD1  LEU 101          2HD1      LEU 101   5.209  -5.050  -3.781
  759   3HD1  LEU 101          3HD1      LEU 101   6.971  -5.088  -3.855
  760   1HD2  LEU 101          1HD2      LEU 101   7.944  -2.391  -3.894
  761   2HD2  LEU 101          2HD2      LEU 101   7.084  -3.288  -2.643
  762   3HD2  LEU 101          3HD2      LEU 101   6.509  -1.697  -3.140
  763    H    ILE 102           H        ILE 102   6.779  -0.416  -4.634
  764    HA   ILE 102           HA       ILE 102   8.139   1.583  -6.316
  765    HB   ILE 102           HB       ILE 102   7.326   1.917  -3.430
  766   1HG1  ILE 102          2HG1      ILE 102   5.326   1.631  -4.808
  767   2HG1  ILE 102          1HG1      ILE 102   5.473   3.306  -4.282
  768   1HG2  ILE 102          1HG2      ILE 102   7.517   4.397  -4.371
  769   2HG2  ILE 102          2HG2      ILE 102   8.666   3.613  -5.454
  770   3HG2  ILE 102          3HG2      ILE 102   8.901   3.528  -3.708
  771   1HD1  ILE 102          1HD1      ILE 102   5.717   2.135  -6.993
  772   2HD1  ILE 102          2HD1      ILE 102   6.691   3.555  -6.608
  773   3HD1  ILE 102          3HD1      ILE 102   4.935   3.625  -6.464
  774    HA   PRO 103           HA       PRO 103  11.684  -0.733  -4.580
  775   1HB   PRO 103          2HB       PRO 103  13.128   0.906  -6.565
  776   2HB   PRO 103          1HB       PRO 103  13.119  -0.846  -6.347
  777   1HG   PRO 103          2HG       PRO 103  11.878   0.328  -8.414
  778   2HG   PRO 103          1HG       PRO 103  11.234  -1.132  -7.642
  779   1HD   PRO 103          2HD       PRO 103  10.355   1.711  -7.363
  780   2HD   PRO 103          1HD       PRO 103   9.380   0.228  -7.418
  781    H    GLN 104           H        GLN 104  14.076   0.303  -4.265
  782    HA   GLN 104           HA       GLN 104  14.294   3.010  -3.594
  783   1HB   GLN 104          2HB       GLN 104  12.607   2.115  -1.843
  784   2HB   GLN 104          1HB       GLN 104  14.006   1.343  -1.110
  785   1HG   GLN 104          2HG       GLN 104  14.726   3.247  -0.216
  786   2HG   GLN 104          1HG       GLN 104  14.454   4.152  -1.704
  787   1HE2  GLN 104          1HE2      GLN 104  12.793   5.514  -1.791
  788   2HE2  GLN 104          2HE2      GLN 104  11.543   5.643  -0.605
  789    H    ILE 105           H        ILE 105  15.251  -0.035  -1.999
  790    HA   ILE 105           HA       ILE 105  17.972   0.283  -2.951
  791    HB   ILE 105           HB       ILE 105  18.938   0.066  -0.666
  792   1HG1  ILE 105          2HG1      ILE 105  16.540   1.179   0.625
  793   2HG1  ILE 105          1HG1      ILE 105  16.369  -0.497   0.113
  794   1HG2  ILE 105          1HG2      ILE 105  18.664   2.238  -1.952
  795   2HG2  ILE 105          2HG2      ILE 105  18.920   2.373  -0.211
  796   3HG2  ILE 105          3HG2      ILE 105  17.302   2.575  -0.884
  797   1HD1  ILE 105          1HD1      ILE 105  17.864   0.633   2.323
  798   2HD1  ILE 105          2HD1      ILE 105  18.831  -0.463   1.335
  799   3HD1  ILE 105          3HD1      ILE 105  17.317  -1.021   2.049
  800    HA   PRO 106           HA       PRO 106  17.847  -4.125  -2.882
  801   1HB   PRO 106          2HB       PRO 106  20.466  -4.748  -2.557
  802   2HB   PRO 106          1HB       PRO 106  19.821  -4.087  -4.063
  803   1HG   PRO 106          2HG       PRO 106  21.267  -2.688  -1.846
  804   2HG   PRO 106          1HG       PRO 106  21.471  -2.514  -3.600
  805   1HD   PRO 106          2HD       PRO 106  20.047  -0.752  -2.113
  806   2HD   PRO 106          1HD       PRO 106  19.646  -1.122  -3.801
  807    H    HIS 107           H        HIS 107  16.807  -4.909  -1.118
  808    HA   HIS 107           HA       HIS 107  18.453  -5.524   1.223
  809   1HB   HIS 107          2HB       HIS 107  17.016  -3.411   1.554
  810   2HB   HIS 107          1HB       HIS 107  15.640  -4.509   1.573
  811    HD1  HIS 107           1HD      HIS 107  15.371  -6.039   3.633
  812    HD2  HIS 107           2HD      HIS 107  18.660  -3.507   3.821
  813    HE1  HIS 107           1HE      HIS 107  16.163  -6.142   6.018
  814    HE2  HIS 107           2HE      HIS 107  18.207  -4.671   6.087
  815    H    SER 108           H        SER 108  18.467  -7.661   0.392
  816    HA   SER 108           HA       SER 108  15.891  -9.068   0.674
  817   1HB   SER 108          2HB       SER 108  16.880  -9.020  -1.655
  818   2HB   SER 108          1HB       SER 108  18.215  -9.985  -1.027
  819    HG   SER 108           HG       SER 108  16.985 -11.660  -1.239
  820    H    HIS 109           H        HIS 109  16.020  -9.749   2.759
  821    HA   HIS 109           HA       HIS 109  18.418 -11.245   3.568
  822   1HB   HIS 109          2HB       HIS 109  16.594  -9.443   4.961
  823   2HB   HIS 109          1HB       HIS 109  16.834 -10.956   5.828
  824    HD1  HIS 109           1HD      HIS 109  18.108  -9.558   7.659
  825    HD2  HIS 109           2HD      HIS 109  19.928  -9.650   3.924
  826    HE1  HIS 109           1HE      HIS 109  20.458  -8.745   8.036
  827    HE2  HIS 109           2HE      HIS 109  21.513  -8.728   5.747
  828    H    TYR 110           H        TYR 110  14.952 -11.454   3.150
  829    HA   TYR 110           HA       TYR 110  13.509 -13.211   3.119
  830   1HB   TYR 110          2HB       TYR 110  15.939 -14.162   2.020
  831   2HB   TYR 110          1HB       TYR 110  15.326 -15.436   3.068
  832    HD1  TYR 110           1HD      TYR 110  13.151 -16.485   2.605
  833    HD2  TYR 110           2HD      TYR 110  14.799 -13.561  -0.010
  834    HE1  TYR 110           1HE      TYR 110  11.569 -17.169   0.851
  835    HE2  TYR 110           2HE      TYR 110  13.221 -14.237  -1.770
  836    HH   TYR 110           HH       TYR 110  11.493 -17.070  -1.703
  Start of MODEL    7
    1   1H    GLY   1          1HT       GLY   1 -19.304 -25.628  -1.347
    2   2H    GLY   1          2HT       GLY   1 -18.648 -27.177  -1.172
    3   3H    GLY   1          3HT       GLY   1 -17.740 -25.952  -1.903
    4   1HA   GLY   1          1HA       GLY   1 -18.514 -26.184   0.946
    5   2HA   GLY   1          2HA       GLY   1 -16.891 -26.197   0.276
    6    H    SER   2           H        SER   2 -16.952 -24.071  -1.448
    7    HA   SER   2           HA       SER   2 -17.370 -21.816   0.398
    8   1HB   SER   2          2HB       SER   2 -15.562 -20.671  -0.749
    9   2HB   SER   2          1HB       SER   2 -15.008 -22.271  -0.255
   10    HG   SER   2           HG       SER   2 -15.521 -22.954  -2.433
   11    H    GLN   3           H        GLN   3 -17.887 -22.997  -2.858
   12    HA   GLN   3           HA       GLN   3 -19.245 -22.307  -4.546
   13   1HB   GLN   3          2HB       GLN   3 -20.808 -22.186  -2.452
   14   2HB   GLN   3          1HB       GLN   3 -20.665 -20.449  -2.673
   15   1HG   GLN   3          2HG       GLN   3 -21.721 -20.504  -4.751
   16   2HG   GLN   3          1HG       GLN   3 -21.479 -22.241  -4.928
   17   1HE2  GLN   3          1HE2      GLN   3 -23.102 -19.874  -2.853
   18   2HE2  GLN   3          2HE2      GLN   3 -24.504 -20.839  -2.553
   19    H    ASP   4           H        ASP   4 -16.795 -20.835  -3.932
   20    HA   ASP   4           HA       ASP   4 -17.470 -18.344  -5.333
   21   1HB   ASP   4          2HB       ASP   4 -15.827 -18.653  -2.836
   22   2HB   ASP   4          1HB       ASP   4 -15.533 -17.315  -3.942
   23    H    ARG   5           H        ARG   5 -15.223 -17.267  -5.992
   24    HA   ARG   5           HA       ARG   5 -13.141 -19.120  -6.658
   25   1HB   ARG   5          2HB       ARG   5 -15.226 -19.203  -8.391
   26   2HB   ARG   5          1HB       ARG   5 -14.255 -17.934  -9.123
   27   1HG   ARG   5          2HG       ARG   5 -12.355 -19.790  -8.649
   28   2HG   ARG   5          1HG       ARG   5 -13.759 -20.822  -8.925
   29   1HD   ARG   5          2HD       ARG   5 -14.163 -19.750 -11.061
   30   2HD   ARG   5          1HD       ARG   5 -12.832 -18.629 -10.776
   31    HE   ARG   5           HE       ARG   5 -11.759 -21.168 -10.603
   32   1HH1  ARG   5          1HH1      ARG   5 -13.385 -19.248 -13.019
   33   2HH1  ARG   5          2HH1      ARG   5 -12.579 -20.011 -14.348
   34   1HH2  ARG   5          1HH2      ARG   5 -10.697 -22.174 -12.350
   35   2HH2  ARG   5          2HH2      ARG   5 -11.054 -21.673 -13.969
   36    H    LYS   6           H        LYS   6 -12.175 -17.376  -5.373
   37    HA   LYS   6           HA       LYS   6 -11.801 -14.844  -6.779
   38   1HB   LYS   6          2HB       LYS   6 -10.698 -14.109  -4.697
   39   2HB   LYS   6          1HB       LYS   6 -12.329 -14.689  -4.420
   40   1HG   LYS   6          2HG       LYS   6 -11.348 -16.866  -3.709
   41   2HG   LYS   6          1HG       LYS   6  -9.755 -16.119  -3.818
   42   1HD   LYS   6          2HD       LYS   6 -10.082 -14.837  -1.965
   43   2HD   LYS   6          1HD       LYS   6 -11.818 -14.687  -2.246
   44   1HE   LYS   6          2HE       LYS   6 -10.530 -17.264  -1.384
   45   2HE   LYS   6          1HE       LYS   6 -11.100 -16.057  -0.231
   46   1HZ   LYS   6          1HZ       LYS   6 -13.240 -16.557  -0.633
   47   2HZ   LYS   6          2HZ       LYS   6 -12.612 -18.037  -1.159
   48   3HZ   LYS   6          3HZ       LYS   6 -12.998 -16.835  -2.285
   49    H    ILE   7           H        ILE   7  -9.484 -13.927  -6.608
   50    HA   ILE   7           HA       ILE   7  -7.632 -16.024  -7.537
   51    HB   ILE   7           HB       ILE   7  -6.451 -14.214  -8.747
   52   1HG1  ILE   7          2HG1      ILE   7  -8.529 -12.280  -8.892
   53   2HG1  ILE   7          1HG1      ILE   7  -8.195 -12.563  -7.188
   54   1HG2  ILE   7          1HG2      ILE   7  -8.475 -13.779 -10.362
   55   2HG2  ILE   7          2HG2      ILE   7  -9.269 -14.967  -9.329
   56   3HG2  ILE   7          3HG2      ILE   7  -7.786 -15.392 -10.184
   57   1HD1  ILE   7          1HD1      ILE   7  -6.433 -11.446  -9.305
   58   2HD1  ILE   7          2HD1      ILE   7  -5.711 -12.285  -7.932
   59   3HD1  ILE   7          3HD1      ILE   7  -6.733 -10.872  -7.664
   60    H    PHE   8           H        PHE   8  -8.142 -13.686  -5.108
   61    HA   PHE   8           HA       PHE   8  -5.310 -13.473  -4.451
   62   1HB   PHE   8          2HB       PHE   8  -7.799 -12.120  -3.441
   63   2HB   PHE   8          1HB       PHE   8  -6.274 -11.979  -2.587
   64    HD1  PHE   8           1HD      PHE   8  -7.858  -9.699  -3.724
   65    HD2  PHE   8           2HD      PHE   8  -4.712 -12.042  -5.381
   66    HE1  PHE   8           1HE      PHE   8  -7.230  -7.821  -5.183
   67    HE2  PHE   8           2HE      PHE   8  -4.083 -10.170  -6.841
   68    HZ   PHE   8           HZ       PHE   8  -5.341  -8.055  -6.744
   69    H    ARG   9           H        ARG   9  -8.328 -14.681  -3.043
   70    HA   ARG   9           HA       ARG   9  -8.745 -16.052  -1.266
   71   1HB   ARG   9          2HB       ARG   9  -7.791 -17.652  -2.850
   72   2HB   ARG   9          1HB       ARG   9  -6.174 -17.294  -2.257
   73   1HG   ARG   9          2HG       ARG   9  -6.482 -18.457  -0.304
   74   2HG   ARG   9          1HG       ARG   9  -8.236 -18.256  -0.336
   75   1HD   ARG   9          2HD       ARG   9  -8.530 -19.963  -1.880
   76   2HD   ARG   9          1HD       ARG   9  -6.862 -19.873  -2.444
   77    HE   ARG   9           HE       ARG   9  -6.812 -20.650   0.232
   78   1HH1  ARG   9          1HH1      ARG   9  -7.914 -21.895  -2.837
   79   2HH1  ARG   9          2HH1      ARG   9  -7.702 -23.552  -2.382
   80   1HH2  ARG   9          1HH2      ARG   9  -6.532 -22.830   0.831
   81   2HH2  ARG   9          2HH2      ARG   9  -6.917 -24.083  -0.300
   82    H    GLY  10           H        GLY  10  -8.556 -14.674   0.479
   83   1HA   GLY  10          2HA       GLY  10  -7.746 -14.051   2.544
   84   2HA   GLY  10          1HA       GLY  10  -6.529 -15.303   2.365
   85    H    LEU  11           H        LEU  11  -7.345 -12.018   1.348
   86    HA   LEU  11           HA       LEU  11  -4.508 -11.329   1.564
   87   1HB   LEU  11          2HB       LEU  11  -5.929 -11.563  -0.874
   88   2HB   LEU  11          1HB       LEU  11  -5.634  -9.858  -0.609
   89    HG   LEU  11           HG       LEU  11  -3.318 -11.659  -0.217
   90   1HD1  LEU  11          1HD1      LEU  11  -2.856 -11.879  -2.564
   91   2HD1  LEU  11          2HD1      LEU  11  -4.337 -11.013  -2.975
   92   3HD1  LEU  11          3HD1      LEU  11  -4.427 -12.603  -2.216
   93   1HD2  LEU  11          1HD2      LEU  11  -3.214  -9.287  -1.953
   94   2HD2  LEU  11          2HD2      LEU  11  -2.138  -9.793  -0.651
   95   3HD2  LEU  11          3HD2      LEU  11  -3.660  -8.984  -0.274
   96    H    GLU  12           H        GLU  12  -4.137  -8.985   1.657
   97    HA   GLU  12           HA       GLU  12  -6.448  -7.383   2.451
   98   1HB   GLU  12          2HB       GLU  12  -4.188  -8.195   4.220
   99   2HB   GLU  12          1HB       GLU  12  -4.809  -6.558   4.378
  100   1HG   GLU  12          2HG       GLU  12  -7.086  -8.114   4.353
  101   2HG   GLU  12          1HG       GLU  12  -5.932  -9.070   5.281
  102    H    ILE  13           H        ILE  13  -6.321  -5.734   1.061
  103    HA   ILE  13           HA       ILE  13  -3.672  -4.532   0.590
  104    HB   ILE  13           HB       ILE  13  -6.022  -4.476  -1.298
  105   1HG1  ILE  13          2HG1      ILE  13  -3.744  -5.916  -2.293
  106   2HG1  ILE  13          1HG1      ILE  13  -4.234  -6.598  -0.743
  107   1HG2  ILE  13          1HG2      ILE  13  -3.147  -3.647  -1.664
  108   2HG2  ILE  13          2HG2      ILE  13  -4.534  -2.567  -1.530
  109   3HG2  ILE  13          3HG2      ILE  13  -4.387  -3.643  -2.919
  110   1HD1  ILE  13          1HD1      ILE  13  -6.613  -6.526  -1.790
  111   2HD1  ILE  13          2HD1      ILE  13  -5.493  -7.821  -2.214
  112   3HD1  ILE  13          3HD1      ILE  13  -5.729  -6.462  -3.313
  113    H    CYS  14           H        CYS  14  -3.398  -2.528   1.262
  114    HA   CYS  14           HA       CYS  14  -5.771  -0.913   1.883
  115   1HB   CYS  14          2HB       CYS  14  -4.410   0.272   3.495
  116   2HB   CYS  14          1HB       CYS  14  -4.277  -1.458   3.782
  117    HG   CYS  14           HG       CYS  14  -1.990  -0.280   2.128
  118    H    CYS  15           H        CYS  15  -6.139   0.911   0.812
  119    HA   CYS  15           HA       CYS  15  -4.153   1.780  -1.153
  120   1HB   CYS  15          2HB       CYS  15  -7.003   2.744  -0.900
  121   2HB   CYS  15          1HB       CYS  15  -5.938   2.881  -2.294
  122    HG   CYS  15           HG       CYS  15  -6.267   0.015  -1.949
  123    H    TYR  16           H        TYR  16  -2.827   3.357  -0.564
  124    HA   TYR  16           HA       TYR  16  -3.629   5.192   1.557
  125   1HB   TYR  16          2HB       TYR  16  -1.377   4.006   1.514
  126   2HB   TYR  16          1HB       TYR  16  -0.945   5.076   0.185
  127    HD1  TYR  16           1HD      TYR  16   0.042   7.124   0.650
  128    HD2  TYR  16           2HD      TYR  16  -2.198   5.176   3.697
  129    HE1  TYR  16           1HE      TYR  16   0.746   8.844   2.259
  130    HE2  TYR  16           2HE      TYR  16  -1.503   6.892   5.315
  131    HH   TYR  16           HH       TYR  16   0.973   9.169   4.628
  132    H    GLY  17           H        GLY  17  -4.755   6.908   0.915
  133   1HA   GLY  17          2HA       GLY  17  -4.791   9.092  -0.006
  134   2HA   GLY  17          1HA       GLY  17  -3.636   8.571  -1.223
  135    HA   PRO  18           HA       PRO  18  -8.048   8.385  -2.897
  136   1HB   PRO  18          2HB       PRO  18  -8.206  10.678  -4.276
  137   2HB   PRO  18          1HB       PRO  18  -8.560  10.614  -2.545
  138   1HG   PRO  18          2HG       PRO  18  -6.075  11.530  -3.938
  139   2HG   PRO  18          1HG       PRO  18  -6.912  12.251  -2.551
  140   1HD   PRO  18          2HD       PRO  18  -4.691  10.648  -2.346
  141   2HD   PRO  18          1HD       PRO  18  -5.894  10.849  -1.058
  142    H    PHE  19           H        PHE  19  -4.899   8.518  -3.994
  143    HA   PHE  19           HA       PHE  19  -3.853   7.815  -5.880
  144   1HB   PHE  19          2HB       PHE  19  -6.595   6.666  -6.334
  145   2HB   PHE  19          1HB       PHE  19  -5.321   6.485  -7.536
  146    HD1  PHE  19           1HD      PHE  19  -5.290   6.302  -3.813
  147    HD2  PHE  19           2HD      PHE  19  -4.581   4.305  -7.504
  148    HE1  PHE  19           1HE      PHE  19  -4.419   4.358  -2.587
  149    HE2  PHE  19           2HE      PHE  19  -3.708   2.356  -6.281
  150    HZ   PHE  19           HZ       PHE  19  -3.626   2.380  -3.821
  151    H    THR  20           H        THR  20  -6.987   8.431  -7.398
  152    HA   THR  20           HA       THR  20  -5.769  10.709  -8.814
  153    HB   THR  20           HB       THR  20  -7.610   9.846 -10.607
  154    HG1  THR  20           1HG      THR  20  -8.129   7.872 -10.200
  155   1HG2  THR  20          1HG2      THR  20  -4.803   9.863 -10.453
  156   2HG2  THR  20          2HG2      THR  20  -5.820   9.758 -11.891
  157   3HG2  THR  20          3HG2      THR  20  -5.279   8.286 -11.084
  158    H    ASN  21           H        ASN  21  -9.045   9.351  -8.904
  159    HA   ASN  21           HA       ASN  21 -10.121  11.536  -7.348
  160   1HB   ASN  21          2HB       ASN  21  -9.816  12.226  -9.875
  161   2HB   ASN  21          1HB       ASN  21 -11.279  11.270 -10.094
  162   1HD2  ASN  21          1HD2      ASN  21 -13.024  11.796  -8.425
  163   2HD2  ASN  21          2HD2      ASN  21 -13.307  13.475  -8.139
  164    H    MET  22           H        MET  22 -10.035   8.638  -7.192
  165    HA   MET  22           HA       MET  22 -12.817   7.866  -7.666
  166   1HB   MET  22          2HB       MET  22 -10.498   6.485  -8.056
  167   2HB   MET  22          1HB       MET  22 -10.980   5.895  -6.471
  168   1HG   MET  22          2HG       MET  22 -12.870   4.880  -7.267
  169   2HG   MET  22          1HG       MET  22 -12.998   5.960  -8.654
  170   1HE   MET  22          1HE       MET  22 -12.213   3.688 -11.295
  171   2HE   MET  22          2HE       MET  22 -11.520   5.303 -11.161
  172   3HE   MET  22          3HE       MET  22 -13.151   4.993 -10.571
  173    HA   PRO  23           HA       PRO  23 -14.152   8.403  -3.499
  174   1HB   PRO  23          2HB       PRO  23 -15.436   5.735  -3.746
  175   2HB   PRO  23          1HB       PRO  23 -16.152   7.295  -3.326
  176   1HG   PRO  23          2HG       PRO  23 -16.555   6.212  -5.727
  177   2HG   PRO  23          1HG       PRO  23 -16.325   7.960  -5.539
  178   1HD   PRO  23          2HD       PRO  23 -14.402   5.887  -6.509
  179   2HD   PRO  23          1HD       PRO  23 -14.652   7.550  -7.079
  180    H    THR  24           H        THR  24 -12.412   5.582  -4.497
  181    HA   THR  24           HA       THR  24 -10.714   4.488  -3.403
  182    HB   THR  24           HB       THR  24 -11.586   5.408  -0.698
  183    HG1  THR  24           1HG      THR  24 -10.781   7.398  -0.990
  184   1HG2  THR  24          1HG2      THR  24  -9.576   4.726  -0.094
  185   2HG2  THR  24          2HG2      THR  24  -8.818   5.773  -1.295
  186   3HG2  THR  24          3HG2      THR  24  -9.313   4.138  -1.735
  187    H    ASP  25           H        ASP  25 -14.036   4.379  -2.597
  188    HA   ASP  25           HA       ASP  25 -13.841   1.895  -1.113
  189   1HB   ASP  25          2HB       ASP  25 -16.188   3.567  -2.025
  190   2HB   ASP  25          1HB       ASP  25 -16.372   2.024  -1.196
  191    H    GLN  26           H        GLN  26 -14.346   3.008  -4.333
  192    HA   GLN  26           HA       GLN  26 -15.529   0.603  -5.340
  193   1HB   GLN  26          2HB       GLN  26 -15.347   3.158  -6.261
  194   2HB   GLN  26          1HB       GLN  26 -14.093   2.377  -7.212
  195   1HG   GLN  26          2HG       GLN  26 -15.870   0.630  -7.780
  196   2HG   GLN  26          1HG       GLN  26 -17.027   1.797  -7.141
  197   1HE2  GLN  26          1HE2      GLN  26 -17.929   1.807  -9.281
  198   2HE2  GLN  26          2HE2      GLN  26 -17.211   2.780 -10.514
  199    H    LEU  27           H        LEU  27 -12.308   1.863  -4.909
  200    HA   LEU  27           HA       LEU  27 -10.993  -0.041  -6.580
  201   1HB   LEU  27          2HB       LEU  27  -9.937   2.081  -6.054
  202   2HB   LEU  27          1HB       LEU  27  -9.962   1.704  -4.342
  203    HG   LEU  27           HG       LEU  27  -8.383  -0.152  -4.739
  204   1HD1  LEU  27          1HD1      LEU  27  -7.541   0.718  -7.375
  205   2HD1  LEU  27          2HD1      LEU  27  -9.183   0.073  -7.376
  206   3HD1  LEU  27          3HD1      LEU  27  -7.851  -0.907  -6.764
  207   1HD2  LEU  27          1HD2      LEU  27  -7.686   2.229  -4.217
  208   2HD2  LEU  27          2HD2      LEU  27  -7.296   2.386  -5.930
  209   3HD2  LEU  27          3HD2      LEU  27  -6.457   1.191  -4.941
  210    H    GLU  28           H        GLU  28 -11.405   0.265  -3.049
  211    HA   GLU  28           HA       GLU  28 -10.102  -2.137  -2.391
  212   1HB   GLU  28          2HB       GLU  28 -11.585  -1.995  -0.287
  213   2HB   GLU  28          1HB       GLU  28 -10.422  -0.711  -0.584
  214   1HG   GLU  28          2HG       GLU  28 -12.025   0.809  -0.570
  215   2HG   GLU  28          1HG       GLU  28 -12.914  -0.054  -1.823
  216    H    TRP  29           H        TRP  29 -13.292  -1.486  -3.600
  217    HA   TRP  29           HA       TRP  29 -14.530  -3.912  -2.844
  218   1HB   TRP  29          2HB       TRP  29 -16.041  -2.292  -3.584
  219   2HB   TRP  29          1HB       TRP  29 -15.037  -1.838  -4.955
  220    HD1  TRP  29           HD       TRP  29 -17.054  -4.972  -3.870
  221    HE1  TRP  29           1HE      TRP  29 -18.188  -5.948  -5.966
  222    HE3  TRP  29           3HE      TRP  29 -15.216  -1.730  -7.363
  223    HZ2  TRP  29           2HZ      TRP  29 -18.284  -5.413  -8.736
  224    HZ3  TRP  29           3HZ      TRP  29 -15.875  -2.030  -9.715
  225    HH2  TRP  29           HH       TRP  29 -17.376  -3.836 -10.386
  226    H    MET  30           H        MET  30 -12.866  -2.900  -5.786
  227    HA   MET  30           HA       MET  30 -13.080  -5.195  -7.301
  228   1HB   MET  30          2HB       MET  30 -10.603  -3.474  -7.158
  229   2HB   MET  30          1HB       MET  30 -11.154  -4.438  -8.520
  230   1HG   MET  30          2HG       MET  30 -13.286  -2.865  -8.240
  231   2HG   MET  30          1HG       MET  30 -12.055  -1.790  -7.579
  232   1HE   MET  30          1HE       MET  30  -9.829  -0.746  -9.879
  233   2HE   MET  30          2HE       MET  30 -10.932  -0.400  -8.547
  234   3HE   MET  30          3HE       MET  30 -11.325   0.140 -10.179
  235    H    VAL  31           H        VAL  31 -10.389  -4.359  -5.095
  236    HA   VAL  31           HA       VAL  31  -9.010  -6.779  -5.320
  237    HB   VAL  31           HB       VAL  31  -8.043  -6.261  -3.086
  238   1HG1  VAL  31          1HG1      VAL  31  -7.642  -4.976  -5.470
  239   2HG1  VAL  31          2HG1      VAL  31  -6.615  -4.830  -4.043
  240   3HG1  VAL  31          3HG1      VAL  31  -7.877  -3.635  -4.348
  241   1HG2  VAL  31          1HG2      VAL  31  -9.933  -3.923  -3.166
  242   2HG2  VAL  31          2HG2      VAL  31  -8.625  -4.140  -2.005
  243   3HG2  VAL  31          3HG2      VAL  31  -9.980  -5.267  -2.026
  244    H    GLN  32           H        GLN  32 -11.560  -5.784  -3.088
  245    HA   GLN  32           HA       GLN  32 -11.650  -8.098  -1.511
  246   1HB   GLN  32          2HB       GLN  32 -13.333  -5.760  -1.988
  247   2HB   GLN  32          1HB       GLN  32 -14.274  -7.198  -1.626
  248   1HG   GLN  32          2HG       GLN  32 -13.295  -7.446   0.482
  249   2HG   GLN  32          1HG       GLN  32 -11.965  -6.356   0.089
  250   1HE2  GLN  32          1HE2      GLN  32 -13.313  -5.975   2.390
  251   2HE2  GLN  32          2HE2      GLN  32 -14.296  -4.557   2.291
  252    H    LEU  33           H        LEU  33 -13.112  -7.291  -4.587
  253    HA   LEU  33           HA       LEU  33 -14.782  -9.584  -4.785
  254   1HB   LEU  33          2HB       LEU  33 -15.084  -7.453  -6.057
  255   2HB   LEU  33          1HB       LEU  33 -13.676  -7.872  -7.012
  256    HG   LEU  33           HG       LEU  33 -14.824  -9.847  -7.879
  257   1HD1  LEU  33          1HD1      LEU  33 -17.302 -10.026  -7.418
  258   2HD1  LEU  33          2HD1      LEU  33 -17.034  -8.934  -6.059
  259   3HD1  LEU  33          3HD1      LEU  33 -16.230 -10.503  -6.101
  260   1HD2  LEU  33          1HD2      LEU  33 -16.218  -8.736  -9.384
  261   2HD2  LEU  33          2HD2      LEU  33 -15.080  -7.493  -8.864
  262   3HD2  LEU  33          3HD2      LEU  33 -16.708  -7.536  -8.188
  263    H    CYS  34           H        CYS  34 -11.427  -9.030  -5.275
  264    HA   CYS  34           HA       CYS  34 -11.092 -11.397  -6.940
  265   1HB   CYS  34          2HB       CYS  34  -9.428  -9.055  -6.220
  266   2HB   CYS  34          1HB       CYS  34  -8.566 -10.566  -6.494
  267    HG   CYS  34           HG       CYS  34  -8.701  -9.382  -8.766
  268    H    GLY  35           H        GLY  35 -11.372 -10.841  -3.679
  269   1HA   GLY  35          2HA       GLY  35 -11.221 -12.761  -2.216
  270   2HA   GLY  35          1HA       GLY  35  -9.793 -13.263  -3.107
  271    H    ALA  36           H        ALA  36 -10.197  -9.930  -2.209
  272    HA   ALA  36           HA       ALA  36  -8.102 -10.279  -0.165
  273   1HB   ALA  36          1HB       ALA  36  -8.548  -8.054  -2.135
  274   2HB   ALA  36          2HB       ALA  36  -7.132  -9.091  -1.955
  275   3HB   ALA  36          3HB       ALA  36  -7.506  -7.885  -0.722
  276    H    SER  37           H        SER  37  -8.042  -8.160   1.238
  277    HA   SER  37           HA       SER  37 -10.782  -7.462   2.041
  278   1HB   SER  37          2HB       SER  37  -9.059  -9.133   3.500
  279   2HB   SER  37          1HB       SER  37  -9.008  -7.577   4.326
  280    HG   SER  37           HG       SER  37 -11.440  -8.804   3.567
  281    H    VAL  38           H        VAL  38 -11.102  -5.352   2.435
  282    HA   VAL  38           HA       VAL  38  -9.030  -3.488   1.839
  283    HB   VAL  38           HB       VAL  38 -11.396  -3.053   1.301
  284   1HG1  VAL  38          1HG1      VAL  38 -11.961  -2.314   4.126
  285   2HG1  VAL  38          2HG1      VAL  38 -12.080  -4.010   3.656
  286   3HG1  VAL  38          3HG1      VAL  38 -13.068  -2.798   2.841
  287   1HG2  VAL  38          1HG2      VAL  38 -10.611  -0.906   3.217
  288   2HG2  VAL  38          2HG2      VAL  38 -11.253  -0.775   1.580
  289   3HG2  VAL  38          3HG2      VAL  38  -9.575  -1.255   1.833
  290    H    VAL  39           H        VAL  39  -7.501  -2.792   3.177
  291    HA   VAL  39           HA       VAL  39  -7.853  -3.141   6.057
  292    HB   VAL  39           HB       VAL  39  -5.332  -2.029   4.949
  293   1HG1  VAL  39          1HG1      VAL  39  -5.287  -4.335   6.743
  294   2HG1  VAL  39          2HG1      VAL  39  -6.111  -2.919   7.394
  295   3HG1  VAL  39          3HG1      VAL  39  -4.438  -2.794   6.848
  296   1HG2  VAL  39          1HG2      VAL  39  -5.560  -3.645   3.287
  297   2HG2  VAL  39          2HG2      VAL  39  -6.340  -4.792   4.376
  298   3HG2  VAL  39          3HG2      VAL  39  -4.613  -4.466   4.526
  299    H    LYS  40           H        LYS  40  -8.389  -1.514   7.351
  300    HA   LYS  40           HA       LYS  40  -9.035   1.039   6.475
  301   1HB   LYS  40          2HB       LYS  40  -8.462  -0.096   9.193
  302   2HB   LYS  40          1HB       LYS  40  -8.810   1.616   8.993
  303   1HG   LYS  40          2HG       LYS  40 -10.985   1.218   8.900
  304   2HG   LYS  40          1HG       LYS  40 -10.764   0.058   7.589
  305   1HD   LYS  40          2HD       LYS  40 -11.724  -1.248   9.242
  306   2HD   LYS  40          1HD       LYS  40 -10.002  -1.546   9.488
  307   1HE   LYS  40          2HE       LYS  40 -11.097   0.750  10.961
  308   2HE   LYS  40          1HE       LYS  40 -11.737  -0.821  11.445
  309   1HZ   LYS  40          1HZ       LYS  40  -9.631   0.053  12.586
  310   2HZ   LYS  40          2HZ       LYS  40  -8.830  -0.405  11.168
  311   3HZ   LYS  40          3HZ       LYS  40  -9.655  -1.563  12.084
  312    H    GLU  41           H        GLU  41  -6.086  -0.084   8.070
  313    HA   GLU  41           HA       GLU  41  -4.640   2.167   6.915
  314   1HB   GLU  41          2HB       GLU  41  -4.964   1.672   9.856
  315   2HB   GLU  41          1HB       GLU  41  -3.493   2.417   9.245
  316   1HG   GLU  41          2HG       GLU  41  -5.189   4.012   8.032
  317   2HG   GLU  41          1HG       GLU  41  -6.270   3.476   9.318
  318    H    LEU  42           H        LEU  42  -2.199   1.922   7.777
  319    HA   LEU  42           HA       LEU  42  -1.274  -0.511   6.662
  320   1HB   LEU  42          2HB       LEU  42   0.322   1.404   8.357
  321   2HB   LEU  42          1HB       LEU  42   0.933   0.281   7.156
  322    HG   LEU  42           HG       LEU  42  -0.827   2.650   6.520
  323   1HD1  LEU  42          1HD1      LEU  42   1.538   3.263   5.421
  324   2HD1  LEU  42          2HD1      LEU  42   2.096   2.380   6.843
  325   3HD1  LEU  42          3HD1      LEU  42   1.055   3.791   7.032
  326   1HD2  LEU  42          1HD2      LEU  42  -1.120   1.165   4.771
  327   2HD2  LEU  42          2HD2      LEU  42   0.523   0.537   4.892
  328   3HD2  LEU  42          3HD2      LEU  42   0.240   2.139   4.211
  329    H    SER  43           H        SER  43  -1.454   0.696   9.990
  330    HA   SER  43           HA       SER  43  -0.231  -1.585  11.160
  331   1HB   SER  43          2HB       SER  43  -0.975   0.927  12.050
  332   2HB   SER  43          1HB       SER  43  -2.077  -0.147  12.910
  333    HG   SER  43           HG       SER  43   0.756  -0.325  12.851
  334    H    SER  44           H        SER  44  -3.366  -1.017   9.921
  335    HA   SER  44           HA       SER  44  -4.876  -2.718  11.590
  336   1HB   SER  44          2HB       SER  44  -5.284  -1.758   8.760
  337   2HB   SER  44          1HB       SER  44  -6.451  -2.789   9.586
  338    HG   SER  44           HG       SER  44  -5.587  -0.199  10.356
  339    H    PHE  45           H        PHE  45  -2.531  -3.409   9.198
  340    HA   PHE  45           HA       PHE  45  -3.380  -5.777   8.066
  341   1HB   PHE  45          2HB       PHE  45  -0.653  -4.788   8.854
  342   2HB   PHE  45          1HB       PHE  45  -0.857  -6.383   8.136
  343    HD1  PHE  45           1HD      PHE  45  -2.838  -6.008   6.087
  344    HD2  PHE  45           2HD      PHE  45   0.304  -3.405   7.298
  345    HE1  PHE  45           1HE      PHE  45  -2.815  -4.997   3.841
  346    HE2  PHE  45           2HE      PHE  45   0.329  -2.388   5.059
  347    HZ   PHE  45           HZ       PHE  45  -1.230  -3.181   3.330
  348    H    THR  46           H        THR  46  -4.186  -7.517   9.026
  349    HA   THR  46           HA       THR  46  -3.262  -8.255  11.701
  350    HB   THR  46           HB       THR  46  -5.204  -9.803  11.688
  351    HG1  THR  46           1HG      THR  46  -5.858  -8.590   9.214
  352   1HG2  THR  46          1HG2      THR  46  -6.939  -7.809  11.122
  353   2HG2  THR  46          2HG2      THR  46  -5.456  -6.900  11.417
  354   3HG2  THR  46          3HG2      THR  46  -6.082  -7.991  12.653
  355    H    LEU  47           H        LEU  47  -3.366 -10.794  12.007
  356    HA   LEU  47           HA       LEU  47  -1.816 -12.020   9.820
  357   1HB   LEU  47          2HB       LEU  47  -0.811 -11.363  12.279
  358   2HB   LEU  47          1HB       LEU  47  -1.288 -13.031  12.528
  359    HG   LEU  47           HG       LEU  47   0.045 -13.306  10.209
  360   1HD1  LEU  47          1HD1      LEU  47   0.544 -10.701  10.654
  361   2HD1  LEU  47          2HD1      LEU  47   1.651 -11.778   9.803
  362   3HD1  LEU  47          3HD1      LEU  47   1.902 -11.427  11.513
  363   1HD2  LEU  47          1HD2      LEU  47   0.784 -13.514  13.062
  364   2HD2  LEU  47          2HD2      LEU  47   2.106 -13.587  11.898
  365   3HD2  LEU  47          3HD2      LEU  47   0.777 -14.743  11.796
  366    H    GLY  48           H        GLY  48  -1.601 -14.563  10.644
  367   1HA   GLY  48          2HA       GLY  48  -3.498 -15.989  11.875
  368   2HA   GLY  48          1HA       GLY  48  -4.344 -15.498  10.416
  369    H    THR  49           H        THR  49  -4.383 -17.060   8.957
  370    HA   THR  49           HA       THR  49  -1.958 -18.693   8.592
  371    HB   THR  49           HB       THR  49  -3.341 -20.632   8.130
  372    HG1  THR  49           1HG      THR  49  -5.231 -20.098   7.359
  373   1HG2  THR  49          1HG2      THR  49  -4.666 -20.767  10.335
  374   2HG2  THR  49          2HG2      THR  49  -3.898 -19.223  10.701
  375   3HG2  THR  49          3HG2      THR  49  -2.907 -20.650  10.395
  376    H    GLY  50           H        GLY  50  -5.016 -17.721   7.032
  377   1HA   GLY  50          2HA       GLY  50  -3.582 -17.757   4.450
  378   2HA   GLY  50          1HA       GLY  50  -5.302 -18.051   4.627
  379    H    VAL  51           H        VAL  51  -2.831 -15.574   5.145
  380    HA   VAL  51           HA       VAL  51  -4.553 -13.580   3.947
  381    HB   VAL  51           HB       VAL  51  -3.548 -13.131   6.761
  382   1HG1  VAL  51          1HG1      VAL  51  -3.735 -11.006   6.021
  383   2HG1  VAL  51          2HG1      VAL  51  -5.447 -11.272   6.353
  384   3HG1  VAL  51          3HG1      VAL  51  -4.830 -11.443   4.710
  385   1HG2  VAL  51          1HG2      VAL  51  -5.303 -14.749   6.896
  386   2HG2  VAL  51          2HG2      VAL  51  -6.305 -13.835   5.769
  387   3HG2  VAL  51          3HG2      VAL  51  -5.972 -13.189   7.375
  388    H    HIS  52           H        HIS  52  -3.410 -11.964   2.989
  389    HA   HIS  52           HA       HIS  52  -0.538 -11.773   3.576
  390   1HB   HIS  52          2HB       HIS  52  -1.283 -13.085   1.409
  391   2HB   HIS  52          1HB       HIS  52  -1.474 -11.461   0.756
  392    HD1  HIS  52           1HD      HIS  52   0.493 -11.834  -0.885
  393    HD2  HIS  52           2HD      HIS  52   1.538 -12.123   3.125
  394    HE1  HIS  52           1HE      HIS  52   3.007 -11.777  -0.840
  395    HE2  HIS  52           2HE      HIS  52   3.612 -11.852   1.604
  396    HA   PRO  53           HA       PRO  53  -1.830  -7.476   3.732
  397   1HB   PRO  53          2HB       PRO  53   0.423  -6.469   4.781
  398   2HB   PRO  53          1HB       PRO  53  -0.693  -7.441   5.747
  399   1HG   PRO  53          2HG       PRO  53   1.878  -8.244   4.443
  400   2HG   PRO  53          1HG       PRO  53   1.265  -8.655   6.055
  401   1HD   PRO  53          2HD       PRO  53   1.102 -10.323   3.882
  402   2HD   PRO  53          1HD       PRO  53  -0.018 -10.375   5.258
  403    H    ILE  54           H        ILE  54  -1.777  -5.965   2.192
  404    HA   ILE  54           HA       ILE  54   0.660  -5.576   0.610
  405    HB   ILE  54           HB       ILE  54  -2.015  -5.662  -0.758
  406   1HG1  ILE  54          2HG1      ILE  54  -1.613  -7.882   0.258
  407   2HG1  ILE  54          1HG1      ILE  54  -1.547  -7.930  -1.500
  408   1HG2  ILE  54          1HG2      ILE  54  -0.133  -6.361  -2.580
  409   2HG2  ILE  54          2HG2      ILE  54   0.787  -5.280  -1.533
  410   3HG2  ILE  54          3HG2      ILE  54  -0.695  -4.712  -2.302
  411   1HD1  ILE  54          1HD1      ILE  54   0.286  -9.032   0.166
  412   2HD1  ILE  54          2HD1      ILE  54   1.041  -7.486  -0.225
  413   3HD1  ILE  54          3HD1      ILE  54   0.580  -8.595  -1.518
  414    H    VAL  55           H        VAL  55   0.915  -3.498  -0.224
  415    HA   VAL  55           HA       VAL  55  -1.103  -1.521   0.622
  416    HB   VAL  55           HB       VAL  55   1.884  -1.061   0.598
  417   1HG1  VAL  55          1HG1      VAL  55  -0.080   0.786   0.394
  418   2HG1  VAL  55          2HG1      VAL  55   1.486   1.085   1.146
  419   3HG1  VAL  55          3HG1      VAL  55   0.091   0.682   2.146
  420   1HG2  VAL  55          1HG2      VAL  55   2.050  -1.672   2.758
  421   2HG2  VAL  55          2HG2      VAL  55   0.603  -2.621   2.411
  422   3HG2  VAL  55          3HG2      VAL  55   0.457  -1.034   3.166
  423    H    VAL  56           H        VAL  56  -1.649   0.045  -0.848
  424    HA   VAL  56           HA       VAL  56  -0.171   0.007  -3.400
  425    HB   VAL  56           HB       VAL  56  -3.134   0.448  -3.129
  426   1HG1  VAL  56          1HG1      VAL  56  -3.060   0.041  -5.608
  427   2HG1  VAL  56          2HG1      VAL  56  -1.304   0.164  -5.497
  428   3HG1  VAL  56          3HG1      VAL  56  -2.314   1.545  -5.067
  429   1HG2  VAL  56          1HG2      VAL  56  -1.707  -2.017  -4.106
  430   2HG2  VAL  56          2HG2      VAL  56  -3.452  -1.772  -4.026
  431   3HG2  VAL  56          3HG2      VAL  56  -2.503  -1.860  -2.540
  432    H    VAL  57           H        VAL  57  -0.314   1.979  -4.668
  433    HA   VAL  57           HA       VAL  57  -1.177   4.402  -3.328
  434    HB   VAL  57           HB       VAL  57   1.651   4.478  -4.267
  435   1HG1  VAL  57          1HG1      VAL  57   1.432   5.891  -1.923
  436   2HG1  VAL  57          2HG1      VAL  57  -0.169   6.073  -2.638
  437   3HG1  VAL  57          3HG1      VAL  57   1.262   6.559  -3.547
  438   1HG2  VAL  57          1HG2      VAL  57   0.886   3.453  -1.534
  439   2HG2  VAL  57          2HG2      VAL  57   2.519   3.791  -2.107
  440   3HG2  VAL  57          3HG2      VAL  57   1.584   2.483  -2.831
  441    H    GLN  58           H        GLN  58  -0.400   6.352  -4.796
  442    HA   GLN  58           HA       GLN  58   0.092   6.000  -7.517
  443   1HB   GLN  58          2HB       GLN  58  -2.288   4.980  -7.210
  444   2HB   GLN  58          1HB       GLN  58  -2.807   6.655  -7.114
  445   1HG   GLN  58          2HG       GLN  58  -1.059   5.987  -9.384
  446   2HG   GLN  58          1HG       GLN  58  -2.661   5.253  -9.400
  447   1HE2  GLN  58          1HE2      GLN  58  -1.084   7.658 -10.704
  448   2HE2  GLN  58          2HE2      GLN  58  -2.299   8.884 -10.768
  449    HA   PRO  59           HA       PRO  59   0.523  10.287  -5.876
  450   1HB   PRO  59          2HB       PRO  59   2.693  10.849  -7.452
  451   2HB   PRO  59          1HB       PRO  59   2.802  10.113  -5.851
  452   1HG   PRO  59          2HG       PRO  59   2.891   8.814  -8.543
  453   2HG   PRO  59          1HG       PRO  59   3.874   8.480  -7.104
  454   1HD   PRO  59          2HD       PRO  59   1.800   6.915  -7.806
  455   2HD   PRO  59          1HD       PRO  59   2.207   7.224  -6.105
  456    H    ASP  60           H        ASP  60  -0.942  11.619  -6.720
  457    HA   ASP  60           HA       ASP  60  -0.635  12.872  -9.197
  458   1HB   ASP  60          2HB       ASP  60  -1.623  10.379  -9.631
  459   2HB   ASP  60          1HB       ASP  60  -3.117  11.291  -9.443
  460    H    ALA  61           H        ALA  61  -2.910  11.823  -6.724
  461    HA   ALA  61           HA       ALA  61  -4.156  14.493  -6.825
  462   1HB   ALA  61          1HB       ALA  61  -5.320  11.793  -6.539
  463   2HB   ALA  61          2HB       ALA  61  -5.983  13.245  -7.291
  464   3HB   ALA  61          3HB       ALA  61  -6.023  13.064  -5.538
  465    H    TRP  62           H        TRP  62  -1.772  13.769  -5.343
  466    HA   TRP  62           HA       TRP  62  -2.489  13.410  -2.593
  467   1HB   TRP  62          2HB       TRP  62  -0.052  13.534  -4.154
  468   2HB   TRP  62          1HB       TRP  62   0.097  14.488  -2.682
  469    HD1  TRP  62           HD       TRP  62  -1.708  11.086  -3.144
  470    HE1  TRP  62           1HE      TRP  62  -0.691   9.417  -1.470
  471    HE3  TRP  62           3HE      TRP  62   1.951  14.055  -1.157
  472    HZ2  TRP  62           2HZ      TRP  62   1.387   9.365   0.439
  473    HZ3  TRP  62           3HZ      TRP  62   3.412  13.118   0.588
  474    HH2  TRP  62           HH       TRP  62   3.134  10.822   1.369
  475    H    THR  63           H        THR  63  -1.853  16.133  -4.693
  476    HA   THR  63           HA       THR  63  -2.237  18.360  -4.443
  477    HB   THR  63           HB       THR  63  -3.413  17.915  -1.723
  478    HG1  THR  63           1HG      THR  63  -4.694  17.342  -4.186
  479   1HG2  THR  63          1HG2      THR  63  -3.382  20.068  -3.550
  480   2HG2  THR  63          2HG2      THR  63  -4.194  19.959  -1.988
  481   3HG2  THR  63          3HG2      THR  63  -5.035  19.460  -3.457
  482    H    GLU  64           H        GLU  64  -1.648  17.287  -1.110
  483    HA   GLU  64           HA       GLU  64   0.305  19.400  -0.757
  484   1HB   GLU  64          2HB       GLU  64  -0.999  17.402   1.062
  485   2HB   GLU  64          1HB       GLU  64   0.444  18.261   1.585
  486   1HG   GLU  64          2HG       GLU  64  -1.739  19.905   0.467
  487   2HG   GLU  64          1HG       GLU  64  -2.034  19.144   2.030
  488    H    ASP  65           H        ASP  65   2.450  19.172  -0.847
  489    HA   ASP  65           HA       ASP  65   3.522  16.483  -1.316
  490   1HB   ASP  65          2HB       ASP  65   4.261  19.207  -2.201
  491   2HB   ASP  65          1HB       ASP  65   5.609  18.131  -1.846
  492    H    ASN  66           H        ASN  66   3.372  15.994   0.985
  493    HA   ASN  66           HA       ASN  66   5.067  17.445   2.814
  494   1HB   ASN  66          2HB       ASN  66   2.849  15.809   3.102
  495   2HB   ASN  66          1HB       ASN  66   4.168  14.815   3.714
  496   1HD2  ASN  66          1HD2      ASN  66   2.991  18.157   3.904
  497   2HD2  ASN  66          2HD2      ASN  66   3.284  18.343   5.597
  498    H    GLY  67           H        GLY  67   5.125  14.322   1.152
  499   1HA   GLY  67          2HA       GLY  67   7.699  14.017   0.570
  500   2HA   GLY  67          1HA       GLY  67   7.729  13.685   2.294
  501    H    PHE  68           H        PHE  68   7.427  12.327  -0.728
  502    HA   PHE  68           HA       PHE  68   5.882  10.032   0.235
  503   1HB   PHE  68          2HB       PHE  68   5.386  11.189  -1.994
  504   2HB   PHE  68          1HB       PHE  68   6.868  10.441  -2.584
  505    HD1  PHE  68           1HD      PHE  68   3.488   9.775  -1.281
  506    HD2  PHE  68           2HD      PHE  68   6.948   8.141  -3.141
  507    HE1  PHE  68           1HE      PHE  68   2.246   7.707  -1.763
  508    HE2  PHE  68           2HE      PHE  68   5.713   6.070  -3.629
  509    HZ   PHE  68           HZ       PHE  68   3.361   5.849  -2.933
  510    H    HIS  69           H        HIS  69   8.961  10.883   0.473
  511    HA   HIS  69           HA       HIS  69  10.153   8.403  -0.481
  512   1HB   HIS  69          2HB       HIS  69  11.238  10.987   0.589
  513   2HB   HIS  69          1HB       HIS  69  12.256   9.550   0.561
  514    HD1  HIS  69           1HD      HIS  69  13.743   9.651  -1.400
  515    HD2  HIS  69           2HD      HIS  69   9.963  11.143  -2.263
  516    HE1  HIS  69           1HE      HIS  69  13.806  10.273  -3.836
  517    HE2  HIS  69           2HE      HIS  69  11.487  11.112  -4.352
  518    H    ALA  70           H        ALA  70   8.448   7.600   1.323
  519    HA   ALA  70           HA       ALA  70  10.015   6.365   3.313
  520   1HB   ALA  70          1HB       ALA  70  10.098   8.362   4.528
  521   2HB   ALA  70          2HB       ALA  70   8.801   7.440   5.290
  522   3HB   ALA  70          3HB       ALA  70   8.413   8.751   4.176
  523    H    ILE  71           H        ILE  71   8.034   5.683   1.331
  524    HA   ILE  71           HA       ILE  71   5.567   5.060   2.635
  525    HB   ILE  71           HB       ILE  71   6.612   3.772   0.122
  526   1HG1  ILE  71          2HG1      ILE  71   6.823   6.100  -0.304
  527   2HG1  ILE  71          1HG1      ILE  71   5.293   5.617  -1.027
  528   1HG2  ILE  71          1HG2      ILE  71   3.825   4.310   1.139
  529   2HG2  ILE  71          2HG2      ILE  71   4.632   2.744   1.081
  530   3HG2  ILE  71          3HG2      ILE  71   4.225   3.582  -0.416
  531   1HD1  ILE  71          1HD1      ILE  71   4.576   6.376   1.518
  532   2HD1  ILE  71          2HD1      ILE  71   4.409   7.343   0.053
  533   3HD1  ILE  71          3HD1      ILE  71   5.832   7.532   1.078
  534    H    GLY  72           H        GLY  72   8.294   3.049   1.511
  535   1HA   GLY  72          2HA       GLY  72   7.347   0.626   2.567
  536   2HA   GLY  72          1HA       GLY  72   9.026   0.982   2.190
  537    H    GLN  73           H        GLN  73   9.023   3.282   4.077
  538    HA   GLN  73           HA       GLN  73   9.626   1.733   6.459
  539   1HB   GLN  73          2HB       GLN  73  10.669   3.781   7.288
  540   2HB   GLN  73          1HB       GLN  73  11.250   3.390   5.676
  541   1HG   GLN  73          2HG       GLN  73   9.635   5.041   4.761
  542   2HG   GLN  73          1HG       GLN  73   9.234   5.496   6.416
  543   1HE2  GLN  73          1HE2      GLN  73  10.113   7.391   6.828
  544   2HE2  GLN  73          2HE2      GLN  73  11.727   7.869   6.442
  545    H    MET  74           H        MET  74   7.020   3.543   5.265
  546    HA   MET  74           HA       MET  74   6.050   4.284   7.916
  547   1HB   MET  74          2HB       MET  74   5.396   5.045   5.131
  548   2HB   MET  74          1HB       MET  74   4.046   5.015   6.257
  549   1HG   MET  74          2HG       MET  74   5.957   6.362   7.675
  550   2HG   MET  74          1HG       MET  74   6.257   6.900   6.024
  551   1HE   MET  74          1HE       MET  74   2.738   8.168   4.960
  552   2HE   MET  74          2HE       MET  74   2.606   6.463   5.390
  553   3HE   MET  74          3HE       MET  74   4.017   7.043   4.503
  554    H    CYS  75           H        CYS  75   5.505   1.947   5.392
  555    HA   CYS  75           HA       CYS  75   3.301   0.797   6.976
  556   1HB   CYS  75          2HB       CYS  75   2.419  -0.158   4.912
  557   2HB   CYS  75          1HB       CYS  75   2.575   1.588   4.757
  558    HG   CYS  75           HG       CYS  75   3.854   1.144   2.729
  559    H    GLU  76           H        GLU  76   3.146  -1.536   6.993
  560    HA   GLU  76           HA       GLU  76   5.797  -2.797   6.821
  561   1HB   GLU  76          2HB       GLU  76   3.379  -3.548   8.474
  562   2HB   GLU  76          1HB       GLU  76   4.881  -4.460   8.427
  563   1HG   GLU  76          2HG       GLU  76   6.005  -2.950   9.693
  564   2HG   GLU  76          1HG       GLU  76   5.059  -1.584   9.101
  565    H    ALA  77           H        ALA  77   4.356  -2.530   4.463
  566    HA   ALA  77           HA       ALA  77   4.064  -5.313   3.724
  567   1HB   ALA  77          1HB       ALA  77   1.839  -5.293   4.023
  568   2HB   ALA  77          2HB       ALA  77   1.815  -4.385   2.510
  569   3HB   ALA  77          3HB       ALA  77   1.759  -3.532   4.053
  570    HA   PRO  78           HA       PRO  78   5.636  -4.002  -0.173
  571   1HB   PRO  78          2HB       PRO  78   4.073  -5.298  -2.000
  572   2HB   PRO  78          1HB       PRO  78   5.329  -6.097  -1.046
  573   1HG   PRO  78          2HG       PRO  78   2.371  -6.002  -0.587
  574   2HG   PRO  78          1HG       PRO  78   3.481  -7.378  -0.442
  575   1HD   PRO  78          2HD       PRO  78   2.613  -6.021   1.713
  576   2HD   PRO  78          1HD       PRO  78   4.253  -6.700   1.632
  577    H    VAL  79           H        VAL  79   5.445  -2.059  -1.052
  578    HA   VAL  79           HA       VAL  79   2.811  -0.855  -1.393
  579    HB   VAL  79           HB       VAL  79   5.517   0.408  -1.838
  580   1HG1  VAL  79          1HG1      VAL  79   4.461   2.423  -2.049
  581   2HG1  VAL  79          2HG1      VAL  79   3.069   1.920  -1.090
  582   3HG1  VAL  79          3HG1      VAL  79   3.239   1.364  -2.755
  583   1HG2  VAL  79          1HG2      VAL  79   4.984  -0.531   0.511
  584   2HG2  VAL  79          2HG2      VAL  79   3.849   0.815   0.614
  585   3HG2  VAL  79          3HG2      VAL  79   5.566   1.127   0.369
  586    H    VAL  80           H        VAL  80   1.822  -0.646  -3.324
  587    HA   VAL  80           HA       VAL  80   3.443  -0.712  -5.764
  588    HB   VAL  80           HB       VAL  80   1.880  -2.313  -6.834
  589   1HG1  VAL  80          1HG1      VAL  80   3.459  -3.211  -4.439
  590   2HG1  VAL  80          2HG1      VAL  80   3.935  -3.230  -6.138
  591   3HG1  VAL  80          3HG1      VAL  80   2.700  -4.345  -5.556
  592   1HG2  VAL  80          1HG2      VAL  80   0.206  -1.805  -4.780
  593   2HG2  VAL  80          2HG2      VAL  80   0.915  -3.328  -4.242
  594   3HG2  VAL  80          3HG2      VAL  80   0.099  -3.238  -5.803
  595    H    THR  81           H        THR  81   1.826  -0.443  -7.723
  596    HA   THR  81           HA       THR  81   0.171   1.878  -7.054
  597    HB   THR  81           HB       THR  81   0.351   2.539  -9.318
  598    HG1  THR  81           1HG      THR  81   1.459   0.013  -9.957
  599   1HG2  THR  81          1HG2      THR  81   2.568   2.427  -7.919
  600   2HG2  THR  81          2HG2      THR  81   2.579   2.887  -9.622
  601   3HG2  THR  81          3HG2      THR  81   3.016   1.245  -9.148
  602    H    ARG  82           H        ARG  82  -1.918   2.094  -8.274
  603    HA   ARG  82           HA       ARG  82  -3.618  -0.034  -7.699
  604   1HB   ARG  82          2HB       ARG  82  -5.177   1.201  -9.399
  605   2HB   ARG  82          1HB       ARG  82  -4.758   1.954  -7.868
  606   1HG   ARG  82          2HG       ARG  82  -3.575   3.600  -8.851
  607   2HG   ARG  82          1HG       ARG  82  -2.954   2.546 -10.116
  608   1HD   ARG  82          2HD       ARG  82  -5.831   2.984 -10.292
  609   2HD   ARG  82          1HD       ARG  82  -4.892   4.469 -10.429
  610    HE   ARG  82           HE       ARG  82  -3.715   2.568 -12.090
  611   1HH1  ARG  82          1HH1      ARG  82  -6.719   4.328 -11.847
  612   2HH1  ARG  82          2HH1      ARG  82  -7.008   4.316 -13.554
  613   1HH2  ARG  82          1HH2      ARG  82  -4.094   2.551 -14.335
  614   2HH2  ARG  82          2HH2      ARG  82  -5.519   3.307 -14.968
  615    H    GLU  83           H        GLU  83  -1.553   0.410 -10.405
  616    HA   GLU  83           HA       GLU  83  -2.812  -0.863 -12.480
  617   1HB   GLU  83          2HB       GLU  83  -0.214  -0.066 -11.927
  618   2HB   GLU  83          1HB       GLU  83  -0.064  -1.800 -12.176
  619   1HG   GLU  83          2HG       GLU  83  -0.759  -1.680 -14.372
  620   2HG   GLU  83          1HG       GLU  83  -1.588  -0.143 -14.134
  621    H    TRP  84           H        TRP  84  -1.110  -2.377  -9.761
  622    HA   TRP  84           HA       TRP  84  -1.322  -5.045 -10.532
  623   1HB   TRP  84          2HB       TRP  84  -0.007  -4.282  -8.596
  624   2HB   TRP  84          1HB       TRP  84  -1.486  -3.874  -7.747
  625    HD1  TRP  84           HD       TRP  84   0.259  -7.028  -9.184
  626    HE1  TRP  84           1HE      TRP  84  -0.397  -9.031  -7.704
  627    HE3  TRP  84           3HE      TRP  84  -3.012  -4.678  -6.037
  628    HZ2  TRP  84           2HZ      TRP  84  -2.081  -9.544  -5.494
  629    HZ3  TRP  84           3HZ      TRP  84  -4.102  -5.994  -4.269
  630    HH2  TRP  84           HH       TRP  84  -3.649  -8.375  -4.003
  631    H    VAL  85           H        VAL  85  -3.427  -3.222  -8.366
  632    HA   VAL  85           HA       VAL  85  -5.421  -5.106  -7.994
  633    HB   VAL  85           HB       VAL  85  -5.796  -2.112  -8.133
  634   1HG1  VAL  85          1HG1      VAL  85  -7.526  -2.975  -6.252
  635   2HG1  VAL  85          2HG1      VAL  85  -7.550  -4.348  -7.360
  636   3HG1  VAL  85          3HG1      VAL  85  -7.955  -2.734  -7.945
  637   1HG2  VAL  85          1HG2      VAL  85  -4.958  -3.911  -5.865
  638   2HG2  VAL  85          2HG2      VAL  85  -5.507  -2.248  -5.650
  639   3HG2  VAL  85          3HG2      VAL  85  -4.046  -2.581  -6.580
  640    H    LEU  86           H        LEU  86  -5.127  -2.666 -10.539
  641    HA   LEU  86           HA       LEU  86  -7.619  -3.278 -11.769
  642   1HB   LEU  86          2HB       LEU  86  -5.645  -1.325 -12.056
  643   2HB   LEU  86          1HB       LEU  86  -5.646  -2.177 -13.588
  644    HG   LEU  86           HG       LEU  86  -8.281  -1.808 -13.342
  645   1HD1  LEU  86          1HD1      LEU  86  -7.453   0.821 -12.300
  646   2HD1  LEU  86          2HD1      LEU  86  -7.512  -0.495 -11.127
  647   3HD1  LEU  86          3HD1      LEU  86  -8.950  -0.080 -12.060
  648   1HD2  LEU  86          1HD2      LEU  86  -7.483  -1.006 -15.302
  649   2HD2  LEU  86          2HD2      LEU  86  -6.094  -0.226 -14.546
  650   3HD2  LEU  86          3HD2      LEU  86  -7.681   0.540 -14.479
  651    H    ASP  87           H        ASP  87  -4.260  -4.099 -12.596
  652    HA   ASP  87           HA       ASP  87  -4.823  -5.660 -14.849
  653   1HB   ASP  87          2HB       ASP  87  -2.566  -4.817 -14.214
  654   2HB   ASP  87          1HB       ASP  87  -2.520  -6.005 -12.914
  655    H    SER  88           H        SER  88  -4.864  -6.414 -11.431
  656    HA   SER  88           HA       SER  88  -5.076  -9.252 -11.808
  657   1HB   SER  88          2HB       SER  88  -5.622  -7.541  -9.371
  658   2HB   SER  88          1HB       SER  88  -5.568  -9.305  -9.380
  659    HG   SER  88           HG       SER  88  -3.572  -8.394  -8.736
  660    H    VAL  89           H        VAL  89  -7.353  -6.670 -10.902
  661    HA   VAL  89           HA       VAL  89  -9.613  -8.399 -10.802
  662    HB   VAL  89           HB       VAL  89  -9.578  -5.398 -11.147
  663   1HG1  VAL  89          1HG1      VAL  89 -11.727  -6.528 -11.676
  664   2HG1  VAL  89          2HG1      VAL  89 -11.825  -5.436 -10.295
  665   3HG1  VAL  89          3HG1      VAL  89 -11.743  -7.179 -10.037
  666   1HG2  VAL  89          1HG2      VAL  89  -9.240  -5.129  -8.933
  667   2HG2  VAL  89          2HG2      VAL  89  -8.468  -6.709  -9.068
  668   3HG2  VAL  89          3HG2      VAL  89 -10.137  -6.588  -8.510
  669    H    ALA  90           H        ALA  90  -8.007  -6.673 -13.348
  670    HA   ALA  90           HA       ALA  90 -10.181  -6.635 -15.186
  671   1HB   ALA  90          1HB       ALA  90  -8.544  -5.990 -16.839
  672   2HB   ALA  90          2HB       ALA  90  -7.228  -6.491 -15.777
  673   3HB   ALA  90          3HB       ALA  90  -8.241  -5.116 -15.337
  674    H    LEU  91           H        LEU  91  -7.246  -8.659 -15.022
  675    HA   LEU  91           HA       LEU  91  -8.510 -10.569 -16.843
  676   1HB   LEU  91          2HB       LEU  91  -6.270  -9.857 -17.424
  677   2HB   LEU  91          1HB       LEU  91  -5.675 -10.333 -15.846
  678    HG   LEU  91           HG       LEU  91  -6.960 -12.527 -17.294
  679   1HD1  LEU  91          1HD1      LEU  91  -4.866 -10.907 -18.605
  680   2HD1  LEU  91          2HD1      LEU  91  -6.115 -11.936 -19.306
  681   3HD1  LEU  91          3HD1      LEU  91  -4.652 -12.657 -18.637
  682   1HD2  LEU  91          1HD2      LEU  91  -5.340 -13.780 -16.282
  683   2HD2  LEU  91          2HD2      LEU  91  -5.383 -12.403 -15.182
  684   3HD2  LEU  91          3HD2      LEU  91  -4.121 -12.512 -16.410
  685    H    TYR  92           H        TYR  92  -8.538 -10.110 -13.627
  686    HA   TYR  92           HA       TYR  92  -8.843 -11.417 -11.788
  687   1HB   TYR  92          2HB       TYR  92 -10.253 -12.641 -13.984
  688   2HB   TYR  92          1HB       TYR  92  -9.694 -13.879 -12.864
  689    HD1  TYR  92           1HD      TYR  92  -9.893 -12.441 -10.281
  690    HD2  TYR  92           2HD      TYR  92 -12.550 -12.523 -13.605
  691    HE1  TYR  92           1HE      TYR  92 -11.775 -11.937  -8.782
  692    HE2  TYR  92           2HE      TYR  92 -14.439 -12.016 -12.115
  693    HH   TYR  92           HH       TYR  92 -13.953 -11.437  -8.649
  694    H    GLN  93           H        GLN  93  -6.579 -11.521 -11.344
  695    HA   GLN  93           HA       GLN  93  -5.608 -14.101 -10.888
  696   1HB   GLN  93          2HB       GLN  93  -5.277 -13.493 -13.527
  697   2HB   GLN  93          1HB       GLN  93  -3.747 -12.945 -12.857
  698   1HG   GLN  93          2HG       GLN  93  -4.367 -15.507 -11.772
  699   2HG   GLN  93          1HG       GLN  93  -4.531 -15.568 -13.526
  700   1HE2  GLN  93          1HE2      GLN  93  -2.719 -15.014 -14.817
  701   2HE2  GLN  93          2HE2      GLN  93  -1.114 -15.143 -14.190
  702    H    CYS  94           H        CYS  94  -4.153 -13.990  -9.290
  703    HA   CYS  94           HA       CYS  94  -3.389 -11.472  -8.228
  704   1HB   CYS  94          2HB       CYS  94  -3.765 -13.608  -6.920
  705   2HB   CYS  94          1HB       CYS  94  -2.197 -14.152  -7.507
  706    HG   CYS  94           HG       CYS  94  -1.771 -13.093  -5.215
  707    H    GLN  95           H        GLN  95  -2.313 -10.560 -10.102
  708    HA   GLN  95           HA       GLN  95   0.027 -11.625 -11.233
  709   1HB   GLN  95          2HB       GLN  95  -0.715  -8.707 -10.969
  710   2HB   GLN  95          1HB       GLN  95   0.418  -9.397 -12.123
  711   1HG   GLN  95          2HG       GLN  95  -2.511 -10.069 -12.028
  712   2HG   GLN  95          1HG       GLN  95  -1.806  -8.836 -13.071
  713   1HE2  GLN  95          1HE2      GLN  95   0.038  -9.641 -14.449
  714   2HE2  GLN  95          2HE2      GLN  95  -0.163 -11.190 -15.186
  715    H    GLU  96           H        GLU  96   2.174 -10.337 -11.100
  716    HA   GLU  96           HA       GLU  96   3.108 -10.589  -8.396
  717   1HB   GLU  96          2HB       GLU  96   4.756  -9.393 -10.597
  718   2HB   GLU  96          1HB       GLU  96   5.265 -10.410  -9.258
  719   1HG   GLU  96          2HG       GLU  96   3.808 -11.251 -11.747
  720   2HG   GLU  96          1HG       GLU  96   5.442 -11.686 -11.251
  721    H    LEU  97           H        LEU  97   4.164  -8.945  -7.175
  722    HA   LEU  97           HA       LEU  97   2.932  -6.326  -7.554
  723   1HB   LEU  97          2HB       LEU  97   4.138  -7.788  -5.259
  724   2HB   LEU  97          1HB       LEU  97   4.176  -6.034  -5.225
  725    HG   LEU  97           HG       LEU  97   1.581  -6.421  -5.838
  726   1HD1  LEU  97          1HD1      LEU  97   0.912  -8.255  -4.123
  727   2HD1  LEU  97          2HD1      LEU  97   2.530  -8.881  -4.438
  728   3HD1  LEU  97          3HD1      LEU  97   1.375  -8.716  -5.761
  729   1HD2  LEU  97          1HD2      LEU  97   1.241  -5.415  -3.864
  730   2HD2  LEU  97          2HD2      LEU  97   3.001  -5.398  -3.747
  731   3HD2  LEU  97          3HD2      LEU  97   2.078  -6.681  -2.964
  732    H    ASP  98           H        ASP  98   6.015  -7.904  -7.685
  733    HA   ASP  98           HA       ASP  98   7.732  -5.717  -7.407
  734   1HB   ASP  98          2HB       ASP  98   8.305  -8.220  -7.563
  735   2HB   ASP  98          1HB       ASP  98   8.256  -7.994  -9.309
  736    H    THR  99           H        THR  99   5.807  -6.803 -10.113
  737    HA   THR  99           HA       THR  99   7.084  -5.170 -12.075
  738    HB   THR  99           HB       THR  99   4.247  -6.056 -12.375
  739    HG1  THR  99           1HG      THR  99   6.500  -7.757 -12.227
  740   1HG2  THR  99          1HG2      THR  99   6.641  -5.943 -14.176
  741   2HG2  THR  99          2HG2      THR  99   5.112  -5.076 -14.321
  742   3HG2  THR  99          3HG2      THR  99   5.169  -6.816 -14.599
  743    H    TYR 100           H        TYR 100   4.858  -4.527  -9.570
  744    HA   TYR 100           HA       TYR 100   4.419  -1.840 -10.662
  745   1HB   TYR 100          2HB       TYR 100   2.237  -3.271  -9.160
  746   2HB   TYR 100          1HB       TYR 100   2.119  -1.825 -10.155
  747    HD1  TYR 100           1HD      TYR 100   2.807  -2.211 -12.701
  748    HD2  TYR 100           2HD      TYR 100   1.464  -5.254 -10.048
  749    HE1  TYR 100           1HE      TYR 100   2.137  -3.585 -14.627
  750    HE2  TYR 100           2HE      TYR 100   0.791  -6.637 -11.966
  751    HH   TYR 100           HH       TYR 100   0.484  -5.451 -15.071
  752    H    LEU 101           H        LEU 101   6.277  -2.926  -8.683
  753    HA   LEU 101           HA       LEU 101   5.286  -1.794  -6.174
  754   1HB   LEU 101          2HB       LEU 101   6.936  -3.979  -6.808
  755   2HB   LEU 101          1HB       LEU 101   7.986  -2.799  -6.051
  756    HG   LEU 101           HG       LEU 101   5.448  -3.268  -4.636
  757   1HD1  LEU 101          1HD1      LEU 101   6.508  -5.531  -5.626
  758   2HD1  LEU 101          2HD1      LEU 101   5.684  -5.436  -4.069
  759   3HD1  LEU 101          3HD1      LEU 101   7.445  -5.375  -4.140
  760   1HD2  LEU 101          1HD2      LEU 101   7.170  -3.464  -2.744
  761   2HD2  LEU 101          2HD2      LEU 101   6.977  -1.898  -3.532
  762   3HD2  LEU 101          3HD2      LEU 101   8.345  -2.931  -3.946
  763    H    ILE 102           H        ILE 102   6.866  -0.454  -4.906
  764    HA   ILE 102           HA       ILE 102   8.547   1.221  -6.640
  765    HB   ILE 102           HB       ILE 102   7.773   3.233  -5.399
  766   1HG1  ILE 102          2HG1      ILE 102   5.216   2.209  -4.569
  767   2HG1  ILE 102          1HG1      ILE 102   6.497   1.296  -3.776
  768   1HG2  ILE 102          1HG2      ILE 102   6.185   3.650  -6.950
  769   2HG2  ILE 102          2HG2      ILE 102   5.294   2.171  -6.596
  770   3HG2  ILE 102          3HG2      ILE 102   6.738   2.109  -7.605
  771   1HD1  ILE 102          1HD1      ILE 102   6.752   2.937  -2.325
  772   2HD1  ILE 102          2HD1      ILE 102   5.494   3.866  -3.143
  773   3HD1  ILE 102          3HD1      ILE 102   7.179   4.037  -3.636
  774    HA   PRO 103           HA       PRO 103  11.029   0.109  -2.974
  775   1HB   PRO 103          2HB       PRO 103  13.407   0.049  -4.232
  776   2HB   PRO 103          1HB       PRO 103  12.257  -1.288  -4.344
  777   1HG   PRO 103          2HG       PRO 103  12.809   0.905  -6.302
  778   2HG   PRO 103          1HG       PRO 103  12.545  -0.823  -6.600
  779   1HD   PRO 103          2HD       PRO 103  10.613   1.091  -6.926
  780   2HD   PRO 103          1HD       PRO 103  10.264  -0.606  -6.545
  781    H    GLN 104           H        GLN 104  13.464   1.124  -2.554
  782    HA   GLN 104           HA       GLN 104  13.016   4.032  -2.602
  783   1HB   GLN 104          2HB       GLN 104  13.300   2.547  -0.412
  784   2HB   GLN 104          1HB       GLN 104  15.004   2.799  -0.759
  785   1HG   GLN 104          2HG       GLN 104  14.886   4.763   0.242
  786   2HG   GLN 104          1HG       GLN 104  13.767   5.308  -1.005
  787   1HE2  GLN 104          1HE2      GLN 104  13.703   6.257   1.603
  788   2HE2  GLN 104          2HE2      GLN 104  12.236   5.737   2.352
  789    H    ILE 105           H        ILE 105  15.134   5.309  -2.458
  790    HA   ILE 105           HA       ILE 105  17.142   4.115  -4.253
  791    HB   ILE 105           HB       ILE 105  17.485   6.496  -5.111
  792   1HG1  ILE 105          2HG1      ILE 105  14.627   6.994  -4.432
  793   2HG1  ILE 105          1HG1      ILE 105  15.824   7.266  -3.170
  794   1HG2  ILE 105          1HG2      ILE 105  16.268   5.956  -6.933
  795   2HG2  ILE 105          2HG2      ILE 105  14.805   5.646  -5.997
  796   3HG2  ILE 105          3HG2      ILE 105  16.075   4.425  -6.079
  797   1HD1  ILE 105          1HD1      ILE 105  15.668   9.341  -4.129
  798   2HD1  ILE 105          2HD1      ILE 105  15.436   8.693  -5.752
  799   3HD1  ILE 105          3HD1      ILE 105  17.034   8.655  -5.008
  800    HA   PRO 106           HA       PRO 106  19.646   5.010  -0.574
  801   1HB   PRO 106          2HB       PRO 106  21.727   4.299  -2.591
  802   2HB   PRO 106          1HB       PRO 106  21.542   3.746  -0.922
  803   1HG   PRO 106          2HG       PRO 106  20.869   2.165  -2.952
  804   2HG   PRO 106          1HG       PRO 106  19.891   2.213  -1.473
  805   1HD   PRO 106          2HD       PRO 106  19.343   3.405  -4.152
  806   2HD   PRO 106          1HD       PRO 106  18.213   2.720  -2.965
  807    H    HIS 107           H        HIS 107  20.935   6.719   0.033
  808    HA   HIS 107           HA       HIS 107  22.340   8.389  -1.767
  809   1HB   HIS 107          2HB       HIS 107  19.723   8.899  -2.004
  810   2HB   HIS 107          1HB       HIS 107  20.066   9.919  -0.612
  811    HD1  HIS 107           1HD      HIS 107  22.797  11.044  -1.393
  812    HD2  HIS 107           2HD      HIS 107  19.601  10.705  -4.027
  813    HE1  HIS 107           1HE      HIS 107  23.239  12.728  -3.206
  814    HE2  HIS 107           2HE      HIS 107  21.248  12.566  -4.742
  815    H    SER 108           H        SER 108  20.465   8.616   1.258
  816    HA   SER 108           HA       SER 108  22.720   8.750   2.928
  817   1HB   SER 108          2HB       SER 108  22.640  11.124   3.594
  818   2HB   SER 108          1HB       SER 108  23.077  10.944   1.895
  819    HG   SER 108           HG       SER 108  21.404  12.566   2.472
  820    H    HIS 109           H        HIS 109  22.126   9.404   5.187
  821    HA   HIS 109           HA       HIS 109  19.692   8.150   5.926
  822   1HB   HIS 109          2HB       HIS 109  20.298   8.803   8.224
  823   2HB   HIS 109          1HB       HIS 109  21.656   8.074   7.374
  824    HD1  HIS 109           1HD      HIS 109  22.265   9.791   9.779
  825    HD2  HIS 109           2HD      HIS 109  22.018  11.310   5.920
  826    HE1  HIS 109           1HE      HIS 109  23.597  11.923   9.811
  827    HE2  HIS 109           2HE      HIS 109  23.368  12.867   7.485
  828    H    TYR 110           H        TYR 110  17.735   8.965   6.404
  829    HA   TYR 110           HA       TYR 110  17.431  11.874   6.634
  830   1HB   TYR 110          2HB       TYR 110  16.931  11.161   4.289
  831   2HB   TYR 110          1HB       TYR 110  15.641  10.141   4.919
  832    HD1  TYR 110           1HD      TYR 110  13.614  11.146   5.869
  833    HD2  TYR 110           2HD      TYR 110  16.674  13.551   4.153
  834    HE1  TYR 110           1HE      TYR 110  12.055  13.045   5.765
  835    HE2  TYR 110           2HE      TYR 110  15.126  15.457   4.046
  836    HH   TYR 110           HH       TYR 110  12.703  15.952   5.643
  Start of MODEL    8
    1   1H    GLY   1          1HT       GLY   1 -19.071 -18.425   1.815
    2   2H    GLY   1          2HT       GLY   1 -17.828 -17.955   2.861
    3   3H    GLY   1          3HT       GLY   1 -18.310 -19.574   2.797
    4   1HA   GLY   1          1HA       GLY   1 -17.384 -18.328   0.319
    5   2HA   GLY   1          2HA       GLY   1 -16.179 -18.724   1.535
    6    H    SER   2           H        SER   2 -19.142 -20.535   0.973
    7    HA   SER   2           HA       SER   2 -17.768 -23.002   0.819
    8   1HB   SER   2          2HB       SER   2 -20.613 -22.264   0.104
    9   2HB   SER   2          1HB       SER   2 -20.004 -23.918   0.145
   10    HG   SER   2           HG       SER   2 -19.525 -23.604   2.357
   11    H    GLN   3           H        GLN   3 -19.844 -21.560  -1.695
   12    HA   GLN   3           HA       GLN   3 -18.198 -22.889  -3.721
   13   1HB   GLN   3          2HB       GLN   3 -20.949 -21.648  -3.850
   14   2HB   GLN   3          1HB       GLN   3 -20.095 -22.262  -5.259
   15   1HG   GLN   3          2HG       GLN   3 -20.585 -24.000  -2.874
   16   2HG   GLN   3          1HG       GLN   3 -21.823 -23.767  -4.106
   17   1HE2  GLN   3          1HE2      GLN   3 -19.751 -25.940  -3.162
   18   2HE2  GLN   3          2HE2      GLN   3 -19.214 -26.600  -4.666
   19    H    ASP   4           H        ASP   4 -16.466 -21.593  -4.082
   20    HA   ASP   4           HA       ASP   4 -16.874 -19.209  -5.599
   21   1HB   ASP   4          2HB       ASP   4 -16.263 -19.009  -2.721
   22   2HB   ASP   4          1HB       ASP   4 -15.224 -18.045  -3.766
   23    H    ARG   5           H        ARG   5 -14.460 -18.040  -5.572
   24    HA   ARG   5           HA       ARG   5 -12.375 -20.047  -5.664
   25   1HB   ARG   5          2HB       ARG   5 -13.770 -19.855  -7.923
   26   2HB   ARG   5          1HB       ARG   5 -12.684 -18.496  -8.182
   27   1HG   ARG   5          2HG       ARG   5 -11.032 -20.567  -7.334
   28   2HG   ARG   5          1HG       ARG   5 -12.188 -21.327  -8.430
   29   1HD   ARG   5          2HD       ARG   5 -10.765 -20.631 -10.026
   30   2HD   ARG   5          1HD       ARG   5 -11.579 -19.082  -9.813
   31    HE   ARG   5           HE       ARG   5  -9.591 -18.979  -7.989
   32   1HH1  ARG   5          1HH1      ARG   5  -9.649 -19.709 -11.401
   33   2HH1  ARG   5          2HH1      ARG   5  -8.051 -19.103 -11.685
   34   1HH2  ARG   5          1HH2      ARG   5  -7.490 -18.182  -8.360
   35   2HH2  ARG   5          2HH2      ARG   5  -6.826 -18.237  -9.959
   36    H    LYS   6           H        LYS   6 -12.923 -16.845  -7.100
   37    HA   LYS   6           HA       LYS   6 -11.788 -14.877  -6.921
   38   1HB   LYS   6          2HB       LYS   6 -10.692 -15.697  -4.257
   39   2HB   LYS   6          1HB       LYS   6 -11.259 -14.126  -4.789
   40   1HG   LYS   6          2HG       LYS   6 -13.384 -16.099  -4.787
   41   2HG   LYS   6          1HG       LYS   6 -12.630 -15.916  -3.203
   42   1HD   LYS   6          2HD       LYS   6 -12.869 -13.339  -3.831
   43   2HD   LYS   6          1HD       LYS   6 -14.200 -13.972  -4.803
   44   1HE   LYS   6          2HE       LYS   6 -14.503 -15.254  -2.376
   45   2HE   LYS   6          1HE       LYS   6 -13.984 -13.632  -1.919
   46   1HZ   LYS   6          1HZ       LYS   6 -15.819 -13.082  -3.776
   47   2HZ   LYS   6          2HZ       LYS   6 -16.161 -13.188  -2.123
   48   3HZ   LYS   6          3HZ       LYS   6 -16.464 -14.509  -3.135
   49    H    ILE   7           H        ILE   7  -9.523 -13.929  -6.586
   50    HA   ILE   7           HA       ILE   7  -7.557 -15.943  -7.459
   51    HB   ILE   7           HB       ILE   7  -6.340 -14.044  -8.514
   52   1HG1  ILE   7          2HG1      ILE   7  -8.527 -12.237  -8.807
   53   2HG1  ILE   7          1HG1      ILE   7  -8.282 -12.517  -7.088
   54   1HG2  ILE   7          1HG2      ILE   7  -9.122 -14.212  -9.615
   55   2HG2  ILE   7          2HG2      ILE   7  -8.033 -15.598  -9.642
   56   3HG2  ILE   7          3HG2      ILE   7  -7.591 -14.113 -10.481
   57   1HD1  ILE   7          1HD1      ILE   7  -6.412 -11.335  -9.091
   58   2HD1  ILE   7          2HD1      ILE   7  -5.801 -12.051  -7.599
   59   3HD1  ILE   7          3HD1      ILE   7  -6.932 -10.699  -7.530
   60    H    PHE   8           H        PHE   8  -8.256 -13.567  -5.072
   61    HA   PHE   8           HA       PHE   8  -5.484 -13.453  -4.163
   62   1HB   PHE   8          2HB       PHE   8  -7.987 -12.003  -3.302
   63   2HB   PHE   8          1HB       PHE   8  -6.468 -11.873  -2.433
   64    HD1  PHE   8           1HD      PHE   8  -4.760 -11.988  -5.058
   65    HD2  PHE   8           2HD      PHE   8  -8.095  -9.661  -3.799
   66    HE1  PHE   8           1HE      PHE   8  -4.061 -10.176  -6.563
   67    HE2  PHE   8           2HE      PHE   8  -7.400  -7.847  -5.306
   68    HZ   PHE   8           HZ       PHE   8  -5.383  -8.101  -6.689
   69    H    ARG   9           H        ARG   9  -8.680 -14.459  -2.982
   70    HA   ARG   9           HA       ARG   9  -9.298 -15.706  -1.157
   71   1HB   ARG   9          2HB       ARG   9  -8.518 -17.385  -2.813
   72   2HB   ARG   9          1HB       ARG   9  -6.925 -17.340  -2.071
   73   1HG   ARG   9          2HG       ARG   9  -7.637 -18.426  -0.161
   74   2HG   ARG   9          1HG       ARG   9  -9.326 -17.983  -0.416
   75   1HD   ARG   9          2HD       ARG   9  -8.884 -19.443  -2.632
   76   2HD   ARG   9          1HD       ARG   9  -7.760 -20.227  -1.523
   77    HE   ARG   9           HE       ARG   9 -10.042 -20.107  -0.087
   78   1HH1  ARG   9          1HH1      ARG   9  -9.315 -21.277  -3.294
   79   2HH1  ARG   9          2HH1      ARG   9 -10.557 -22.482  -3.271
   80   1HH2  ARG   9          1HH2      ARG   9 -11.676 -21.694  -0.056
   81   2HH2  ARG   9          2HH2      ARG   9 -11.898 -22.719  -1.433
   82    H    GLY  10           H        GLY  10  -8.840 -14.284   0.542
   83   1HA   GLY  10          2HA       GLY  10  -7.927 -13.829   2.619
   84   2HA   GLY  10          1HA       GLY  10  -6.887 -15.231   2.409
   85    H    LEU  11           H        LEU  11  -7.323 -11.900   1.324
   86    HA   LEU  11           HA       LEU  11  -4.451 -11.462   1.532
   87   1HB   LEU  11          2HB       LEU  11  -5.334 -12.195  -0.860
   88   2HB   LEU  11          1HB       LEU  11  -5.776 -10.503  -0.958
   89    HG   LEU  11           HG       LEU  11  -2.983 -11.417  -0.313
   90   1HD1  LEU  11          1HD1      LEU  11  -4.050 -12.122  -2.609
   91   2HD1  LEU  11          2HD1      LEU  11  -2.409 -11.482  -2.524
   92   3HD1  LEU  11          3HD1      LEU  11  -3.739 -10.435  -3.015
   93   1HD2  LEU  11          1HD2      LEU  11  -4.311  -8.901  -0.350
   94   2HD2  LEU  11          2HD2      LEU  11  -3.129  -8.933  -1.657
   95   3HD2  LEU  11          3HD2      LEU  11  -2.621  -9.256   0.001
   96    H    GLU  12           H        GLU  12  -4.210  -9.649   2.688
   97    HA   GLU  12           HA       GLU  12  -6.380  -7.694   2.724
   98   1HB   GLU  12          2HB       GLU  12  -4.241  -8.496   4.580
   99   2HB   GLU  12          1HB       GLU  12  -4.556  -6.768   4.530
  100   1HG   GLU  12          2HG       GLU  12  -6.552  -6.965   5.537
  101   2HG   GLU  12          1HG       GLU  12  -6.940  -8.472   4.710
  102    H    ILE  13           H        ILE  13  -6.291  -5.863   1.614
  103    HA   ILE  13           HA       ILE  13  -3.662  -4.755   0.903
  104    HB   ILE  13           HB       ILE  13  -6.015  -4.860  -0.986
  105   1HG1  ILE  13          2HG1      ILE  13  -3.624  -6.239  -1.870
  106   2HG1  ILE  13          1HG1      ILE  13  -4.219  -6.916  -0.357
  107   1HG2  ILE  13          1HG2      ILE  13  -4.533  -2.897  -1.222
  108   2HG2  ILE  13          2HG2      ILE  13  -4.499  -3.957  -2.631
  109   3HG2  ILE  13          3HG2      ILE  13  -3.171  -3.989  -1.473
  110   1HD1  ILE  13          1HD1      ILE  13  -5.453  -8.168  -1.757
  111   2HD1  ILE  13          2HD1      ILE  13  -5.396  -6.974  -3.054
  112   3HD1  ILE  13          3HD1      ILE  13  -6.522  -6.765  -1.713
  113    H    CYS  14           H        CYS  14  -3.457  -2.646   1.329
  114    HA   CYS  14           HA       CYS  14  -5.905  -1.075   1.786
  115   1HB   CYS  14          2HB       CYS  14  -4.771   0.123   3.555
  116   2HB   CYS  14          1HB       CYS  14  -4.685  -1.604   3.876
  117    HG   CYS  14           HG       CYS  14  -2.358  -0.264   4.229
  118    H    CYS  15           H        CYS  15  -5.930   1.064   1.115
  119    HA   CYS  15           HA       CYS  15  -3.823   1.766  -0.813
  120   1HB   CYS  15          2HB       CYS  15  -5.520   3.264  -1.827
  121   2HB   CYS  15          1HB       CYS  15  -6.015   1.575  -1.832
  122    HG   CYS  15           HG       CYS  15  -7.754   2.088  -0.024
  123    H    TYR  16           H        TYR  16  -2.548   3.449  -0.434
  124    HA   TYR  16           HA       TYR  16  -3.082   5.094   1.918
  125   1HB   TYR  16          2HB       TYR  16  -0.800   3.918   1.138
  126   2HB   TYR  16          1HB       TYR  16  -0.599   5.470   0.334
  127    HD1  TYR  16           1HD      TYR  16   0.255   7.283   1.519
  128    HD2  TYR  16           2HD      TYR  16  -1.364   3.986   3.666
  129    HE1  TYR  16           1HE      TYR  16   1.042   8.276   3.626
  130    HE2  TYR  16           2HE      TYR  16  -0.583   4.971   5.779
  131    HH   TYR  16           HH       TYR  16   0.446   8.158   6.054
  132    H    GLY  17           H        GLY  17  -4.391   6.767   1.494
  133   1HA   GLY  17          2HA       GLY  17  -4.948   8.864   0.713
  134   2HA   GLY  17          1HA       GLY  17  -3.468   8.859  -0.232
  135    HA   PRO  18           HA       PRO  18  -7.237   8.352  -3.016
  136   1HB   PRO  18          2HB       PRO  18  -6.906  10.614  -4.471
  137   2HB   PRO  18          1HB       PRO  18  -7.829  10.574  -2.964
  138   1HG   PRO  18          2HG       PRO  18  -5.009  11.464  -3.434
  139   2HG   PRO  18          1HG       PRO  18  -6.272  12.224  -2.449
  140   1HD   PRO  18          2HD       PRO  18  -4.301  10.699  -1.381
  141   2HD   PRO  18          1HD       PRO  18  -5.929  10.791  -0.679
  142    H    PHE  19           H        PHE  19  -6.998   9.015  -5.608
  143    HA   PHE  19           HA       PHE  19  -4.369   8.117  -6.524
  144   1HB   PHE  19          2HB       PHE  19  -6.997   6.813  -7.241
  145   2HB   PHE  19          1HB       PHE  19  -5.497   6.537  -8.119
  146    HD1  PHE  19           1HD      PHE  19  -6.903   6.369  -4.675
  147    HD2  PHE  19           2HD      PHE  19  -4.132   4.790  -7.492
  148    HE1  PHE  19           1HE      PHE  19  -6.312   4.586  -3.088
  149    HE2  PHE  19           2HE      PHE  19  -3.537   3.002  -5.912
  150    HZ   PHE  19           HZ       PHE  19  -4.627   2.898  -3.704
  151    H    THR  20           H        THR  20  -7.608   9.060  -7.615
  152    HA   THR  20           HA       THR  20  -6.447  11.121  -9.305
  153    HB   THR  20           HB       THR  20  -8.176  10.165 -11.123
  154    HG1  THR  20           1HG      THR  20  -8.553   8.114 -10.918
  155   1HG2  THR  20          1HG2      THR  20  -6.285  10.191 -12.262
  156   2HG2  THR  20          2HG2      THR  20  -5.927   8.590 -11.615
  157   3HG2  THR  20          3HG2      THR  20  -5.334  10.030 -10.785
  158    H    ASN  21           H        ASN  21  -9.594   9.467  -9.010
  159    HA   ASN  21           HA       ASN  21 -10.822  12.095  -8.515
  160   1HB   ASN  21          2HB       ASN  21 -11.501  10.043 -10.321
  161   2HB   ASN  21          1HB       ASN  21 -12.741  10.011  -9.072
  162   1HD2  ASN  21          1HD2      ASN  21 -14.413  11.259  -9.439
  163   2HD2  ASN  21          2HD2      ASN  21 -14.422  12.705 -10.383
  164    H    MET  22           H        MET  22 -11.856   8.772  -7.787
  165    HA   MET  22           HA       MET  22 -11.559   9.052  -4.972
  166   1HB   MET  22          2HB       MET  22 -13.507  10.540  -5.330
  167   2HB   MET  22          1HB       MET  22 -14.381   9.195  -6.050
  168   1HG   MET  22          2HG       MET  22 -15.145   8.701  -4.038
  169   2HG   MET  22          1HG       MET  22 -13.504   8.244  -3.585
  170   1HE   MET  22          1HE       MET  22 -11.845  10.625  -3.529
  171   2HE   MET  22          2HE       MET  22 -11.913   9.813  -1.964
  172   3HE   MET  22          3HE       MET  22 -12.124  11.561  -2.062
  173    HA   PRO  23           HA       PRO  23 -12.370   4.763  -6.678
  174   1HB   PRO  23          2HB       PRO  23  -9.914   3.861  -7.150
  175   2HB   PRO  23          1HB       PRO  23 -10.721   4.925  -8.309
  176   1HG   PRO  23          2HG       PRO  23  -8.624   5.578  -6.278
  177   2HG   PRO  23          1HG       PRO  23  -8.777   6.145  -7.950
  178   1HD   PRO  23          2HD       PRO  23  -9.587   7.565  -5.708
  179   2HD   PRO  23          1HD       PRO  23 -10.174   7.843  -7.357
  180    H    THR  24           H        THR  24 -11.402   6.102  -3.941
  181    HA   THR  24           HA       THR  24  -9.844   4.294  -2.541
  182    HB   THR  24           HB       THR  24 -11.968   5.353  -0.870
  183    HG1  THR  24           1HG      THR  24 -10.589   7.227  -2.488
  184   1HG2  THR  24          1HG2      THR  24  -9.714   6.845  -0.390
  185   2HG2  THR  24          2HG2      THR  24  -9.069   5.301  -0.950
  186   3HG2  THR  24          3HG2      THR  24 -10.169   5.350   0.429
  187    H    ASP  25           H        ASP  25 -13.365   4.293  -2.991
  188    HA   ASP  25           HA       ASP  25 -13.640   1.813  -1.512
  189   1HB   ASP  25          2HB       ASP  25 -15.624   3.565  -2.970
  190   2HB   ASP  25          1HB       ASP  25 -16.068   2.044  -2.201
  191    H    GLN  26           H        GLN  26 -13.358   2.911  -4.770
  192    HA   GLN  26           HA       GLN  26 -14.387   0.584  -6.044
  193   1HB   GLN  26          2HB       GLN  26 -13.751   3.091  -6.873
  194   2HB   GLN  26          1HB       GLN  26 -12.360   2.196  -7.464
  195   1HG   GLN  26          2HG       GLN  26 -14.271   0.577  -8.345
  196   2HG   GLN  26          1HG       GLN  26 -15.195   2.078  -8.290
  197   1HE2  GLN  26          1HE2      GLN  26 -15.262   1.600 -10.645
  198   2HE2  GLN  26          2HE2      GLN  26 -13.983   2.222 -11.627
  199    H    LEU  27           H        LEU  27 -11.253   1.583  -4.852
  200    HA   LEU  27           HA       LEU  27  -9.786  -0.515  -6.120
  201   1HB   LEU  27          2HB       LEU  27  -9.187   1.788  -4.588
  202   2HB   LEU  27          1HB       LEU  27  -8.502   0.425  -3.727
  203    HG   LEU  27           HG       LEU  27  -6.858   1.415  -5.217
  204   1HD1  LEU  27          1HD1      LEU  27  -6.064  -0.650  -5.342
  205   2HD1  LEU  27          2HD1      LEU  27  -6.987  -0.877  -6.828
  206   3HD1  LEU  27          3HD1      LEU  27  -7.691  -1.328  -5.275
  207   1HD2  LEU  27          1HD2      LEU  27  -8.838   0.775  -7.399
  208   2HD2  LEU  27          2HD2      LEU  27  -7.171   1.287  -7.663
  209   3HD2  LEU  27          3HD2      LEU  27  -8.315   2.377  -6.882
  210    H    GLU  28           H        GLU  28 -10.935   0.026  -2.790
  211    HA   GLU  28           HA       GLU  28 -10.076  -2.490  -1.830
  212   1HB   GLU  28          2HB       GLU  28 -11.604  -2.050   0.072
  213   2HB   GLU  28          1HB       GLU  28 -10.528  -0.706  -0.279
  214   1HG   GLU  28          2HG       GLU  28 -12.221   0.677  -0.695
  215   2HG   GLU  28          1HG       GLU  28 -13.062  -0.514  -1.685
  216    H    TRP  29           H        TRP  29 -12.893  -1.449  -3.576
  217    HA   TRP  29           HA       TRP  29 -14.503  -3.740  -3.001
  218   1HB   TRP  29          2HB       TRP  29 -15.797  -1.972  -3.772
  219   2HB   TRP  29          1HB       TRP  29 -14.599  -1.479  -4.963
  220    HD1  TRP  29           HD       TRP  29 -17.104  -4.384  -4.435
  221    HE1  TRP  29           1HE      TRP  29 -17.988  -5.107  -6.742
  222    HE3  TRP  29           3HE      TRP  29 -14.278  -1.312  -7.376
  223    HZ2  TRP  29           2HZ      TRP  29 -17.539  -4.458  -9.453
  224    HZ3  TRP  29           3HZ      TRP  29 -14.562  -1.425  -9.817
  225    HH2  TRP  29           HH       TRP  29 -16.158  -2.968 -10.833
  226    H    MET  30           H        MET  30 -12.504  -2.737  -5.735
  227    HA   MET  30           HA       MET  30 -12.808  -4.973  -7.353
  228   1HB   MET  30          2HB       MET  30 -10.882  -2.768  -7.108
  229   2HB   MET  30          1HB       MET  30 -10.210  -4.225  -7.820
  230   1HG   MET  30          2HG       MET  30 -12.115  -4.218  -9.434
  231   2HG   MET  30          1HG       MET  30 -12.567  -2.639  -8.793
  232   1HE   MET  30          1HE       MET  30  -9.816  -0.291  -9.780
  233   2HE   MET  30          2HE       MET  30 -11.004  -0.753  -8.560
  234   3HE   MET  30          3HE       MET  30 -11.530  -0.350 -10.195
  235    H    VAL  31           H        VAL  31 -10.360  -4.360  -4.823
  236    HA   VAL  31           HA       VAL  31  -9.031  -6.834  -5.108
  237    HB   VAL  31           HB       VAL  31  -8.173  -6.445  -2.821
  238   1HG1  VAL  31          1HG1      VAL  31  -7.816  -4.780  -5.101
  239   2HG1  VAL  31          2HG1      VAL  31  -6.652  -5.186  -3.839
  240   3HG1  VAL  31          3HG1      VAL  31  -7.699  -3.778  -3.654
  241   1HG2  VAL  31          1HG2      VAL  31 -10.092  -5.498  -1.753
  242   2HG2  VAL  31          2HG2      VAL  31 -10.079  -4.126  -2.859
  243   3HG2  VAL  31          3HG2      VAL  31  -8.780  -4.322  -1.686
  244    H    GLN  32           H        GLN  32 -11.658  -5.759  -3.024
  245    HA   GLN  32           HA       GLN  32 -12.053  -8.074  -1.526
  246   1HB   GLN  32          2HB       GLN  32 -13.596  -5.670  -2.203
  247   2HB   GLN  32          1HB       GLN  32 -14.597  -7.073  -1.858
  248   1HG   GLN  32          2HG       GLN  32 -13.187  -7.322   0.260
  249   2HG   GLN  32          1HG       GLN  32 -12.643  -5.679  -0.069
  250   1HE2  GLN  32          1HE2      GLN  32 -13.942  -4.003   0.420
  251   2HE2  GLN  32          2HE2      GLN  32 -15.519  -4.157   1.106
  252    H    LEU  33           H        LEU  33 -13.108  -7.184  -4.738
  253    HA   LEU  33           HA       LEU  33 -14.888  -9.362  -5.146
  254   1HB   LEU  33          2HB       LEU  33 -14.873  -7.200  -6.421
  255   2HB   LEU  33          1HB       LEU  33 -13.418  -7.749  -7.229
  256    HG   LEU  33           HG       LEU  33 -14.607  -9.558  -8.282
  257   1HD1  LEU  33          1HD1      LEU  33 -16.715  -8.823  -6.331
  258   2HD1  LEU  33          2HD1      LEU  33 -16.197 -10.411  -6.898
  259   3HD1  LEU  33          3HD1      LEU  33 -17.228  -9.405  -7.915
  260   1HD2  LEU  33          1HD2      LEU  33 -16.581  -7.416  -8.721
  261   2HD2  LEU  33          2HD2      LEU  33 -15.569  -8.284  -9.874
  262   3HD2  LEU  33          3HD2      LEU  33 -14.890  -6.960  -8.927
  263    H    CYS  34           H        CYS  34 -11.469  -9.028  -5.250
  264    HA   CYS  34           HA       CYS  34 -11.102 -11.424  -6.868
  265   1HB   CYS  34          2HB       CYS  34  -9.345  -9.222  -5.906
  266   2HB   CYS  34          1HB       CYS  34  -8.598 -10.786  -6.212
  267    HG   CYS  34           HG       CYS  34 -10.022 -10.271  -8.667
  268    H    GLY  35           H        GLY  35 -11.714 -10.814  -3.673
  269   1HA   GLY  35          2HA       GLY  35 -11.857 -12.768  -2.223
  270   2HA   GLY  35          1HA       GLY  35 -10.311 -13.286  -2.877
  271    H    ALA  36           H        ALA  36  -9.587 -10.262  -2.664
  272    HA   ALA  36           HA       ALA  36  -8.198 -10.506  -0.193
  273   1HB   ALA  36          1HB       ALA  36  -7.620  -8.063  -0.688
  274   2HB   ALA  36          2HB       ALA  36  -8.502  -8.297  -2.198
  275   3HB   ALA  36          3HB       ALA  36  -7.084  -9.284  -1.842
  276    H    SER  37           H        SER  37  -8.238  -8.517   1.339
  277    HA   SER  37           HA       SER  37 -11.030  -7.803   1.940
  278   1HB   SER  37          2HB       SER  37  -9.317  -9.443   3.493
  279   2HB   SER  37          1HB       SER  37  -9.471  -7.911   4.351
  280    HG   SER  37           HG       SER  37 -11.705  -9.316   3.330
  281    H    VAL  38           H        VAL  38 -11.399  -5.715   2.498
  282    HA   VAL  38           HA       VAL  38  -9.364  -3.795   1.957
  283    HB   VAL  38           HB       VAL  38 -11.742  -3.375   1.459
  284   1HG1  VAL  38          1HG1      VAL  38 -13.390  -3.093   3.067
  285   2HG1  VAL  38          2HG1      VAL  38 -12.221  -2.859   4.369
  286   3HG1  VAL  38          3HG1      VAL  38 -12.470  -4.465   3.684
  287   1HG2  VAL  38          1HG2      VAL  38 -10.019  -1.550   1.899
  288   2HG2  VAL  38          2HG2      VAL  38 -10.805  -1.344   3.465
  289   3HG2  VAL  38          3HG2      VAL  38 -11.718  -1.084   1.980
  290    H    VAL  39           H        VAL  39  -7.896  -2.975   3.299
  291    HA   VAL  39           HA       VAL  39  -8.131  -3.528   6.159
  292    HB   VAL  39           HB       VAL  39  -5.768  -2.152   4.962
  293   1HG1  VAL  39          1HG1      VAL  39  -6.320  -2.941   7.470
  294   2HG1  VAL  39          2HG1      VAL  39  -4.687  -2.801   6.819
  295   3HG1  VAL  39          3HG1      VAL  39  -5.487  -4.372   6.865
  296   1HG2  VAL  39          1HG2      VAL  39  -6.176  -3.956   3.397
  297   2HG2  VAL  39          2HG2      VAL  39  -6.320  -5.106   4.726
  298   3HG2  VAL  39          3HG2      VAL  39  -4.769  -4.333   4.393
  299    H    LYS  40           H        LYS  40  -8.042  -1.926   7.746
  300    HA   LYS  40           HA       LYS  40  -9.237   0.565   7.031
  301   1HB   LYS  40          2HB       LYS  40  -8.129  -0.429   9.659
  302   2HB   LYS  40          1HB       LYS  40  -9.011   1.080   9.463
  303   1HG   LYS  40          2HG       LYS  40 -10.672  -0.318  10.183
  304   2HG   LYS  40          1HG       LYS  40 -10.848  -0.461   8.433
  305   1HD   LYS  40          2HD       LYS  40 -10.283  -2.630   8.448
  306   2HD   LYS  40          1HD       LYS  40  -8.936  -2.359   9.556
  307   1HE   LYS  40          2HE       LYS  40 -11.561  -2.072  10.807
  308   2HE   LYS  40          1HE       LYS  40 -11.264  -3.683  10.156
  309   1HZ   LYS  40          1HZ       LYS  40  -9.317  -3.891  11.473
  310   2HZ   LYS  40          2HZ       LYS  40 -10.549  -3.357  12.501
  311   3HZ   LYS  40          3HZ       LYS  40  -9.375  -2.269  11.954
  312    H    GLU  41           H        GLU  41  -6.031  -0.405   8.143
  313    HA   GLU  41           HA       GLU  41  -4.843   1.890   6.883
  314   1HB   GLU  41          2HB       GLU  41  -5.228   1.768   9.820
  315   2HB   GLU  41          1HB       GLU  41  -3.650   2.299   9.260
  316   1HG   GLU  41          2HG       GLU  41  -5.732   3.627   7.793
  317   2HG   GLU  41          1HG       GLU  41  -5.971   3.827   9.528
  318    H    LEU  42           H        LEU  42  -2.367   1.921   7.792
  319    HA   LEU  42           HA       LEU  42  -1.221  -0.444   6.782
  320   1HB   LEU  42          2HB       LEU  42   0.151   1.599   8.523
  321   2HB   LEU  42          1HB       LEU  42   0.903   0.510   7.373
  322    HG   LEU  42           HG       LEU  42  -1.000   2.722   6.604
  323   1HD1  LEU  42          1HD1      LEU  42   1.397   3.482   5.631
  324   2HD1  LEU  42          2HD1      LEU  42   1.892   2.716   7.141
  325   3HD1  LEU  42          3HD1      LEU  42   0.731   4.043   7.165
  326   1HD2  LEU  42          1HD2      LEU  42   0.445   0.597   5.145
  327   2HD2  LEU  42          2HD2      LEU  42   0.430   2.197   4.404
  328   3HD2  LEU  42          3HD2      LEU  42  -1.089   1.385   4.779
  329    H    SER  43           H        SER  43  -1.408   0.806  10.109
  330    HA   SER  43           HA       SER  43  -0.149  -1.427  11.302
  331   1HB   SER  43          2HB       SER  43  -1.820   0.843  12.327
  332   2HB   SER  43          1HB       SER  43  -1.407  -0.495  13.399
  333    HG   SER  43           HG       SER  43   0.528   0.923  11.895
  334    H    SER  44           H        SER  44  -3.327  -0.961  10.096
  335    HA   SER  44           HA       SER  44  -4.789  -2.678  11.761
  336   1HB   SER  44          2HB       SER  44  -5.201  -2.055   8.830
  337   2HB   SER  44          1HB       SER  44  -6.392  -2.819   9.881
  338    HG   SER  44           HG       SER  44  -5.290  -0.219  10.179
  339    H    PHE  45           H        PHE  45  -2.471  -3.355   9.288
  340    HA   PHE  45           HA       PHE  45  -3.194  -5.832   8.350
  341   1HB   PHE  45          2HB       PHE  45  -0.487  -4.686   9.004
  342   2HB   PHE  45          1HB       PHE  45  -0.665  -6.289   8.296
  343    HD1  PHE  45           1HD      PHE  45  -2.762  -5.983   6.351
  344    HD2  PHE  45           2HD      PHE  45   0.357  -3.281   7.395
  345    HE1  PHE  45           1HE      PHE  45  -2.888  -4.977   4.108
  346    HE2  PHE  45           2HE      PHE  45   0.235  -2.270   5.155
  347    HZ   PHE  45           HZ       PHE  45  -1.388  -3.117   3.510
  348    H    THR  46           H        THR  46  -3.915  -7.514   9.477
  349    HA   THR  46           HA       THR  46  -2.661  -8.134  12.062
  350    HB   THR  46           HB       THR  46  -4.790  -9.743  12.075
  351    HG1  THR  46           1HG      THR  46  -5.396  -9.013   9.943
  352   1HG2  THR  46          1HG2      THR  46  -6.113  -7.550  12.833
  353   2HG2  THR  46          2HG2      THR  46  -4.461  -6.933  12.892
  354   3HG2  THR  46          3HG2      THR  46  -4.908  -8.353  13.839
  355    H    LEU  47           H        LEU  47  -1.419  -9.877  12.271
  356    HA   LEU  47           HA       LEU  47  -0.939 -11.571   9.995
  357   1HB   LEU  47          2HB       LEU  47   0.751 -10.715  11.765
  358   2HB   LEU  47          1HB       LEU  47   0.164 -12.046  12.743
  359    HG   LEU  47           HG       LEU  47   0.800 -13.599  10.874
  360   1HD1  LEU  47          1HD1      LEU  47   1.793 -11.018   9.743
  361   2HD1  LEU  47          2HD1      LEU  47   0.926 -12.333   8.949
  362   3HD1  LEU  47          3HD1      LEU  47   2.626 -12.528   9.373
  363   1HD2  LEU  47          1HD2      LEU  47   2.779 -11.958  12.401
  364   2HD2  LEU  47          2HD2      LEU  47   3.333 -13.204  11.284
  365   3HD2  LEU  47          3HD2      LEU  47   2.292 -13.636  12.639
  366    H    GLY  48           H        GLY  48  -2.312 -13.157   9.518
  367   1HA   GLY  48          2HA       GLY  48  -3.409 -14.754  11.751
  368   2HA   GLY  48          1HA       GLY  48  -4.299 -14.423  10.273
  369    H    THR  49           H        THR  49  -4.537 -16.311   9.262
  370    HA   THR  49           HA       THR  49  -2.165 -18.038   8.983
  371    HB   THR  49           HB       THR  49  -3.738 -19.915   8.678
  372    HG1  THR  49           1HG      THR  49  -5.947 -19.533   9.152
  373   1HG2  THR  49          1HG2      THR  49  -4.911 -19.659  11.024
  374   2HG2  THR  49          2HG2      THR  49  -3.768 -18.324  11.176
  375   3HG2  THR  49          3HG2      THR  49  -3.181 -19.959  10.875
  376    H    GLY  50           H        GLY  50  -5.069 -16.849   7.322
  377   1HA   GLY  50          2HA       GLY  50  -3.638 -17.259   4.770
  378   2HA   GLY  50          1HA       GLY  50  -5.343 -17.639   4.941
  379    H    VAL  51           H        VAL  51  -3.066 -14.958   5.355
  380    HA   VAL  51           HA       VAL  51  -4.680 -13.209   3.767
  381    HB   VAL  51           HB       VAL  51  -4.808 -11.480   5.699
  382   1HG1  VAL  51          1HG1      VAL  51  -7.031 -11.900   5.812
  383   2HG1  VAL  51          2HG1      VAL  51  -6.803 -13.617   6.144
  384   3HG1  VAL  51          3HG1      VAL  51  -6.640 -13.007   4.497
  385   1HG2  VAL  51          1HG2      VAL  51  -5.186 -12.476   7.906
  386   2HG2  VAL  51          2HG2      VAL  51  -3.543 -12.769   7.335
  387   3HG2  VAL  51          3HG2      VAL  51  -4.745 -14.058   7.265
  388    H    HIS  52           H        HIS  52  -3.064 -12.429   2.570
  389    HA   HIS  52           HA       HIS  52  -0.526 -11.729   3.828
  390   1HB   HIS  52          2HB       HIS  52  -1.153 -12.878   1.392
  391   2HB   HIS  52          1HB       HIS  52  -0.751 -11.220   0.958
  392    HD1  HIS  52           1HD      HIS  52   1.637 -10.929   0.429
  393    HD2  HIS  52           2HD      HIS  52   1.041 -13.959   3.209
  394    HE1  HIS  52           1HE      HIS  52   3.923 -11.856   0.912
  395    HE2  HIS  52           2HE      HIS  52   3.528 -13.749   2.527
  396    HA   PRO  53           HA       PRO  53  -1.747  -7.439   3.851
  397   1HB   PRO  53          2HB       PRO  53   0.523  -6.389   4.821
  398   2HB   PRO  53          1HB       PRO  53  -0.550  -7.368   5.830
  399   1HG   PRO  53          2HG       PRO  53   1.990  -8.150   4.454
  400   2HG   PRO  53          1HG       PRO  53   1.435  -8.550   6.089
  401   1HD   PRO  53          2HD       PRO  53   1.226 -10.248   3.946
  402   2HD   PRO  53          1HD       PRO  53   0.145 -10.295   5.354
  403    H    ILE  54           H        ILE  54  -1.725  -5.892   2.336
  404    HA   ILE  54           HA       ILE  54   0.655  -5.478   0.689
  405    HB   ILE  54           HB       ILE  54  -2.040  -5.764  -0.621
  406   1HG1  ILE  54          2HG1      ILE  54  -1.316  -7.918   0.443
  407   2HG1  ILE  54          1HG1      ILE  54  -1.476  -7.990  -1.308
  408   1HG2  ILE  54          1HG2      ILE  54  -0.569  -4.476  -1.935
  409   2HG2  ILE  54          2HG2      ILE  54  -0.556  -6.092  -2.641
  410   3HG2  ILE  54          3HG2      ILE  54   0.784  -5.564  -1.625
  411   1HD1  ILE  54          1HD1      ILE  54   0.752  -8.274  -1.637
  412   2HD1  ILE  54          2HD1      ILE  54   0.581  -9.038  -0.057
  413   3HD1  ILE  54          3HD1      ILE  54   1.196  -7.389  -0.178
  414    H    VAL  55           H        VAL  55   0.727  -3.436  -0.334
  415    HA   VAL  55           HA       VAL  55  -1.350  -1.524   0.499
  416    HB   VAL  55           HB       VAL  55   1.606  -0.908   0.507
  417   1HG1  VAL  55          1HG1      VAL  55  -0.855   0.637   1.259
  418   2HG1  VAL  55          2HG1      VAL  55   0.436   1.087   0.144
  419   3HG1  VAL  55          3HG1      VAL  55   0.739   1.065   1.881
  420   1HG2  VAL  55          1HG2      VAL  55   0.098  -2.346   2.436
  421   2HG2  VAL  55          2HG2      VAL  55   0.481  -0.764   3.112
  422   3HG2  VAL  55          3HG2      VAL  55   1.775  -1.810   2.529
  423    H    VAL  56           H        VAL  56  -1.880   0.040  -0.997
  424    HA   VAL  56           HA       VAL  56  -0.486  -0.178  -3.581
  425    HB   VAL  56           HB       VAL  56  -2.939   1.028  -4.121
  426   1HG1  VAL  56          1HG1      VAL  56  -1.650  -1.585  -4.631
  427   2HG1  VAL  56          2HG1      VAL  56  -2.236  -0.366  -5.763
  428   3HG1  VAL  56          3HG1      VAL  56  -3.375  -1.456  -4.974
  429   1HG2  VAL  56          1HG2      VAL  56  -3.454  -1.418  -2.441
  430   2HG2  VAL  56          2HG2      VAL  56  -4.640  -0.348  -3.188
  431   3HG2  VAL  56          3HG2      VAL  56  -3.655   0.228  -1.845
  432    H    VAL  57           H        VAL  57  -0.487   1.781  -4.930
  433    HA   VAL  57           HA       VAL  57  -0.831   4.314  -3.547
  434    HB   VAL  57           HB       VAL  57   1.529   5.006  -4.186
  435   1HG1  VAL  57          1HG1      VAL  57   0.887   4.657  -1.878
  436   2HG1  VAL  57          2HG1      VAL  57   2.514   4.033  -2.147
  437   3HG1  VAL  57          3HG1      VAL  57   1.150   2.922  -2.041
  438   1HG2  VAL  57          1HG2      VAL  57   2.192   3.293  -5.669
  439   2HG2  VAL  57          2HG2      VAL  57   1.766   2.027  -4.517
  440   3HG2  VAL  57          3HG2      VAL  57   3.156   3.069  -4.210
  441    H    GLN  58           H        GLN  58   0.231   6.096  -5.132
  442    HA   GLN  58           HA       GLN  58   0.356   5.738  -7.865
  443   1HB   GLN  58          2HB       GLN  58  -2.245   5.266  -7.070
  444   2HB   GLN  58          1HB       GLN  58  -2.293   6.947  -7.583
  445   1HG   GLN  58          2HG       GLN  58  -0.836   5.594  -9.551
  446   2HG   GLN  58          1HG       GLN  58  -2.208   4.557  -9.165
  447   1HE2  GLN  58          1HE2      GLN  58  -4.335   5.456  -9.344
  448   2HE2  GLN  58          2HE2      GLN  58  -4.639   6.749 -10.448
  449    HA   PRO  59           HA       PRO  59   1.482   9.933  -6.433
  450   1HB   PRO  59          2HB       PRO  59   3.494  10.265  -8.229
  451   2HB   PRO  59          1HB       PRO  59   3.700   9.398  -6.702
  452   1HG   PRO  59          2HG       PRO  59   3.237   8.310  -9.452
  453   2HG   PRO  59          1HG       PRO  59   4.362   7.748  -8.202
  454   1HD   PRO  59          2HD       PRO  59   1.990   6.536  -8.669
  455   2HD   PRO  59          1HD       PRO  59   2.716   6.615  -7.051
  456    H    ASP  60           H        ASP  60  -0.771  10.148  -7.556
  457    HA   ASP  60           HA       ASP  60  -0.380  11.784  -9.968
  458   1HB   ASP  60          2HB       ASP  60  -1.812   9.382  -9.840
  459   2HB   ASP  60          1HB       ASP  60  -3.040  10.644  -9.836
  460    H    ALA  61           H        ALA  61  -3.163  11.048  -7.904
  461    HA   ALA  61           HA       ALA  61  -3.816  13.866  -7.743
  462   1HB   ALA  61          1HB       ALA  61  -5.781  12.981  -6.395
  463   2HB   ALA  61          2HB       ALA  61  -5.199  11.368  -6.809
  464   3HB   ALA  61          3HB       ALA  61  -5.686  12.485  -8.085
  465    H    TRP  62           H        TRP  62  -2.111  11.567  -5.868
  466    HA   TRP  62           HA       TRP  62  -2.565  12.327  -3.259
  467   1HB   TRP  62          2HB       TRP  62  -0.754  10.690  -4.562
  468   2HB   TRP  62          1HB       TRP  62   0.276  11.906  -3.810
  469    HD1  TRP  62           HD       TRP  62  -1.731   8.836  -3.032
  470    HE1  TRP  62           1HE      TRP  62  -1.572   8.307  -0.519
  471    HE3  TRP  62           3HE      TRP  62   0.458  13.169  -1.427
  472    HZ2  TRP  62           2HZ      TRP  62  -0.641   9.559   1.834
  473    HZ3  TRP  62           3HZ      TRP  62   0.950  13.423   0.970
  474    HH2  TRP  62           HH       TRP  62   0.410  11.655   2.566
  475    H    THR  63           H        THR  63  -0.483  13.864  -5.665
  476    HA   THR  63           HA       THR  63   0.511  15.906  -5.750
  477    HB   THR  63           HB       THR  63  -1.336  16.720  -3.509
  478    HG1  THR  63           1HG      THR  63  -1.904  16.652  -6.285
  479   1HG2  THR  63          1HG2      THR  63  -0.006  18.551  -3.931
  480   2HG2  THR  63          2HG2      THR  63  -1.387  18.830  -4.992
  481   3HG2  THR  63          3HG2      THR  63   0.120  18.195  -5.653
  482    H    GLU  64           H        GLU  64   1.929  17.398  -4.573
  483    HA   GLU  64           HA       GLU  64   3.328  15.985  -2.452
  484   1HB   GLU  64          2HB       GLU  64   3.985  18.195  -4.333
  485   2HB   GLU  64          1HB       GLU  64   4.847  18.150  -2.802
  486   1HG   GLU  64          2HG       GLU  64   4.696  15.827  -4.704
  487   2HG   GLU  64          1HG       GLU  64   5.999  17.014  -4.699
  488    H    ASP  65           H        ASP  65   2.083  16.257  -0.626
  489    HA   ASP  65           HA       ASP  65   1.695  19.029   0.291
  490   1HB   ASP  65          2HB       ASP  65  -0.214  17.086   0.018
  491   2HB   ASP  65          1HB       ASP  65   0.225  16.914   1.715
  492    H    ASN  66           H        ASN  66   2.021  15.803   1.782
  493    HA   ASN  66           HA       ASN  66   3.670  17.019   3.880
  494   1HB   ASN  66          2HB       ASN  66   1.693  15.726   4.602
  495   2HB   ASN  66          1HB       ASN  66   2.346  14.298   3.803
  496   1HD2  ASN  66          1HD2      ASN  66   3.463  16.791   6.075
  497   2HD2  ASN  66          2HD2      ASN  66   4.226  15.691   7.167
  498    H    GLY  67           H        GLY  67   3.733  14.667   1.303
  499   1HA   GLY  67          2HA       GLY  67   6.049  14.438   0.350
  500   2HA   GLY  67          1HA       GLY  67   6.540  14.048   1.991
  501    H    PHE  68           H        PHE  68   6.071  12.680  -0.874
  502    HA   PHE  68           HA       PHE  68   4.762  10.262   0.140
  503   1HB   PHE  68          2HB       PHE  68   4.237  11.495  -2.138
  504   2HB   PHE  68          1HB       PHE  68   5.607  10.547  -2.710
  505    HD1  PHE  68           1HD      PHE  68   5.283   8.371  -3.420
  506    HD2  PHE  68           2HD      PHE  68   2.362  10.202  -0.926
  507    HE1  PHE  68           1HE      PHE  68   3.812   6.421  -3.719
  508    HE2  PHE  68           2HE      PHE  68   0.886   8.256  -1.220
  509    HZ   PHE  68           HZ       PHE  68   1.611   6.362  -2.616
  510    H    HIS  69           H        HIS  69   7.764  11.376   0.248
  511    HA   HIS  69           HA       HIS  69   9.132   9.022  -0.775
  512   1HB   HIS  69          2HB       HIS  69   9.956  11.496  -0.907
  513   2HB   HIS  69          1HB       HIS  69  10.481  11.226   0.751
  514    HD1  HIS  69           1HD      HIS  69  11.102   9.994  -2.760
  515    HD2  HIS  69           2HD      HIS  69  12.804   9.771   1.024
  516    HE1  HIS  69           1HE      HIS  69  13.353   8.925  -3.098
  517    HE2  HIS  69           2HE      HIS  69  14.403   8.889  -0.808
  518    H    ALA  70           H        ALA  70   7.481   8.163   1.118
  519    HA   ALA  70           HA       ALA  70   9.194   6.958   3.016
  520   1HB   ALA  70          1HB       ALA  70   9.022   9.222   4.024
  521   2HB   ALA  70          2HB       ALA  70   8.410   7.937   5.065
  522   3HB   ALA  70          3HB       ALA  70   7.284   8.975   4.188
  523    H    ILE  71           H        ILE  71   7.212   6.194   1.090
  524    HA   ILE  71           HA       ILE  71   4.793   5.450   2.403
  525    HB   ILE  71           HB       ILE  71   5.950   4.231  -0.103
  526   1HG1  ILE  71          2HG1      ILE  71   5.845   6.695  -0.271
  527   2HG1  ILE  71          1HG1      ILE  71   4.695   5.912  -1.350
  528   1HG2  ILE  71          1HG2      ILE  71   3.073   4.529   0.040
  529   2HG2  ILE  71          2HG2      ILE  71   3.698   3.560   1.376
  530   3HG2  ILE  71          3HG2      ILE  71   4.045   3.094  -0.289
  531   1HD1  ILE  71          1HD1      ILE  71   3.798   6.792   1.350
  532   2HD1  ILE  71          2HD1      ILE  71   2.879   6.623  -0.144
  533   3HD1  ILE  71          3HD1      ILE  71   3.987   7.979   0.060
  534    H    GLY  72           H        GLY  72   7.375   3.372   1.067
  535   1HA   GLY  72          2HA       GLY  72   6.565   1.059   2.453
  536   2HA   GLY  72          1HA       GLY  72   8.145   1.312   1.728
  537    H    GLN  73           H        GLN  73   8.556   3.740   3.424
  538    HA   GLN  73           HA       GLN  73   9.782   2.387   5.635
  539   1HB   GLN  73          2HB       GLN  73  10.634   4.462   4.351
  540   2HB   GLN  73          1HB       GLN  73   9.533   5.371   5.378
  541   1HG   GLN  73          2HG       GLN  73  11.099   5.440   6.933
  542   2HG   GLN  73          1HG       GLN  73  10.991   3.688   7.086
  543   1HE2  GLN  73          1HE2      GLN  73  12.906   2.780   7.015
  544   2HE2  GLN  73          2HE2      GLN  73  14.233   3.260   6.018
  545    H    MET  74           H        MET  74   6.791   4.031   5.107
  546    HA   MET  74           HA       MET  74   6.311   4.367   7.966
  547   1HB   MET  74          2HB       MET  74   4.976   5.327   5.472
  548   2HB   MET  74          1HB       MET  74   4.026   5.219   6.948
  549   1HG   MET  74          2HG       MET  74   6.290   6.503   7.795
  550   2HG   MET  74          1HG       MET  74   6.069   7.142   6.168
  551   1HE   MET  74          1HE       MET  74   3.187   7.192   5.590
  552   2HE   MET  74          2HE       MET  74   3.983   8.761   5.469
  553   3HE   MET  74          3HE       MET  74   2.458   8.611   6.343
  554    H    CYS  75           H        CYS  75   4.987   2.611   5.185
  555    HA   CYS  75           HA       CYS  75   3.126   1.170   6.882
  556   1HB   CYS  75          2HB       CYS  75   2.351   0.126   4.819
  557   2HB   CYS  75          1HB       CYS  75   2.442   1.873   4.620
  558    HG   CYS  75           HG       CYS  75   4.803   1.329   3.355
  559    H    GLU  76           H        GLU  76   3.032  -1.217   6.786
  560    HA   GLU  76           HA       GLU  76   5.747  -2.360   6.775
  561   1HB   GLU  76          2HB       GLU  76   4.453  -2.221   8.977
  562   2HB   GLU  76          1HB       GLU  76   3.398  -3.458   8.311
  563   1HG   GLU  76          2HG       GLU  76   5.534  -4.814   7.938
  564   2HG   GLU  76          1HG       GLU  76   6.297  -3.657   9.028
  565    H    ALA  77           H        ALA  77   4.064  -2.158   4.449
  566    HA   ALA  77           HA       ALA  77   3.949  -4.995   3.769
  567   1HB   ALA  77          1HB       ALA  77   1.717  -4.988   4.014
  568   2HB   ALA  77          2HB       ALA  77   1.718  -4.123   2.476
  569   3HB   ALA  77          3HB       ALA  77   1.621  -3.227   3.992
  570    HA   PRO  78           HA       PRO  78   5.571  -3.758  -0.135
  571   1HB   PRO  78          2HB       PRO  78   4.184  -5.237  -1.941
  572   2HB   PRO  78          1HB       PRO  78   5.390  -5.936  -0.853
  573   1HG   PRO  78          2HG       PRO  78   2.407  -5.884  -0.588
  574   2HG   PRO  78          1HG       PRO  78   3.527  -7.230  -0.312
  575   1HD   PRO  78          2HD       PRO  78   2.514  -5.770   1.717
  576   2HD   PRO  78          1HD       PRO  78   4.157  -6.442   1.769
  577    H    VAL  79           H        VAL  79   5.305  -1.900  -1.183
  578    HA   VAL  79           HA       VAL  79   2.615  -0.863  -1.634
  579    HB   VAL  79           HB       VAL  79   5.230   0.542  -2.169
  580   1HG1  VAL  79          1HG1      VAL  79   2.779   1.254  -2.989
  581   2HG1  VAL  79          2HG1      VAL  79   4.031   2.418  -2.557
  582   3HG1  VAL  79          3HG1      VAL  79   2.781   1.993  -1.388
  583   1HG2  VAL  79          1HG2      VAL  79   4.956  -0.273   0.211
  584   2HG2  VAL  79          2HG2      VAL  79   3.572   0.814   0.327
  585   3HG2  VAL  79          3HG2      VAL  79   5.180   1.465   0.007
  586    H    VAL  80           H        VAL  80   1.639  -0.997  -3.553
  587    HA   VAL  80           HA       VAL  80   3.265  -1.033  -5.992
  588    HB   VAL  80           HB       VAL  80   1.922  -2.861  -6.952
  589   1HG1  VAL  80          1HG1      VAL  80   3.448  -3.430  -4.427
  590   2HG1  VAL  80          2HG1      VAL  80   4.011  -3.536  -6.095
  591   3HG1  VAL  80          3HG1      VAL  80   2.846  -4.709  -5.480
  592   1HG2  VAL  80          1HG2      VAL  80   0.578  -4.279  -5.400
  593   2HG2  VAL  80          2HG2      VAL  80  -0.105  -2.679  -5.689
  594   3HG2  VAL  80          3HG2      VAL  80   0.745  -3.016  -4.181
  595    H    THR  81           H        THR  81   2.366   0.136  -7.637
  596    HA   THR  81           HA       THR  81   0.269   1.895  -7.158
  597    HB   THR  81           HB       THR  81   0.461   2.604  -9.364
  598    HG1  THR  81           1HG      THR  81   1.400   0.063 -10.167
  599   1HG2  THR  81          1HG2      THR  81   3.050   1.205  -9.514
  600   2HG2  THR  81          2HG2      THR  81   2.780   2.232  -8.106
  601   3HG2  THR  81          3HG2      THR  81   2.660   2.911  -9.729
  602    H    ARG  82           H        ARG  82  -1.856   2.016  -8.226
  603    HA   ARG  82           HA       ARG  82  -3.456  -0.165  -7.631
  604   1HB   ARG  82          2HB       ARG  82  -5.102   1.002  -9.305
  605   2HB   ARG  82          1HB       ARG  82  -4.686   1.767  -7.780
  606   1HG   ARG  82          2HG       ARG  82  -3.819   3.527  -8.810
  607   2HG   ARG  82          1HG       ARG  82  -2.835   2.519  -9.866
  608   1HD   ARG  82          2HD       ARG  82  -5.713   2.568 -10.476
  609   2HD   ARG  82          1HD       ARG  82  -4.865   4.096 -10.710
  610    HE   ARG  82           HE       ARG  82  -3.536   1.837 -11.894
  611   1HH1  ARG  82          1HH1      ARG  82  -5.957   4.306 -12.367
  612   2HH1  ARG  82          2HH1      ARG  82  -5.847   4.261 -14.094
  613   1HH2  ARG  82          1HH2      ARG  82  -3.389   1.776 -14.167
  614   2HH2  ARG  82          2HH2      ARG  82  -4.389   2.824 -15.116
  615    H    GLU  83           H        GLU  83  -1.499   0.334 -10.414
  616    HA   GLU  83           HA       GLU  83  -2.765  -0.977 -12.445
  617   1HB   GLU  83          2HB       GLU  83   0.092  -0.792 -11.614
  618   2HB   GLU  83          1HB       GLU  83  -0.325  -1.940 -12.877
  619   1HG   GLU  83          2HG       GLU  83  -0.684  -0.338 -14.398
  620   2HG   GLU  83          1HG       GLU  83  -1.457   0.737 -13.236
  621    H    TRP  84           H        TRP  84  -1.130  -2.430  -9.671
  622    HA   TRP  84           HA       TRP  84  -1.266  -5.118 -10.447
  623   1HB   TRP  84          2HB       TRP  84   0.023  -4.341  -8.506
  624   2HB   TRP  84          1HB       TRP  84  -1.464  -3.920  -7.676
  625    HD1  TRP  84           HD       TRP  84   0.330  -7.086  -9.016
  626    HE1  TRP  84           1HE      TRP  84  -0.360  -9.069  -7.525
  627    HE3  TRP  84           3HE      TRP  84  -3.063  -4.711  -6.021
  628    HZ2  TRP  84           2HZ      TRP  84  -2.114  -9.561  -5.364
  629    HZ3  TRP  84           3HZ      TRP  84  -4.206  -6.007  -4.271
  630    HH2  TRP  84           HH       TRP  84  -3.742  -8.380  -3.949
  631    H    VAL  85           H        VAL  85  -3.409  -3.308  -8.309
  632    HA   VAL  85           HA       VAL  85  -5.389  -5.242  -8.002
  633    HB   VAL  85           HB       VAL  85  -5.744  -2.242  -7.958
  634   1HG1  VAL  85          1HG1      VAL  85  -7.535  -3.096  -6.196
  635   2HG1  VAL  85          2HG1      VAL  85  -7.513  -4.515  -7.243
  636   3HG1  VAL  85          3HG1      VAL  85  -7.913  -2.933  -7.910
  637   1HG2  VAL  85          1HG2      VAL  85  -5.483  -2.534  -5.491
  638   2HG2  VAL  85          2HG2      VAL  85  -4.017  -2.851  -6.419
  639   3HG2  VAL  85          3HG2      VAL  85  -4.975  -4.195  -5.796
  640    H    LEU  86           H        LEU  86  -5.092  -2.669 -10.412
  641    HA   LEU  86           HA       LEU  86  -7.588  -3.192 -11.665
  642   1HB   LEU  86          2HB       LEU  86  -5.843  -1.156 -11.801
  643   2HB   LEU  86          1HB       LEU  86  -5.381  -2.017 -13.257
  644    HG   LEU  86           HG       LEU  86  -8.152  -0.994 -12.630
  645   1HD1  LEU  86          1HD1      LEU  86  -7.723   0.847 -13.867
  646   2HD1  LEU  86          2HD1      LEU  86  -6.600   0.004 -14.935
  647   3HD1  LEU  86          3HD1      LEU  86  -6.070   0.535 -13.339
  648   1HD2  LEU  86          1HD2      LEU  86  -7.022  -2.515 -14.963
  649   2HD2  LEU  86          2HD2      LEU  86  -8.495  -1.555 -15.080
  650   3HD2  LEU  86          3HD2      LEU  86  -8.418  -2.917 -13.963
  651    H    ASP  87           H        ASP  87  -4.254  -3.917 -12.697
  652    HA   ASP  87           HA       ASP  87  -4.919  -5.438 -14.939
  653   1HB   ASP  87          2HB       ASP  87  -2.644  -4.592 -14.455
  654   2HB   ASP  87          1HB       ASP  87  -2.503  -5.759 -13.144
  655    H    SER  88           H        SER  88  -4.823  -6.272 -11.552
  656    HA   SER  88           HA       SER  88  -4.953  -9.107 -11.974
  657   1HB   SER  88          2HB       SER  88  -5.411  -7.401  -9.519
  658   2HB   SER  88          1HB       SER  88  -5.470  -9.163  -9.511
  659    HG   SER  88           HG       SER  88  -3.250  -7.542 -10.221
  660    H    VAL  89           H        VAL  89  -7.291  -6.621 -10.948
  661    HA   VAL  89           HA       VAL  89  -9.490  -8.429 -10.854
  662    HB   VAL  89           HB       VAL  89  -9.552  -5.417 -11.082
  663   1HG1  VAL  89          1HG1      VAL  89 -11.624  -7.470 -10.834
  664   2HG1  VAL  89          2HG1      VAL  89 -11.742  -5.797 -11.378
  665   3HG1  VAL  89          3HG1      VAL  89 -11.751  -6.166  -9.653
  666   1HG2  VAL  89          1HG2      VAL  89  -8.505  -6.956  -9.019
  667   2HG2  VAL  89          2HG2      VAL  89 -10.124  -6.521  -8.468
  668   3HG2  VAL  89          3HG2      VAL  89  -8.982  -5.261  -8.935
  669    H    ALA  90           H        ALA  90  -8.025  -6.524 -13.368
  670    HA   ALA  90           HA       ALA  90 -10.215  -6.455 -15.156
  671   1HB   ALA  90          1HB       ALA  90  -7.287  -6.388 -15.864
  672   2HB   ALA  90          2HB       ALA  90  -8.208  -4.993 -15.302
  673   3HB   ALA  90          3HB       ALA  90  -8.633  -5.775 -16.825
  674    H    LEU  91           H        LEU  91  -7.332  -8.551 -15.093
  675    HA   LEU  91           HA       LEU  91  -8.671 -10.399 -16.924
  676   1HB   LEU  91          2HB       LEU  91  -6.438  -9.784 -17.559
  677   2HB   LEU  91          1HB       LEU  91  -5.820 -10.194 -15.971
  678    HG   LEU  91           HG       LEU  91  -7.134 -12.388 -17.463
  679   1HD1  LEU  91          1HD1      LEU  91  -4.313 -11.790 -18.193
  680   2HD1  LEU  91          2HD1      LEU  91  -5.606 -10.941 -19.040
  681   3HD1  LEU  91          3HD1      LEU  91  -5.540 -12.703 -19.071
  682   1HD2  LEU  91          1HD2      LEU  91  -5.833 -13.701 -16.164
  683   2HD2  LEU  91          2HD2      LEU  91  -5.764 -12.253 -15.159
  684   3HD2  LEU  91          3HD2      LEU  91  -4.445 -12.619 -16.270
  685    H    TYR  92           H        TYR  92  -8.472  -9.969 -13.662
  686    HA   TYR  92           HA       TYR  92  -8.842 -11.278 -11.844
  687   1HB   TYR  92          2HB       TYR  92 -10.386 -12.378 -13.979
  688   2HB   TYR  92          1HB       TYR  92  -9.769 -13.708 -13.006
  689    HD1  TYR  92           1HD      TYR  92 -12.648 -12.273 -13.437
  690    HD2  TYR  92           2HD      TYR  92  -9.773 -12.484 -10.303
  691    HE1  TYR  92           1HE      TYR  92 -14.426 -11.877 -11.787
  692    HE2  TYR  92           2HE      TYR  92 -11.547 -12.090  -8.648
  693    HH   TYR  92           HH       TYR  92 -13.931 -12.285  -8.417
  694    H    GLN  93           H        GLN  93  -6.598 -11.470 -11.408
  695    HA   GLN  93           HA       GLN  93  -5.685 -14.095 -11.063
  696   1HB   GLN  93          2HB       GLN  93  -5.345 -14.027 -13.500
  697   2HB   GLN  93          1HB       GLN  93  -4.320 -12.610 -13.316
  698   1HG   GLN  93          2HG       GLN  93  -2.548 -13.813 -12.646
  699   2HG   GLN  93          1HG       GLN  93  -3.531 -14.947 -11.720
  700   1HE2  GLN  93          1HE2      GLN  93  -1.452 -15.885 -13.171
  701   2HE2  GLN  93          2HE2      GLN  93  -2.024 -16.768 -14.542
  702    H    CYS  94           H        CYS  94  -4.018 -14.164  -9.625
  703    HA   CYS  94           HA       CYS  94  -3.340 -11.775  -8.259
  704   1HB   CYS  94          2HB       CYS  94  -3.470 -13.994  -7.163
  705   2HB   CYS  94          1HB       CYS  94  -2.040 -14.499  -8.055
  706    HG   CYS  94           HG       CYS  94  -2.030 -12.940  -5.496
  707    H    GLN  95           H        GLN  95  -2.523 -10.602 -10.171
  708    HA   GLN  95           HA       GLN  95  -0.200 -11.283 -11.557
  709   1HB   GLN  95          2HB       GLN  95  -1.798  -8.860 -11.130
  710   2HB   GLN  95          1HB       GLN  95  -0.101  -8.539 -11.460
  711   1HG   GLN  95          2HG       GLN  95  -1.378  -8.506 -13.504
  712   2HG   GLN  95          1HG       GLN  95  -0.253  -9.864 -13.510
  713   1HE2  GLN  95          1HE2      GLN  95  -3.445  -8.894 -13.912
  714   2HE2  GLN  95          2HE2      GLN  95  -4.181 -10.456 -13.967
  715    H    GLU  96           H        GLU  96   1.949 -10.329 -11.389
  716    HA   GLU  96           HA       GLU  96   3.026 -10.625  -8.779
  717   1HB   GLU  96          2HB       GLU  96   5.164 -10.053  -9.795
  718   2HB   GLU  96          1HB       GLU  96   4.291 -11.189 -10.815
  719   1HG   GLU  96          2HG       GLU  96   3.468  -8.889 -11.910
  720   2HG   GLU  96          1HG       GLU  96   5.048  -8.386 -11.311
  721    H    LEU  97           H        LEU  97   4.085  -9.062  -7.482
  722    HA   LEU  97           HA       LEU  97   2.864  -6.415  -7.686
  723   1HB   LEU  97          2HB       LEU  97   4.094  -8.007  -5.482
  724   2HB   LEU  97          1HB       LEU  97   4.065  -6.259  -5.342
  725    HG   LEU  97           HG       LEU  97   1.495  -6.629  -5.931
  726   1HD1  LEU  97          1HD1      LEU  97   2.506  -9.276  -5.098
  727   2HD1  LEU  97          2HD1      LEU  97   1.134  -8.852  -6.123
  728   3HD1  LEU  97          3HD1      LEU  97   0.993  -8.740  -4.368
  729   1HD2  LEU  97          1HD2      LEU  97   2.856  -5.813  -3.773
  730   2HD2  LEU  97          2HD2      LEU  97   2.142  -7.290  -3.125
  731   3HD2  LEU  97          3HD2      LEU  97   1.105  -6.026  -3.786
  732    H    ASP  98           H        ASP  98   5.995  -7.990  -7.653
  733    HA   ASP  98           HA       ASP  98   7.666  -5.799  -7.326
  734   1HB   ASP  98          2HB       ASP  98   7.931  -8.477  -8.582
  735   2HB   ASP  98          1HB       ASP  98   9.159  -7.280  -8.989
  736    H    THR  99           H        THR  99   5.753  -6.715 -10.070
  737    HA   THR  99           HA       THR  99   7.205  -5.171 -11.988
  738    HB   THR  99           HB       THR  99   5.804  -7.103 -12.622
  739    HG1  THR  99           1HG      THR  99   4.963  -6.140 -14.444
  740   1HG2  THR  99          1HG2      THR  99   3.456  -7.050 -12.667
  741   2HG2  THR  99          2HG2      THR  99   3.411  -5.354 -12.188
  742   3HG2  THR  99          3HG2      THR  99   3.922  -6.581 -11.031
  743    H    TYR 100           H        TYR 100   4.728  -4.478  -9.666
  744    HA   TYR 100           HA       TYR 100   4.569  -1.731 -10.724
  745   1HB   TYR 100          2HB       TYR 100   2.305  -3.021  -9.214
  746   2HB   TYR 100          1HB       TYR 100   2.278  -1.568 -10.198
  747    HD1  TYR 100           1HD      TYR 100   1.069  -4.732 -10.123
  748    HD2  TYR 100           2HD      TYR 100   3.257  -2.189 -12.739
  749    HE1  TYR 100           1HE      TYR 100   0.287  -6.048 -12.045
  750    HE2  TYR 100           2HE      TYR 100   2.480  -3.499 -14.670
  751    HH   TYR 100           HH       TYR 100   1.617  -5.693 -15.181
  752    H    LEU 101           H        LEU 101   6.090  -3.267  -8.479
  753    HA   LEU 101           HA       LEU 101   5.171  -1.957  -6.089
  754   1HB   LEU 101          2HB       LEU 101   6.674  -4.205  -6.617
  755   2HB   LEU 101          1HB       LEU 101   7.866  -3.071  -6.022
  756    HG   LEU 101           HG       LEU 101   5.388  -3.317  -4.424
  757   1HD1  LEU 101          1HD1      LEU 101   5.981  -5.362  -3.388
  758   2HD1  LEU 101          2HD1      LEU 101   7.506  -5.446  -4.270
  759   3HD1  LEU 101          3HD1      LEU 101   5.979  -5.660  -5.127
  760   1HD2  LEU 101          1HD2      LEU 101   6.931  -1.873  -3.489
  761   2HD2  LEU 101          2HD2      LEU 101   8.306  -2.873  -3.960
  762   3HD2  LEU 101          3HD2      LEU 101   7.259  -3.381  -2.634
  763    H    ILE 102           H        ILE 102   5.300   0.249  -6.604
  764    HA   ILE 102           HA       ILE 102   6.254   2.312  -6.699
  765    HB   ILE 102           HB       ILE 102   8.686   1.010  -5.483
  766   1HG1  ILE 102          2HG1      ILE 102   6.235   2.097  -4.079
  767   2HG1  ILE 102          1HG1      ILE 102   6.625   0.389  -4.254
  768   1HG2  ILE 102          1HG2      ILE 102   9.398   3.130  -5.805
  769   2HG2  ILE 102          2HG2      ILE 102   8.487   3.422  -4.324
  770   3HG2  ILE 102          3HG2      ILE 102   7.762   3.782  -5.890
  771   1HD1  ILE 102          1HD1      ILE 102   8.131   0.438  -2.597
  772   2HD1  ILE 102          2HD1      ILE 102   7.257   1.889  -2.106
  773   3HD1  ILE 102          3HD1      ILE 102   8.739   2.029  -3.052
  774    HA   PRO 103           HA       PRO 103   8.477   1.759 -10.610
  775   1HB   PRO 103          2HB       PRO 103   7.975   4.258 -11.550
  776   2HB   PRO 103          1HB       PRO 103   6.800   2.942 -11.643
  777   1HG   PRO 103          2HG       PRO 103   6.979   5.184  -9.668
  778   2HG   PRO 103          1HG       PRO 103   5.549   4.515 -10.477
  779   1HD   PRO 103          2HD       PRO 103   6.212   3.879  -7.931
  780   2HD   PRO 103          1HD       PRO 103   5.403   2.734  -9.019
  781    H    GLN 104           H        GLN 104  10.187   3.114 -11.726
  782    HA   GLN 104           HA       GLN 104  11.944   4.274  -9.677
  783   1HB   GLN 104          2HB       GLN 104  12.463   2.284 -11.477
  784   2HB   GLN 104          1HB       GLN 104  13.091   3.692 -12.324
  785   1HG   GLN 104          2HG       GLN 104  14.414   4.231 -10.276
  786   2HG   GLN 104          1HG       GLN 104  13.896   2.683  -9.609
  787   1HE2  GLN 104          1HE2      GLN 104  15.943   4.287 -11.870
  788   2HE2  GLN 104          2HE2      GLN 104  16.842   2.899 -12.371
  789    H    ILE 105           H        ILE 105  11.004   4.745 -13.080
  790    HA   ILE 105           HA       ILE 105  11.448   7.631 -12.699
  791    HB   ILE 105           HB       ILE 105  11.937   6.150 -15.282
  792   1HG1  ILE 105          2HG1      ILE 105  14.279   7.327 -14.018
  793   2HG1  ILE 105          1HG1      ILE 105  13.544   6.092 -13.000
  794   1HG2  ILE 105          1HG2      ILE 105  11.302   8.510 -15.505
  795   2HG2  ILE 105          2HG2      ILE 105  12.968   8.225 -16.010
  796   3HG2  ILE 105          3HG2      ILE 105  12.636   8.961 -14.443
  797   1HD1  ILE 105          1HD1      ILE 105  13.639   4.534 -14.926
  798   2HD1  ILE 105          2HD1      ILE 105  15.218   5.076 -14.362
  799   3HD1  ILE 105          3HD1      ILE 105  14.519   5.769 -15.826
  800    HA   PRO 106           HA       PRO 106   7.207   7.910 -14.009
  801   1HB   PRO 106          2HB       PRO 106   7.103  10.572 -14.506
  802   2HB   PRO 106          1HB       PRO 106   7.133   9.906 -12.869
  803   1HG   PRO 106          2HG       PRO 106   9.375  11.056 -14.489
  804   2HG   PRO 106          1HG       PRO 106   8.988  11.307 -12.776
  805   1HD   PRO 106          2HD       PRO 106  10.921   9.597 -13.602
  806   2HD   PRO 106          1HD       PRO 106   9.960   9.318 -12.135
  807    H    HIS 107           H        HIS 107   5.955   8.262 -15.888
  808    HA   HIS 107           HA       HIS 107   7.416   8.946 -18.335
  809   1HB   HIS 107          2HB       HIS 107   6.058   6.363 -17.713
  810   2HB   HIS 107          1HB       HIS 107   5.953   6.983 -19.358
  811    HD1  HIS 107           1HD      HIS 107   7.645   4.452 -18.076
  812    HD2  HIS 107           2HD      HIS 107   9.074   8.037 -19.617
  813    HE1  HIS 107           1HE      HIS 107  10.023   3.994 -18.752
  814    HE2  HIS 107           2HE      HIS 107  10.895   6.201 -19.594
  815    H    SER 108           H        SER 108   6.284  10.909 -18.360
  816    HA   SER 108           HA       SER 108   3.384  10.688 -18.825
  817   1HB   SER 108          2HB       SER 108   4.600  13.346 -18.295
  818   2HB   SER 108          1HB       SER 108   3.056  12.686 -17.761
  819    HG   SER 108           HG       SER 108   4.334  11.327 -16.323
  820    H    HIS 109           H        HIS 109   2.487  12.298 -20.373
  821    HA   HIS 109           HA       HIS 109   4.258  13.415 -22.343
  822   1HB   HIS 109          2HB       HIS 109   3.932  10.875 -22.851
  823   2HB   HIS 109          1HB       HIS 109   2.340  11.373 -23.413
  824    HD1  HIS 109           1HD      HIS 109   5.843  11.173 -24.436
  825    HD2  HIS 109           2HD      HIS 109   2.449  13.252 -25.629
  826    HE1  HIS 109           1HE      HIS 109   6.367  12.054 -26.733
  827    HE2  HIS 109           2HE      HIS 109   4.264  13.229 -27.470
  828    H    TYR 110           H        TYR 110   2.156  14.316 -20.554
  829    HA   TYR 110           HA       TYR 110   0.255  15.359 -22.550
  830   1HB   TYR 110          2HB       TYR 110  -0.195  14.191 -19.877
  831   2HB   TYR 110          1HB       TYR 110  -1.084  15.676 -20.200
  832    HD1  TYR 110           1HD      TYR 110  -3.277  15.182 -20.712
  833    HD2  TYR 110           2HD      TYR 110  -0.200  12.721 -22.317
  834    HE1  TYR 110           1HE      TYR 110  -4.962  13.903 -21.965
  835    HE2  TYR 110           2HE      TYR 110  -1.877  11.435 -23.576
  836    HH   TYR 110           HH       TYR 110  -4.832  11.192 -22.985
  Start of MODEL    9
    1   1H    GLY   1          1HT       GLY   1 -14.879 -16.911   4.368
    2   2H    GLY   1          2HT       GLY   1 -14.433 -15.768   5.534
    3   3H    GLY   1          3HT       GLY   1 -14.139 -15.464   3.896
    4   1HA   GLY   1          1HA       GLY   1 -16.824 -15.728   5.137
    5   2HA   GLY   1          2HA       GLY   1 -16.052 -14.206   4.718
    6    H    SER   2           H        SER   2 -17.534 -17.121   3.468
    7    HA   SER   2           HA       SER   2 -18.519 -17.605   1.477
    8   1HB   SER   2          2HB       SER   2 -18.491 -14.662   0.829
    9   2HB   SER   2          1HB       SER   2 -19.677 -15.880   0.356
   10    HG   SER   2           HG       SER   2 -20.236 -16.026   2.605
   11    H    GLN   3           H        GLN   3 -16.054 -18.255   1.279
   12    HA   GLN   3           HA       GLN   3 -14.873 -16.892  -1.037
   13   1HB   GLN   3          2HB       GLN   3 -13.526 -18.989   0.654
   14   2HB   GLN   3          1HB       GLN   3 -12.779 -17.805  -0.410
   15   1HG   GLN   3          2HG       GLN   3 -13.659 -16.028   1.147
   16   2HG   GLN   3          1HG       GLN   3 -14.072 -17.333   2.259
   17   1HE2  GLN   3          1HE2      GLN   3 -12.035 -15.043   2.172
   18   2HE2  GLN   3          2HE2      GLN   3 -10.559 -15.803   2.649
   19    H    ASP   4           H        ASP   4 -15.791 -17.748  -2.822
   20    HA   ASP   4           HA       ASP   4 -16.212 -20.612  -3.032
   21   1HB   ASP   4          2HB       ASP   4 -17.636 -18.523  -3.996
   22   2HB   ASP   4          1HB       ASP   4 -16.644 -18.895  -5.402
   23    H    ARG   5           H        ARG   5 -14.318 -18.100  -4.649
   24    HA   ARG   5           HA       ARG   5 -12.295 -20.062  -5.320
   25   1HB   ARG   5          2HB       ARG   5 -14.229 -19.399  -7.225
   26   2HB   ARG   5          1HB       ARG   5 -12.816 -18.457  -7.677
   27   1HG   ARG   5          2HG       ARG   5 -12.332 -21.289  -7.015
   28   2HG   ARG   5          1HG       ARG   5 -13.242 -20.968  -8.492
   29   1HD   ARG   5          2HD       ARG   5 -11.294 -19.194  -8.837
   30   2HD   ARG   5          1HD       ARG   5 -10.423 -20.332  -7.812
   31    HE   ARG   5           HE       ARG   5 -11.247 -20.728 -10.541
   32   1HH1  ARG   5          1HH1      ARG   5 -10.336 -22.299  -7.561
   33   2HH1  ARG   5          2HH1      ARG   5  -9.834 -23.762  -8.340
   34   1HH2  ARG   5          1HH2      ARG   5 -10.588 -22.651 -11.567
   35   2HH2  ARG   5          2HH2      ARG   5  -9.976 -23.962 -10.614
   36    H    LYS   6           H        LYS   6 -12.991 -16.847  -6.639
   37    HA   LYS   6           HA       LYS   6 -11.780 -14.915  -6.659
   38   1HB   LYS   6          2HB       LYS   6 -10.591 -15.616  -4.001
   39   2HB   LYS   6          1HB       LYS   6 -11.148 -14.063  -4.597
   40   1HG   LYS   6          2HG       LYS   6 -13.341 -15.917  -4.442
   41   2HG   LYS   6          1HG       LYS   6 -12.498 -15.810  -2.897
   42   1HD   LYS   6          2HD       LYS   6 -12.616 -13.210  -3.478
   43   2HD   LYS   6          1HD       LYS   6 -14.036 -13.751  -4.376
   44   1HE   LYS   6          2HE       LYS   6 -14.573 -13.040  -2.075
   45   2HE   LYS   6          1HE       LYS   6 -14.978 -14.728  -2.382
   46   1HZ   LYS   6          1HZ       LYS   6 -12.330 -14.487  -1.383
   47   2HZ   LYS   6          2HZ       LYS   6 -13.632 -15.368  -0.758
   48   3HZ   LYS   6          3HZ       LYS   6 -13.427 -13.744  -0.331
   49    H    ILE   7           H        ILE   7  -9.485 -13.996  -6.436
   50    HA   ILE   7           HA       ILE   7  -7.589 -16.073  -7.315
   51    HB   ILE   7           HB       ILE   7  -6.345 -14.060  -8.315
   52   1HG1  ILE   7          2HG1      ILE   7  -9.021 -12.756  -8.489
   53   2HG1  ILE   7          1HG1      ILE   7  -8.090 -12.536  -7.018
   54   1HG2  ILE   7          1HG2      ILE   7  -7.299 -14.489 -10.352
   55   2HG2  ILE   7          2HG2      ILE   7  -8.940 -14.501  -9.706
   56   3HG2  ILE   7          3HG2      ILE   7  -7.872 -15.877  -9.427
   57   1HD1  ILE   7          1HD1      ILE   7  -6.328 -12.083  -9.161
   58   2HD1  ILE   7          2HD1      ILE   7  -6.972 -10.913  -8.008
   59   3HD1  ILE   7          3HD1      ILE   7  -7.821 -11.218  -9.523
   60    H    PHE   8           H        PHE   8  -8.188 -13.671  -4.938
   61    HA   PHE   8           HA       PHE   8  -5.393 -13.569  -4.103
   62   1HB   PHE   8          2HB       PHE   8  -7.868 -12.093  -3.210
   63   2HB   PHE   8          1HB       PHE   8  -6.343 -11.973  -2.352
   64    HD1  PHE   8           1HD      PHE   8  -7.724  -9.623  -3.442
   65    HD2  PHE   8           2HD      PHE   8  -4.896 -12.231  -5.265
   66    HE1  PHE   8           1HE      PHE   8  -7.026  -7.809  -4.946
   67    HE2  PHE   8           2HE      PHE   8  -4.196 -10.421  -6.773
   68    HZ   PHE   8           HZ       PHE   8  -5.261  -8.206  -6.615
   69    H    ARG   9           H        ARG   9  -8.563 -14.429  -2.731
   70    HA   ARG   9           HA       ARG   9  -9.139 -15.692  -0.917
   71   1HB   ARG   9          2HB       ARG   9  -8.393 -17.391  -2.576
   72   2HB   ARG   9          1HB       ARG   9  -6.793 -17.353  -1.850
   73   1HG   ARG   9          2HG       ARG   9  -7.942 -17.994   0.328
   74   2HG   ARG   9          1HG       ARG   9  -9.356 -18.358  -0.662
   75   1HD   ARG   9          2HD       ARG   9  -6.673 -19.515  -1.325
   76   2HD   ARG   9          1HD       ARG   9  -7.698 -20.257  -0.101
   77    HE   ARG   9           HE       ARG   9  -9.171 -20.927  -1.755
   78   1HH1  ARG   9          1HH1      ARG   9  -6.690 -18.879  -3.118
   79   2HH1  ARG   9          2HH1      ARG   9  -7.084 -19.284  -4.754
   80   1HH2  ARG   9          1HH2      ARG   9  -9.684 -21.456  -3.907
   81   2HH2  ARG   9          2HH2      ARG   9  -8.782 -20.743  -5.202
   82    H    GLY  10           H        GLY  10  -8.679 -14.325   0.794
   83   1HA   GLY  10          2HA       GLY  10  -7.748 -13.938   2.880
   84   2HA   GLY  10          1HA       GLY  10  -6.600 -15.228   2.562
   85    H    LEU  11           H        LEU  11  -7.346 -11.871   1.773
   86    HA   LEU  11           HA       LEU  11  -4.496 -11.255   1.865
   87   1HB   LEU  11          2HB       LEU  11  -5.973 -11.478  -0.555
   88   2HB   LEU  11          1HB       LEU  11  -5.604  -9.783  -0.312
   89    HG   LEU  11           HG       LEU  11  -3.347 -11.656   0.061
   90   1HD1  LEU  11          1HD1      LEU  11  -4.531 -12.611  -1.888
   91   2HD1  LEU  11          2HD1      LEU  11  -2.950 -11.941  -2.294
   92   3HD1  LEU  11          3HD1      LEU  11  -4.416 -11.042  -2.686
   93   1HD2  LEU  11          1HD2      LEU  11  -3.476  -9.038   0.067
   94   2HD2  LEU  11          2HD2      LEU  11  -3.364  -9.247  -1.680
   95   3HD2  LEU  11          3HD2      LEU  11  -2.092  -9.876  -0.634
   96    H    GLU  12           H        GLU  12  -4.084  -8.913   1.931
   97    HA   GLU  12           HA       GLU  12  -6.367  -7.270   2.723
   98   1HB   GLU  12          2HB       GLU  12  -4.490  -8.388   4.571
   99   2HB   GLU  12          1HB       GLU  12  -4.250  -6.648   4.520
  100   1HG   GLU  12          2HG       GLU  12  -5.936  -6.464   5.940
  101   2HG   GLU  12          1HG       GLU  12  -7.005  -6.966   4.632
  102    H    ILE  13           H        ILE  13  -6.243  -5.637   1.315
  103    HA   ILE  13           HA       ILE  13  -3.609  -4.384   0.884
  104    HB   ILE  13           HB       ILE  13  -5.797  -4.495  -1.184
  105   1HG1  ILE  13          2HG1      ILE  13  -3.502  -6.058  -1.899
  106   2HG1  ILE  13          1HG1      ILE  13  -4.105  -6.609  -0.338
  107   1HG2  ILE  13          1HG2      ILE  13  -4.297  -3.530  -2.655
  108   2HG2  ILE  13          2HG2      ILE  13  -2.894  -4.007  -1.698
  109   3HG2  ILE  13          3HG2      ILE  13  -3.935  -2.695  -1.144
  110   1HD1  ILE  13          1HD1      ILE  13  -5.321  -7.918  -1.748
  111   2HD1  ILE  13          2HD1      ILE  13  -5.395  -6.688  -3.009
  112   3HD1  ILE  13          3HD1      ILE  13  -6.415  -6.547  -1.577
  113    H    CYS  14           H        CYS  14  -3.486  -2.266   1.261
  114    HA   CYS  14           HA       CYS  14  -5.996  -0.796   1.698
  115   1HB   CYS  14          2HB       CYS  14  -4.526   0.749   3.082
  116   2HB   CYS  14          1HB       CYS  14  -4.806  -0.855   3.744
  117    HG   CYS  14           HG       CYS  14  -2.388  -1.141   3.829
  118    H    CYS  15           H        CYS  15  -6.296   1.204   0.789
  119    HA   CYS  15           HA       CYS  15  -4.396   1.915  -1.339
  120   1HB   CYS  15          2HB       CYS  15  -6.328   3.166  -2.324
  121   2HB   CYS  15          1HB       CYS  15  -6.586   1.429  -2.208
  122    HG   CYS  15           HG       CYS  15  -7.823   3.211  -0.005
  123    H    TYR  16           H        TYR  16  -3.005   3.401  -0.601
  124    HA   TYR  16           HA       TYR  16  -3.938   5.484   1.217
  125   1HB   TYR  16          2HB       TYR  16  -1.473   4.101   0.842
  126   2HB   TYR  16          1HB       TYR  16  -1.183   5.814   0.558
  127    HD1  TYR  16           1HD      TYR  16   0.010   6.474   2.460
  128    HD2  TYR  16           2HD      TYR  16  -3.590   4.256   2.927
  129    HE1  TYR  16           1HE      TYR  16   0.092   6.865   4.886
  130    HE2  TYR  16           2HE      TYR  16  -3.520   4.641   5.354
  131    HH   TYR  16           HH       TYR  16  -2.210   6.755   6.846
  132    H    GLY  17           H        GLY  17  -4.271   7.542   0.641
  133   1HA   GLY  17          2HA       GLY  17  -3.981   9.515  -0.587
  134   2HA   GLY  17          1HA       GLY  17  -3.061   8.612  -1.780
  135    HA   PRO  18           HA       PRO  18  -7.588   9.190  -3.108
  136   1HB   PRO  18          2HB       PRO  18  -7.559  11.515  -4.439
  137   2HB   PRO  18          1HB       PRO  18  -7.786  11.456  -2.687
  138   1HG   PRO  18          2HG       PRO  18  -5.315  12.079  -4.257
  139   2HG   PRO  18          1HG       PRO  18  -5.949  12.876  -2.805
  140   1HD   PRO  18          2HD       PRO  18  -3.941  11.005  -2.775
  141   2HD   PRO  18          1HD       PRO  18  -5.019  11.324  -1.403
  142    H    PHE  19           H        PHE  19  -4.548   8.911  -4.437
  143    HA   PHE  19           HA       PHE  19  -3.750   8.134  -6.412
  144   1HB   PHE  19          2HB       PHE  19  -6.647   7.366  -6.646
  145   2HB   PHE  19          1HB       PHE  19  -5.520   7.059  -7.964
  146    HD1  PHE  19           1HD      PHE  19  -4.462   5.025  -8.023
  147    HD2  PHE  19           2HD      PHE  19  -5.790   6.546  -4.280
  148    HE1  PHE  19           1HE      PHE  19  -3.740   2.943  -6.928
  149    HE2  PHE  19           2HE      PHE  19  -5.073   4.468  -3.175
  150    HZ   PHE  19           HZ       PHE  19  -4.046   2.663  -4.498
  151    H    THR  20           H        THR  20  -6.865   9.146  -7.733
  152    HA   THR  20           HA       THR  20  -5.630  11.506  -8.928
  153    HB   THR  20           HB       THR  20  -5.256   9.845 -10.625
  154    HG1  THR  20           1HG      THR  20  -5.946  11.771 -11.489
  155   1HG2  THR  20          1HG2      THR  20  -6.903   8.452 -11.582
  156   2HG2  THR  20          2HG2      THR  20  -8.195   9.241 -10.679
  157   3HG2  THR  20          3HG2      THR  20  -7.013   8.240  -9.836
  158    H    ASN  21           H        ASN  21  -8.596   9.556  -8.718
  159    HA   ASN  21           HA       ASN  21 -10.125  12.069  -8.523
  160   1HB   ASN  21          2HB       ASN  21 -10.927   9.394  -9.680
  161   2HB   ASN  21          1HB       ASN  21 -12.076  10.687  -9.345
  162   1HD2  ASN  21          1HD2      ASN  21 -10.917  12.911 -10.170
  163   2HD2  ASN  21          2HD2      ASN  21 -10.530  12.844 -11.852
  164    H    MET  22           H        MET  22 -11.013   8.706  -7.817
  165    HA   MET  22           HA       MET  22 -10.864   8.964  -5.002
  166   1HB   MET  22          2HB       MET  22 -13.340   8.896  -4.571
  167   2HB   MET  22          1HB       MET  22 -12.735  10.436  -5.166
  168   1HG   MET  22          2HG       MET  22 -13.612   8.636  -7.284
  169   2HG   MET  22          1HG       MET  22 -14.889   9.070  -6.149
  170   1HE   MET  22          1HE       MET  22 -15.644  12.646  -6.678
  171   2HE   MET  22          2HE       MET  22 -15.613  11.286  -5.555
  172   3HE   MET  22          3HE       MET  22 -16.474  11.145  -7.088
  173    HA   PRO  23           HA       PRO  23 -11.650   4.696  -6.751
  174   1HB   PRO  23          2HB       PRO  23  -9.191   3.775  -7.153
  175   2HB   PRO  23          1HB       PRO  23  -9.944   4.864  -8.327
  176   1HG   PRO  23          2HG       PRO  23  -7.903   5.462  -6.224
  177   2HG   PRO  23          1HG       PRO  23  -8.006   6.063  -7.888
  178   1HD   PRO  23          2HD       PRO  23  -8.872   7.433  -5.625
  179   2HD   PRO  23          1HD       PRO  23  -9.379   7.775  -7.289
  180    H    THR  24           H        THR  24 -10.769   6.018  -3.983
  181    HA   THR  24           HA       THR  24  -9.306   4.087  -2.581
  182    HB   THR  24           HB       THR  24 -11.109   5.293  -0.764
  183    HG1  THR  24           1HG      THR  24 -10.887   7.482  -1.384
  184   1HG2  THR  24          1HG2      THR  24  -8.814   6.890  -0.896
  185   2HG2  THR  24          2HG2      THR  24  -8.300   5.244  -1.271
  186   3HG2  THR  24          3HG2      THR  24  -9.162   5.579   0.230
  187    H    ASP  25           H        ASP  25 -12.809   4.480  -2.994
  188    HA   ASP  25           HA       ASP  25 -13.313   2.051  -1.477
  189   1HB   ASP  25          2HB       ASP  25 -14.751   4.352  -1.759
  190   2HB   ASP  25          1HB       ASP  25 -15.558   3.303  -2.922
  191    H    GLN  26           H        GLN  26 -13.046   3.118  -4.746
  192    HA   GLN  26           HA       GLN  26 -14.404   0.871  -5.906
  193   1HB   GLN  26          2HB       GLN  26 -13.728   3.349  -6.810
  194   2HB   GLN  26          1HB       GLN  26 -12.471   2.374  -7.553
  195   1HG   GLN  26          2HG       GLN  26 -14.405   0.869  -8.338
  196   2HG   GLN  26          1HG       GLN  26 -15.431   2.246  -7.936
  197   1HE2  GLN  26          1HE2      GLN  26 -14.887   4.304  -8.967
  198   2HE2  GLN  26          2HE2      GLN  26 -14.251   4.284 -10.573
  199    H    LEU  27           H        LEU  27 -11.115   1.720  -5.071
  200    HA   LEU  27           HA       LEU  27  -9.913  -0.470  -6.470
  201   1HB   LEU  27          2HB       LEU  27  -8.752   1.675  -5.869
  202   2HB   LEU  27          1HB       LEU  27  -8.757   1.144  -4.198
  203    HG   LEU  27           HG       LEU  27  -7.465  -0.905  -4.997
  204   1HD1  LEU  27          1HD1      LEU  27  -6.135  -0.434  -7.093
  205   2HD1  LEU  27          2HD1      LEU  27  -7.320   0.820  -7.454
  206   3HD1  LEU  27          3HD1      LEU  27  -7.829  -0.864  -7.328
  207   1HD2  LEU  27          1HD2      LEU  27  -5.629   1.258  -5.571
  208   2HD2  LEU  27          2HD2      LEU  27  -5.675   0.150  -4.199
  209   3HD2  LEU  27          3HD2      LEU  27  -6.650   1.620  -4.179
  210    H    GLU  28           H        GLU  28 -10.816   0.179  -3.096
  211    HA   GLU  28           HA       GLU  28  -9.837  -2.285  -2.094
  212   1HB   GLU  28          2HB       GLU  28 -11.159  -1.788  -0.096
  213   2HB   GLU  28          1HB       GLU  28 -10.244  -0.386  -0.626
  214   1HG   GLU  28          2HG       GLU  28 -12.102   0.802  -0.624
  215   2HG   GLU  28          1HG       GLU  28 -12.757  -0.239  -1.885
  216    H    TRP  29           H        TRP  29 -12.763  -1.341  -3.694
  217    HA   TRP  29           HA       TRP  29 -14.354  -3.578  -2.931
  218   1HB   TRP  29          2HB       TRP  29 -15.607  -1.780  -3.738
  219   2HB   TRP  29          1HB       TRP  29 -14.480  -1.453  -5.046
  220    HD1  TRP  29           HD       TRP  29 -17.021  -4.221  -4.108
  221    HE1  TRP  29           1HE      TRP  29 -18.159  -5.024  -6.275
  222    HE3  TRP  29           3HE      TRP  29 -14.434  -1.381  -7.469
  223    HZ2  TRP  29           2HZ      TRP  29 -17.972  -4.521  -9.047
  224    HZ3  TRP  29           3HZ      TRP  29 -14.970  -1.600  -9.860
  225    HH2  TRP  29           HH       TRP  29 -16.702  -3.139 -10.632
  226    H    MET  30           H        MET  30 -12.456  -2.816  -5.812
  227    HA   MET  30           HA       MET  30 -12.888  -5.194  -7.214
  228   1HB   MET  30          2HB       MET  30 -10.464  -3.381  -7.205
  229   2HB   MET  30          1HB       MET  30 -10.753  -4.653  -8.383
  230   1HG   MET  30          2HG       MET  30 -13.080  -3.181  -8.446
  231   2HG   MET  30          1HG       MET  30 -11.822  -1.964  -8.247
  232   1HE   MET  30          1HE       MET  30 -10.254  -1.321  -9.549
  233   2HE   MET  30          2HE       MET  30 -10.548  -1.200 -11.284
  234   3HE   MET  30          3HE       MET  30  -9.390  -2.377 -10.665
  235    H    VAL  31           H        VAL  31 -10.263  -4.354  -4.926
  236    HA   VAL  31           HA       VAL  31  -8.933  -6.831  -5.078
  237    HB   VAL  31           HB       VAL  31  -7.982  -6.285  -2.859
  238   1HG1  VAL  31          1HG1      VAL  31  -6.507  -5.011  -3.931
  239   2HG1  VAL  31          2HG1      VAL  31  -7.645  -3.662  -3.981
  240   3HG1  VAL  31          3HG1      VAL  31  -7.655  -4.876  -5.263
  241   1HG2  VAL  31          1HG2      VAL  31  -9.886  -3.967  -2.975
  242   2HG2  VAL  31          2HG2      VAL  31  -8.551  -4.105  -1.835
  243   3HG2  VAL  31          3HG2      VAL  31  -9.873  -5.270  -1.790
  244    H    GLN  32           H        GLN  32 -11.482  -5.639  -2.944
  245    HA   GLN  32           HA       GLN  32 -11.765  -7.885  -1.302
  246   1HB   GLN  32          2HB       GLN  32 -13.300  -5.490  -1.946
  247   2HB   GLN  32          1HB       GLN  32 -14.341  -6.864  -1.615
  248   1HG   GLN  32          2HG       GLN  32 -12.257  -6.737   0.343
  249   2HG   GLN  32          1HG       GLN  32 -13.063  -5.174   0.222
  250   1HE2  GLN  32          1HE2      GLN  32 -13.945  -5.431   2.285
  251   2HE2  GLN  32          2HE2      GLN  32 -15.273  -6.495   2.582
  252    H    LEU  33           H        LEU  33 -12.945  -7.145  -4.493
  253    HA   LEU  33           HA       LEU  33 -14.745  -9.327  -4.746
  254   1HB   LEU  33          2HB       LEU  33 -13.770  -7.132  -6.362
  255   2HB   LEU  33          1HB       LEU  33 -13.881  -8.599  -7.310
  256    HG   LEU  33           HG       LEU  33 -15.941  -7.456  -7.577
  257   1HD1  LEU  33          1HD1      LEU  33 -15.891  -9.989  -6.864
  258   2HD1  LEU  33          2HD1      LEU  33 -17.416  -9.127  -7.073
  259   3HD1  LEU  33          3HD1      LEU  33 -16.756  -9.372  -5.455
  260   1HD2  LEU  33          1HD2      LEU  33 -15.661  -5.982  -5.607
  261   2HD2  LEU  33          2HD2      LEU  33 -16.168  -7.320  -4.576
  262   3HD2  LEU  33          3HD2      LEU  33 -17.287  -6.645  -5.759
  263    H    CYS  34           H        CYS  34 -11.334  -9.012  -4.975
  264    HA   CYS  34           HA       CYS  34 -11.016 -11.470  -6.509
  265   1HB   CYS  34          2HB       CYS  34  -9.133  -9.331  -5.553
  266   2HB   CYS  34          1HB       CYS  34  -8.523 -10.875  -6.140
  267    HG   CYS  34           HG       CYS  34 -10.350  -9.326  -8.072
  268    H    GLY  35           H        GLY  35 -11.529 -10.732  -3.322
  269   1HA   GLY  35          2HA       GLY  35 -11.620 -12.675  -1.826
  270   2HA   GLY  35          1HA       GLY  35 -10.052 -13.142  -2.463
  271    H    ALA  36           H        ALA  36  -9.249 -10.223  -2.385
  272    HA   ALA  36           HA       ALA  36  -7.968 -10.291   0.137
  273   1HB   ALA  36          1HB       ALA  36  -6.908  -9.165  -1.687
  274   2HB   ALA  36          2HB       ALA  36  -7.259  -7.973  -0.436
  275   3HB   ALA  36          3HB       ALA  36  -8.278  -8.070  -1.872
  276    H    SER  37           H        SER  37  -8.046  -8.157   1.494
  277    HA   SER  37           HA       SER  37 -10.854  -7.453   2.019
  278   1HB   SER  37          2HB       SER  37  -9.238  -9.035   3.684
  279   2HB   SER  37          1HB       SER  37  -9.274  -7.446   4.446
  280    HG   SER  37           HG       SER  37 -11.628  -7.586   4.144
  281    H    VAL  38           H        VAL  38 -11.243  -5.340   2.506
  282    HA   VAL  38           HA       VAL  38  -9.213  -3.442   1.868
  283    HB   VAL  38           HB       VAL  38 -11.566  -3.017   1.336
  284   1HG1  VAL  38          1HG1      VAL  38 -13.263  -2.864   2.855
  285   2HG1  VAL  38          2HG1      VAL  38 -12.194  -2.370   4.168
  286   3HG1  VAL  38          3HG1      VAL  38 -12.246  -4.059   3.662
  287   1HG2  VAL  38          1HG2      VAL  38  -9.765  -1.196   2.061
  288   2HG2  VAL  38          2HG2      VAL  38 -10.974  -0.880   3.305
  289   3HG2  VAL  38          3HG2      VAL  38 -11.411  -0.764   1.600
  290    H    VAL  39           H        VAL  39  -7.636  -2.863   3.191
  291    HA   VAL  39           HA       VAL  39  -7.991  -3.094   6.078
  292    HB   VAL  39           HB       VAL  39  -5.442  -2.265   4.720
  293   1HG1  VAL  39          1HG1      VAL  39  -4.383  -2.914   6.661
  294   2HG1  VAL  39          2HG1      VAL  39  -5.687  -4.003   7.132
  295   3HG1  VAL  39          3HG1      VAL  39  -5.900  -2.258   7.278
  296   1HG2  VAL  39          1HG2      VAL  39  -6.763  -4.901   4.658
  297   2HG2  VAL  39          2HG2      VAL  39  -5.048  -4.899   5.068
  298   3HG2  VAL  39          3HG2      VAL  39  -5.591  -4.191   3.548
  299    H    LYS  40           H        LYS  40  -8.528  -1.400   7.269
  300    HA   LYS  40           HA       LYS  40  -8.923   1.174   6.278
  301   1HB   LYS  40          2HB       LYS  40  -8.504   0.297   9.137
  302   2HB   LYS  40          1HB       LYS  40  -9.153   1.855   8.644
  303   1HG   LYS  40          2HG       LYS  40 -10.417  -0.802   8.006
  304   2HG   LYS  40          1HG       LYS  40 -10.884   0.242   9.351
  305   1HD   LYS  40          2HD       LYS  40 -10.805   1.707   6.857
  306   2HD   LYS  40          1HD       LYS  40 -11.876   0.309   6.745
  307   1HE   LYS  40          2HE       LYS  40 -13.104   2.265   7.495
  308   2HE   LYS  40          1HE       LYS  40 -13.041   1.048   8.770
  309   1HZ   LYS  40          1HZ       LYS  40 -11.418   3.525   8.582
  310   2HZ   LYS  40          2HZ       LYS  40 -11.150   2.309   9.726
  311   3HZ   LYS  40          3HZ       LYS  40 -12.607   3.167   9.731
  312    H    GLU  41           H        GLU  41  -6.245  -0.104   8.212
  313    HA   GLU  41           HA       GLU  41  -4.611   2.157   7.286
  314   1HB   GLU  41          2HB       GLU  41  -4.810   1.092  10.102
  315   2HB   GLU  41          1HB       GLU  41  -3.496   2.124   9.555
  316   1HG   GLU  41          2HG       GLU  41  -6.364   2.950   9.287
  317   2HG   GLU  41          1HG       GLU  41  -5.450   3.219  10.771
  318    H    LEU  42           H        LEU  42  -2.203   1.681   7.936
  319    HA   LEU  42           HA       LEU  42  -1.462  -0.682   6.536
  320   1HB   LEU  42          2HB       LEU  42   0.351   1.049   8.207
  321   2HB   LEU  42          1HB       LEU  42   0.796   0.024   6.857
  322    HG   LEU  42           HG       LEU  42  -1.025   2.394   6.514
  323   1HD1  LEU  42          1HD1      LEU  42   0.742   3.635   7.149
  324   2HD1  LEU  42          2HD1      LEU  42   1.325   3.261   5.527
  325   3HD1  LEU  42          3HD1      LEU  42   1.892   2.319   6.906
  326   1HD2  LEU  42          1HD2      LEU  42  -1.203   1.225   4.571
  327   2HD2  LEU  42          2HD2      LEU  42   0.381   0.468   4.751
  328   3HD2  LEU  42          3HD2      LEU  42   0.258   2.141   4.202
  329    H    SER  43           H        SER  43  -1.335   0.293   9.941
  330    HA   SER  43           HA       SER  43  -0.141  -2.167  10.798
  331   1HB   SER  43          2HB       SER  43  -0.341   0.306  11.914
  332   2HB   SER  43          1HB       SER  43  -1.595  -0.559  12.803
  333    HG   SER  43           HG       SER  43   0.128  -2.214  13.105
  334    H    SER  44           H        SER  44  -3.212  -1.469   9.737
  335    HA   SER  44           HA       SER  44  -4.751  -2.958  11.622
  336   1HB   SER  44          2HB       SER  44  -5.234  -1.608   9.038
  337   2HB   SER  44          1HB       SER  44  -6.300  -2.967   9.393
  338    HG   SER  44           HG       SER  44  -6.791  -1.943  11.389
  339    H    PHE  45           H        PHE  45  -2.664  -3.860   9.077
  340    HA   PHE  45           HA       PHE  45  -3.799  -6.131   8.007
  341   1HB   PHE  45          2HB       PHE  45  -0.908  -5.614   8.725
  342   2HB   PHE  45          1HB       PHE  45  -1.446  -6.971   7.744
  343    HD1  PHE  45           1HD      PHE  45   0.358  -4.349   7.248
  344    HD2  PHE  45           2HD      PHE  45  -3.526  -5.648   6.092
  345    HE1  PHE  45           1HE      PHE  45   0.486  -2.933   5.240
  346    HE2  PHE  45           2HE      PHE  45  -3.403  -4.234   4.078
  347    HZ   PHE  45           HZ       PHE  45  -1.394  -2.877   3.655
  348    H    THR  46           H        THR  46  -4.441  -8.021   8.798
  349    HA   THR  46           HA       THR  46  -4.408  -8.649  11.514
  350    HB   THR  46           HB       THR  46  -4.676 -10.601   9.223
  351    HG1  THR  46           1HG      THR  46  -6.883 -10.113   9.345
  352   1HG2  THR  46          1HG2      THR  46  -4.564 -11.836  11.228
  353   2HG2  THR  46          2HG2      THR  46  -6.271 -11.721  10.801
  354   3HG2  THR  46          3HG2      THR  46  -5.609 -10.695  12.073
  355    H    LEU  47           H        LEU  47  -2.182  -9.509   8.941
  356    HA   LEU  47           HA       LEU  47  -0.131 -10.497   8.944
  357   1HB   LEU  47          2HB       LEU  47  -0.291  -9.452  11.756
  358   2HB   LEU  47          1HB       LEU  47   1.110 -10.349  11.203
  359    HG   LEU  47           HG       LEU  47   0.296  -8.097   9.478
  360   1HD1  LEU  47          1HD1      LEU  47   0.074  -7.474  12.043
  361   2HD1  LEU  47          2HD1      LEU  47   0.775  -6.362  10.867
  362   3HD1  LEU  47          3HD1      LEU  47   1.826  -7.330  11.900
  363   1HD2  LEU  47          1HD2      LEU  47   2.476  -8.106   8.904
  364   2HD2  LEU  47          2HD2      LEU  47   2.438  -9.727   9.598
  365   3HD2  LEU  47          3HD2      LEU  47   3.023  -8.370  10.561
  366    H    GLY  48           H        GLY  48  -2.501 -12.110   9.501
  367   1HA   GLY  48          2HA       GLY  48  -1.747 -14.075  11.469
  368   2HA   GLY  48          1HA       GLY  48  -3.116 -14.166  10.373
  369    H    THR  49           H        THR  49  -2.862 -16.196   9.590
  370    HA   THR  49           HA       THR  49  -0.306 -16.803   8.254
  371    HB   THR  49           HB       THR  49  -2.287 -18.922   9.007
  372    HG1  THR  49           1HG      THR  49  -1.930 -18.620  11.034
  373   1HG2  THR  49          1HG2      THR  49  -0.511 -19.798   7.759
  374   2HG2  THR  49          2HG2      THR  49  -0.128 -20.172   9.439
  375   3HG2  THR  49          3HG2      THR  49   0.684 -18.835   8.626
  376    H    GLY  50           H        GLY  50  -3.811 -16.848   7.972
  377   1HA   GLY  50          2HA       GLY  50  -3.579 -17.714   5.172
  378   2HA   GLY  50          1HA       GLY  50  -5.055 -17.708   6.122
  379    H    VAL  51           H        VAL  51  -2.753 -15.060   5.883
  380    HA   VAL  51           HA       VAL  51  -4.455 -13.593   4.045
  381    HB   VAL  51           HB       VAL  51  -3.896 -12.426   6.772
  382   1HG1  VAL  51          1HG1      VAL  51  -5.816 -10.897   5.889
  383   2HG1  VAL  51          2HG1      VAL  51  -5.288 -11.474   4.309
  384   3HG1  VAL  51          3HG1      VAL  51  -4.155 -10.625   5.360
  385   1HG2  VAL  51          1HG2      VAL  51  -6.391 -13.732   5.704
  386   2HG2  VAL  51          2HG2      VAL  51  -6.360 -12.697   7.131
  387   3HG2  VAL  51          3HG2      VAL  51  -5.447 -14.206   7.115
  388    H    HIS  52           H        HIS  52  -3.198 -12.479   2.701
  389    HA   HIS  52           HA       HIS  52  -0.423 -11.956   3.486
  390   1HB   HIS  52          2HB       HIS  52  -1.205 -13.207   1.302
  391   2HB   HIS  52          1HB       HIS  52  -1.418 -11.571   0.692
  392    HD1  HIS  52           1HD      HIS  52   1.041 -10.183   1.807
  393    HD2  HIS  52           2HD      HIS  52   1.122 -13.996   0.158
  394    HE1  HIS  52           1HE      HIS  52   3.421 -10.552   1.086
  395    HE2  HIS  52           2HE      HIS  52   3.429 -12.836   0.019
  396    HA   PRO  53           HA       PRO  53  -1.663  -7.652   3.790
  397   1HB   PRO  53          2HB       PRO  53   0.645  -6.690   4.766
  398   2HB   PRO  53          1HB       PRO  53  -0.448  -7.665   5.756
  399   1HG   PRO  53          2HG       PRO  53   2.059  -8.479   4.338
  400   2HG   PRO  53          1HG       PRO  53   1.503  -8.911   5.965
  401   1HD   PRO  53          2HD       PRO  53   1.233 -10.542   3.782
  402   2HD   PRO  53          1HD       PRO  53   0.157 -10.594   5.190
  403    H    ILE  54           H        ILE  54  -1.650  -6.092   2.303
  404    HA   ILE  54           HA       ILE  54   0.722  -5.650   0.641
  405    HB   ILE  54           HB       ILE  54  -1.985  -5.758  -0.658
  406   1HG1  ILE  54          2HG1      ILE  54  -1.508  -7.985   0.342
  407   2HG1  ILE  54          1HG1      ILE  54  -1.560  -8.010  -1.417
  408   1HG2  ILE  54          1HG2      ILE  54  -0.735  -4.806  -2.247
  409   2HG2  ILE  54          2HG2      ILE  54  -0.122  -6.436  -2.522
  410   3HG2  ILE  54          3HG2      ILE  54   0.778  -5.316  -1.501
  411   1HD1  ILE  54          1HD1      ILE  54   0.376  -9.142   0.091
  412   2HD1  ILE  54          2HD1      ILE  54   1.103  -7.580  -0.289
  413   3HD1  ILE  54          3HD1      ILE  54   0.571  -8.645  -1.590
  414    H    VAL  55           H        VAL  55   0.569  -3.595  -0.584
  415    HA   VAL  55           HA       VAL  55  -1.357  -1.679   0.519
  416    HB   VAL  55           HB       VAL  55   1.601  -1.088   0.332
  417   1HG1  VAL  55          1HG1      VAL  55   0.269   0.883   0.007
  418   2HG1  VAL  55          2HG1      VAL  55   0.967   0.937   1.625
  419   3HG1  VAL  55          3HG1      VAL  55  -0.728   0.495   1.409
  420   1HG2  VAL  55          1HG2      VAL  55   0.831  -0.890   2.991
  421   2HG2  VAL  55          2HG2      VAL  55   1.812  -2.165   2.269
  422   3HG2  VAL  55          3HG2      VAL  55   0.067  -2.375   2.425
  423    H    VAL  56           H        VAL  56  -1.752   0.149  -0.820
  424    HA   VAL  56           HA       VAL  56  -0.692  -0.133  -3.555
  425    HB   VAL  56           HB       VAL  56  -3.407   0.993  -2.956
  426   1HG1  VAL  56          1HG1      VAL  56  -2.120  -0.121  -5.441
  427   2HG1  VAL  56          2HG1      VAL  56  -2.529   1.564  -5.119
  428   3HG1  VAL  56          3HG1      VAL  56  -3.811   0.370  -5.322
  429   1HG2  VAL  56          1HG2      VAL  56  -3.922  -1.471  -4.001
  430   2HG2  VAL  56          2HG2      VAL  56  -4.015  -1.062  -2.288
  431   3HG2  VAL  56          3HG2      VAL  56  -2.554  -1.807  -2.939
  432    H    VAL  57           H        VAL  57  -0.620   1.848  -4.829
  433    HA   VAL  57           HA       VAL  57  -0.770   4.366  -3.382
  434    HB   VAL  57           HB       VAL  57   1.596   4.901  -4.378
  435   1HG1  VAL  57          1HG1      VAL  57   1.072   3.359  -1.849
  436   2HG1  VAL  57          2HG1      VAL  57   1.167   5.108  -2.055
  437   3HG1  VAL  57          3HG1      VAL  57   2.620   4.121  -2.216
  438   1HG2  VAL  57          1HG2      VAL  57   2.021   2.867  -5.538
  439   2HG2  VAL  57          2HG2      VAL  57   1.662   1.903  -4.106
  440   3HG2  VAL  57          3HG2      VAL  57   3.107   2.914  -4.150
  441    H    GLN  58           H        GLN  58   0.199   6.150  -4.981
  442    HA   GLN  58           HA       GLN  58   0.115   5.850  -7.732
  443   1HB   GLN  58          2HB       GLN  58  -2.190   5.175  -7.557
  444   2HB   GLN  58          1HB       GLN  58  -2.568   6.554  -6.534
  445   1HG   GLN  58          2HG       GLN  58  -3.031   7.800  -8.300
  446   2HG   GLN  58          1HG       GLN  58  -1.447   7.470  -9.001
  447   1HE2  GLN  58          1HE2      GLN  58  -4.518   7.454  -9.777
  448   2HE2  GLN  58          2HE2      GLN  58  -4.601   6.096 -10.841
  449    HA   PRO  59           HA       PRO  59   1.468   9.908  -5.714
  450   1HB   PRO  59          2HB       PRO  59   3.586   9.394  -7.748
  451   2HB   PRO  59          1HB       PRO  59   3.737  10.004  -6.096
  452   1HG   PRO  59          2HG       PRO  59   4.401   7.494  -6.677
  453   2HG   PRO  59          1HG       PRO  59   3.575   7.888  -5.158
  454   1HD   PRO  59          2HD       PRO  59   2.489   6.632  -7.638
  455   2HD   PRO  59          1HD       PRO  59   2.078   6.319  -5.940
  456    H    ASP  60           H        ASP  60  -0.273  10.993  -6.689
  457    HA   ASP  60           HA       ASP  60   0.408  12.425  -9.083
  458   1HB   ASP  60          2HB       ASP  60  -1.009  10.070  -9.451
  459   2HB   ASP  60          1HB       ASP  60  -2.259  11.310  -9.465
  460    H    ALA  61           H        ALA  61  -2.161  11.608  -6.796
  461    HA   ALA  61           HA       ALA  61  -2.935  14.452  -6.761
  462   1HB   ALA  61          1HB       ALA  61  -4.861  13.449  -7.490
  463   2HB   ALA  61          2HB       ALA  61  -5.115  13.392  -5.746
  464   3HB   ALA  61          3HB       ALA  61  -4.551  11.957  -6.602
  465    H    TRP  62           H        TRP  62  -0.788  13.475  -5.214
  466    HA   TRP  62           HA       TRP  62  -1.784  13.073  -2.519
  467   1HB   TRP  62          2HB       TRP  62   0.666  12.555  -3.909
  468   2HB   TRP  62          1HB       TRP  62   1.015  13.554  -2.501
  469    HD1  TRP  62           HD       TRP  62  -0.086  10.059  -3.492
  470    HE1  TRP  62           1HE      TRP  62  -0.107   8.560  -1.400
  471    HE3  TRP  62           3HE      TRP  62   0.637  13.642   0.085
  472    HZ2  TRP  62           2HZ      TRP  62   0.148   8.857   1.396
  473    HZ3  TRP  62           3HZ      TRP  62   0.736  12.950   2.444
  474    HH2  TRP  62           HH       TRP  62   0.496  10.606   3.085
  475    H    THR  63           H        THR  63  -0.445  15.624  -4.485
  476    HA   THR  63           HA       THR  63  -0.503  17.890  -4.189
  477    HB   THR  63           HB       THR  63  -1.403  17.564  -1.344
  478    HG1  THR  63           1HG      THR  63  -3.145  16.645  -2.013
  479   1HG2  THR  63          1HG2      THR  63  -2.407  19.633  -1.561
  480   2HG2  THR  63          2HG2      THR  63  -2.414  19.557  -3.323
  481   3HG2  THR  63          3HG2      THR  63  -0.901  19.827  -2.458
  482    H    GLU  64           H        GLU  64   1.348  15.714  -2.500
  483    HA   GLU  64           HA       GLU  64   3.300  15.814  -1.335
  484   1HB   GLU  64          2HB       GLU  64   3.611  17.241  -3.603
  485   2HB   GLU  64          1HB       GLU  64   3.972  18.488  -2.418
  486   1HG   GLU  64          2HG       GLU  64   5.419  16.318  -1.525
  487   2HG   GLU  64          1HG       GLU  64   5.559  16.219  -3.279
  488    H    ASP  65           H        ASP  65   2.381  16.045   0.734
  489    HA   ASP  65           HA       ASP  65   2.875  18.670   1.934
  490   1HB   ASP  65          2HB       ASP  65   0.333  17.066   2.268
  491   2HB   ASP  65          1HB       ASP  65   0.777  18.435   3.283
  492    H    ASN  66           H        ASN  66   1.814  15.358   2.728
  493    HA   ASN  66           HA       ASN  66   3.173  15.443   5.269
  494   1HB   ASN  66          2HB       ASN  66   1.001  14.075   4.388
  495   2HB   ASN  66          1HB       ASN  66   2.243  12.836   4.235
  496   1HD2  ASN  66          1HD2      ASN  66  -0.080  13.218   6.086
  497   2HD2  ASN  66          2HD2      ASN  66   0.593  13.044   7.668
  498    H    GLY  67           H        GLY  67   3.799  14.227   2.062
  499   1HA   GLY  67          2HA       GLY  67   6.070  13.904   1.342
  500   2HA   GLY  67          1HA       GLY  67   6.472  13.398   2.976
  501    H    PHE  68           H        PHE  68   5.902  12.337  -0.109
  502    HA   PHE  68           HA       PHE  68   4.738   9.782   0.601
  503   1HB   PHE  68          2HB       PHE  68   4.206  10.972  -1.544
  504   2HB   PHE  68          1HB       PHE  68   5.855  10.648  -2.069
  505    HD1  PHE  68           1HD      PHE  68   2.589   9.165  -1.321
  506    HD2  PHE  68           2HD      PHE  68   6.538   8.447  -2.737
  507    HE1  PHE  68           1HE      PHE  68   1.881   6.966  -2.168
  508    HE2  PHE  68           2HE      PHE  68   5.837   6.248  -3.587
  509    HZ   PHE  68           HZ       PHE  68   3.507   5.504  -3.302
  510    H    HIS  69           H        HIS  69   7.777  11.031   0.868
  511    HA   HIS  69           HA       HIS  69   9.245   8.710  -0.043
  512   1HB   HIS  69          2HB       HIS  69  10.050  11.273   1.326
  513   2HB   HIS  69          1HB       HIS  69  11.193   9.963   1.043
  514    HD1  HIS  69           1HD      HIS  69  12.014  12.400  -0.310
  515    HD2  HIS  69           2HD      HIS  69   9.222   9.854  -2.039
  516    HE1  HIS  69           1HE      HIS  69  12.065  12.918  -2.770
  517    HE2  HIS  69           2HE      HIS  69  10.431  11.304  -3.807
  518    H    ALA  70           H        ALA  70   7.568   7.612   1.595
  519    HA   ALA  70           HA       ALA  70   9.107   6.394   3.587
  520   1HB   ALA  70          1HB       ALA  70   7.553   8.765   4.457
  521   2HB   ALA  70          2HB       ALA  70   9.068   8.112   5.078
  522   3HB   ALA  70          3HB       ALA  70   7.538   7.349   5.509
  523    H    ILE  71           H        ILE  71   7.331   5.634   1.523
  524    HA   ILE  71           HA       ILE  71   4.784   4.894   2.541
  525    HB   ILE  71           HB       ILE  71   6.228   3.565   0.254
  526   1HG1  ILE  71          2HG1      ILE  71   6.322   5.963  -0.120
  527   2HG1  ILE  71          1HG1      ILE  71   5.130   5.249  -1.200
  528   1HG2  ILE  71          1HG2      ILE  71   4.166   2.826  -0.462
  529   2HG2  ILE  71          2HG2      ILE  71   3.291   4.070   0.428
  530   3HG2  ILE  71          3HG2      ILE  71   4.006   2.706   1.289
  531   1HD1  ILE  71          1HD1      ILE  71   3.354   6.194  -0.073
  532   2HD1  ILE  71          2HD1      ILE  71   4.585   7.452   0.030
  533   3HD1  ILE  71          3HD1      ILE  71   4.277   6.406   1.415
  534    H    GLY  72           H        GLY  72   7.469   2.752   1.562
  535   1HA   GLY  72          2HA       GLY  72   6.476   0.528   3.002
  536   2HA   GLY  72          1HA       GLY  72   8.096   0.683   2.338
  537    H    GLN  73           H        GLN  73   8.449   3.218   3.945
  538    HA   GLN  73           HA       GLN  73   9.658   1.995   6.213
  539   1HB   GLN  73          2HB       GLN  73   9.622   4.609   4.960
  540   2HB   GLN  73          1HB       GLN  73   9.525   4.745   6.710
  541   1HG   GLN  73          2HG       GLN  73  11.501   2.914   6.447
  542   2HG   GLN  73          1HG       GLN  73  11.745   3.890   4.998
  543   1HE2  GLN  73          1HE2      GLN  73  11.984   3.748   8.417
  544   2HE2  GLN  73          2HE2      GLN  73  12.710   5.297   8.655
  545    H    MET  74           H        MET  74   6.591   3.523   5.616
  546    HA   MET  74           HA       MET  74   5.979   3.667   8.466
  547   1HB   MET  74          2HB       MET  74   4.663   4.694   5.978
  548   2HB   MET  74          1HB       MET  74   3.728   4.541   7.460
  549   1HG   MET  74          2HG       MET  74   5.862   5.849   8.413
  550   2HG   MET  74          1HG       MET  74   5.870   6.436   6.751
  551   1HE   MET  74          1HE       MET  74   3.265   8.679   6.224
  552   2HE   MET  74          2HE       MET  74   2.389   7.151   6.140
  553   3HE   MET  74          3HE       MET  74   4.054   7.247   5.564
  554    H    CYS  75           H        CYS  75   4.966   1.958   5.547
  555    HA   CYS  75           HA       CYS  75   3.126   0.320   7.131
  556   1HB   CYS  75          2HB       CYS  75   2.236  -0.464   5.021
  557   2HB   CYS  75          1HB       CYS  75   2.316   1.293   4.995
  558    HG   CYS  75           HG       CYS  75   4.622  -0.209   3.609
  559    H    GLU  76           H        GLU  76   3.281  -1.926   7.228
  560    HA   GLU  76           HA       GLU  76   5.979  -2.958   6.727
  561   1HB   GLU  76          2HB       GLU  76   4.525  -3.082   8.989
  562   2HB   GLU  76          1HB       GLU  76   4.004  -4.580   8.232
  563   1HG   GLU  76          2HG       GLU  76   5.846  -5.579   8.918
  564   2HG   GLU  76          1HG       GLU  76   6.822  -4.432   8.000
  565    H    ALA  77           H        ALA  77   4.260  -2.670   4.511
  566    HA   ALA  77           HA       ALA  77   4.150  -5.447   3.642
  567   1HB   ALA  77          1HB       ALA  77   1.787  -4.084   2.693
  568   2HB   ALA  77          2HB       ALA  77   1.825  -4.156   4.454
  569   3HB   ALA  77          3HB       ALA  77   1.940  -5.640   3.508
  570    HA   PRO  78           HA       PRO  78   5.442  -3.828  -0.249
  571   1HB   PRO  78          2HB       PRO  78   4.130  -5.305  -2.077
  572   2HB   PRO  78          1HB       PRO  78   5.363  -6.004  -1.020
  573   1HG   PRO  78          2HG       PRO  78   2.379  -6.083  -0.757
  574   2HG   PRO  78          1HG       PRO  78   3.549  -7.394  -0.537
  575   1HD   PRO  78          2HD       PRO  78   2.470  -6.014   1.537
  576   2HD   PRO  78          1HD       PRO  78   4.099  -6.715   1.590
  577    H    VAL  79           H        VAL  79   4.991  -1.935  -1.176
  578    HA   VAL  79           HA       VAL  79   2.193  -1.150  -1.544
  579    HB   VAL  79           HB       VAL  79   4.595   0.629  -1.915
  580   1HG1  VAL  79          1HG1      VAL  79   1.880   0.991  -2.388
  581   2HG1  VAL  79          2HG1      VAL  79   3.119   2.241  -2.303
  582   3HG1  VAL  79          3HG1      VAL  79   2.186   1.827  -0.866
  583   1HG2  VAL  79          1HG2      VAL  79   3.107   0.835   0.617
  584   2HG2  VAL  79          2HG2      VAL  79   4.833   1.008   0.295
  585   3HG2  VAL  79          3HG2      VAL  79   4.122  -0.598   0.452
  586    H    VAL  80           H        VAL  80   1.300  -0.762  -3.535
  587    HA   VAL  80           HA       VAL  80   3.046  -0.657  -5.876
  588    HB   VAL  80           HB       VAL  80   1.696  -2.366  -7.074
  589   1HG1  VAL  80          1HG1      VAL  80   3.231  -3.209  -4.629
  590   2HG1  VAL  80          2HG1      VAL  80   3.812  -3.073  -6.288
  591   3HG1  VAL  80          3HG1      VAL  80   2.672  -4.345  -5.854
  592   1HG2  VAL  80          1HG2      VAL  80   0.666  -3.199  -4.374
  593   2HG2  VAL  80          2HG2      VAL  80   0.185  -3.796  -5.962
  594   3HG2  VAL  80          3HG2      VAL  80  -0.253  -2.162  -5.465
  595    H    THR  81           H        THR  81   1.899  -0.020  -7.845
  596    HA   THR  81           HA       THR  81  -0.062   1.992  -7.312
  597    HB   THR  81           HB       THR  81   0.131   2.587  -9.592
  598    HG1  THR  81           1HG      THR  81   0.618   1.204 -11.170
  599   1HG2  THR  81          1HG2      THR  81   2.314   2.659  -8.207
  600   2HG2  THR  81          2HG2      THR  81   2.378   2.909  -9.952
  601   3HG2  THR  81          3HG2      THR  81   2.821   1.345  -9.268
  602    H    ARG  82           H        ARG  82  -2.176   2.102  -8.402
  603    HA   ARG  82           HA       ARG  82  -3.794  -0.070  -7.836
  604   1HB   ARG  82          2HB       ARG  82  -5.440   1.055  -9.461
  605   2HB   ARG  82          1HB       ARG  82  -4.922   1.957  -8.045
  606   1HG   ARG  82          2HG       ARG  82  -4.404   3.620  -9.421
  607   2HG   ARG  82          1HG       ARG  82  -3.070   2.625 -10.008
  608   1HD   ARG  82          2HD       ARG  82  -4.379   1.771 -11.792
  609   2HD   ARG  82          1HD       ARG  82  -5.859   2.452 -11.121
  610    HE   ARG  82           HE       ARG  82  -3.901   4.449 -11.719
  611   1HH1  ARG  82          1HH1      ARG  82  -6.408   2.453 -13.103
  612   2HH1  ARG  82          2HH1      ARG  82  -6.729   3.543 -14.408
  613   1HH2  ARG  82          1HH2      ARG  82  -4.322   5.884 -13.437
  614   2HH2  ARG  82          2HH2      ARG  82  -5.544   5.491 -14.600
  615    H    GLU  83           H        GLU  83  -1.812   0.463 -10.616
  616    HA   GLU  83           HA       GLU  83  -3.041  -0.917 -12.631
  617   1HB   GLU  83          2HB       GLU  83  -0.180  -0.635 -11.821
  618   2HB   GLU  83          1HB       GLU  83  -0.580  -1.769 -13.102
  619   1HG   GLU  83          2HG       GLU  83  -1.831   0.839 -13.442
  620   2HG   GLU  83          1HG       GLU  83  -0.069   0.901 -13.418
  621    H    TRP  84           H        TRP  84  -1.400  -2.246  -9.818
  622    HA   TRP  84           HA       TRP  84  -1.439  -4.960 -10.590
  623   1HB   TRP  84          2HB       TRP  84  -0.093  -4.119  -8.709
  624   2HB   TRP  84          1HB       TRP  84  -1.560  -3.743  -7.822
  625    HD1  TRP  84           HD       TRP  84   0.319  -6.840  -9.193
  626    HE1  TRP  84           1HE      TRP  84  -0.253  -8.845  -7.682
  627    HE3  TRP  84           3HE      TRP  84  -3.111  -4.599  -6.134
  628    HZ2  TRP  84           2HZ      TRP  84  -1.939  -9.401  -5.483
  629    HZ3  TRP  84           3HZ      TRP  84  -4.157  -5.937  -4.354
  630    HH2  TRP  84           HH       TRP  84  -3.586  -8.286  -4.036
  631    H    VAL  85           H        VAL  85  -3.532  -3.163  -8.399
  632    HA   VAL  85           HA       VAL  85  -5.457  -5.098  -7.929
  633    HB   VAL  85           HB       VAL  85  -5.903  -2.116  -8.102
  634   1HG1  VAL  85          1HG1      VAL  85  -7.580  -2.974  -6.178
  635   2HG1  VAL  85          2HG1      VAL  85  -7.601  -4.371  -7.255
  636   3HG1  VAL  85          3HG1      VAL  85  -8.046  -2.778  -7.867
  637   1HG2  VAL  85          1HG2      VAL  85  -5.553  -2.202  -5.632
  638   2HG2  VAL  85          2HG2      VAL  85  -4.109  -2.548  -6.584
  639   3HG2  VAL  85          3HG2      VAL  85  -5.000  -3.866  -5.823
  640    H    LEU  86           H        LEU  86  -5.226  -2.783 -10.586
  641    HA   LEU  86           HA       LEU  86  -7.764  -3.521 -11.706
  642   1HB   LEU  86          2HB       LEU  86  -6.225  -1.338 -11.967
  643   2HB   LEU  86          1HB       LEU  86  -5.709  -2.213 -13.397
  644    HG   LEU  86           HG       LEU  86  -8.630  -2.035 -13.039
  645   1HD1  LEU  86          1HD1      LEU  86  -8.544   0.148 -12.468
  646   2HD1  LEU  86          2HD1      LEU  86  -8.283   0.354 -14.200
  647   3HD1  LEU  86          3HD1      LEU  86  -6.909   0.363 -13.094
  648   1HD2  LEU  86          1HD2      LEU  86  -6.651  -1.765 -15.280
  649   2HD2  LEU  86          2HD2      LEU  86  -8.355  -1.359 -15.488
  650   3HD2  LEU  86          3HD2      LEU  86  -7.889  -2.999 -15.039
  651    H    ASP  87           H        ASP  87  -4.375  -4.136 -12.574
  652    HA   ASP  87           HA       ASP  87  -4.870  -5.700 -14.842
  653   1HB   ASP  87          2HB       ASP  87  -2.652  -4.739 -14.169
  654   2HB   ASP  87          1HB       ASP  87  -2.540  -5.992 -12.936
  655    H    SER  88           H        SER  88  -4.758  -6.519 -11.428
  656    HA   SER  88           HA       SER  88  -4.887  -9.351 -11.867
  657   1HB   SER  88          2HB       SER  88  -5.398  -7.737  -9.358
  658   2HB   SER  88          1HB       SER  88  -5.228  -9.491  -9.428
  659    HG   SER  88           HG       SER  88  -3.291  -7.495  -9.720
  660    H    VAL  89           H        VAL  89  -7.214  -6.875 -10.801
  661    HA   VAL  89           HA       VAL  89  -9.393  -8.700 -10.622
  662    HB   VAL  89           HB       VAL  89  -9.436  -5.686 -10.853
  663   1HG1  VAL  89          1HG1      VAL  89 -11.689  -5.866  -9.870
  664   2HG1  VAL  89          2HG1      VAL  89 -11.588  -7.622  -9.999
  665   3HG1  VAL  89          3HG1      VAL  89 -11.587  -6.629 -11.457
  666   1HG2  VAL  89          1HG2      VAL  89 -10.040  -6.938  -8.277
  667   2HG2  VAL  89          2HG2      VAL  89  -9.025  -5.546  -8.653
  668   3HG2  VAL  89          3HG2      VAL  89  -8.381  -7.179  -8.824
  669    H    ALA  90           H        ALA  90  -7.994  -6.866 -13.216
  670    HA   ALA  90           HA       ALA  90 -10.258  -6.877 -14.940
  671   1HB   ALA  90          1HB       ALA  90  -8.680  -6.237 -16.691
  672   2HB   ALA  90          2HB       ALA  90  -7.331  -6.617 -15.621
  673   3HB   ALA  90          3HB       ALA  90  -8.423  -5.291 -15.226
  674    H    LEU  91           H        LEU  91  -7.225  -8.748 -15.102
  675    HA   LEU  91           HA       LEU  91  -8.449 -10.667 -16.892
  676   1HB   LEU  91          2HB       LEU  91  -6.134  -9.928 -17.234
  677   2HB   LEU  91          1HB       LEU  91  -5.691 -10.580 -15.669
  678    HG   LEU  91           HG       LEU  91  -6.583 -12.834 -16.691
  679   1HD1  LEU  91          1HD1      LEU  91  -6.366 -11.024 -19.012
  680   2HD1  LEU  91          2HD1      LEU  91  -7.381 -12.445 -18.767
  681   3HD1  LEU  91          3HD1      LEU  91  -5.684 -12.639 -19.204
  682   1HD2  LEU  91          1HD2      LEU  91  -4.186 -12.936 -17.859
  683   2HD2  LEU  91          2HD2      LEU  91  -4.397 -12.971 -16.108
  684   3HD2  LEU  91          3HD2      LEU  91  -3.972 -11.461 -16.915
  685    H    TYR  92           H        TYR  92  -7.968 -10.313 -13.524
  686    HA   TYR  92           HA       TYR  92  -8.629 -11.602 -11.767
  687   1HB   TYR  92          2HB       TYR  92 -10.114 -12.672 -13.925
  688   2HB   TYR  92          1HB       TYR  92  -9.458 -14.042 -13.036
  689    HD1  TYR  92           1HD      TYR  92  -9.474 -12.683 -10.282
  690    HD2  TYR  92           2HD      TYR  92 -12.402 -12.973 -13.358
  691    HE1  TYR  92           1HE      TYR  92 -11.256 -12.443  -8.603
  692    HE2  TYR  92           2HE      TYR  92 -14.188 -12.732 -11.687
  693    HH   TYR  92           HH       TYR  92 -14.359 -13.237  -9.085
  694    H    GLN  93           H        GLN  93  -6.313 -11.672 -11.416
  695    HA   GLN  93           HA       GLN  93  -5.380 -14.253 -10.851
  696   1HB   GLN  93          2HB       GLN  93  -5.139 -14.091 -13.428
  697   2HB   GLN  93          1HB       GLN  93  -3.783 -13.027 -13.081
  698   1HG   GLN  93          2HG       GLN  93  -2.559 -14.881 -13.048
  699   2HG   GLN  93          1HG       GLN  93  -3.268 -15.163 -11.459
  700   1HE2  GLN  93          1HE2      GLN  93  -5.186 -16.493 -11.357
  701   2HE2  GLN  93          2HE2      GLN  93  -5.415 -17.746 -12.524
  702    H    CYS  94           H        CYS  94  -3.776 -14.145  -9.370
  703    HA   CYS  94           HA       CYS  94  -3.088 -11.679  -8.226
  704   1HB   CYS  94          2HB       CYS  94  -3.068 -13.905  -7.063
  705   2HB   CYS  94          1HB       CYS  94  -1.576 -14.280  -7.918
  706    HG   CYS  94           HG       CYS  94  -1.501 -13.063  -5.363
  707    H    GLN  95           H        GLN  95  -2.272 -10.370  -9.911
  708    HA   GLN  95           HA       GLN  95  -0.025 -11.075 -11.485
  709   1HB   GLN  95          2HB       GLN  95  -1.052  -8.319 -10.781
  710   2HB   GLN  95          1HB       GLN  95   0.049  -8.704 -12.097
  711   1HG   GLN  95          2HG       GLN  95  -2.769  -9.731 -11.863
  712   2HG   GLN  95          1HG       GLN  95  -2.278  -8.340 -12.828
  713   1HE2  GLN  95          1HE2      GLN  95  -0.126  -9.037 -14.131
  714   2HE2  GLN  95          2HE2      GLN  95  -0.370 -10.439 -15.110
  715    H    GLU  96           H        GLU  96   2.071  -9.904 -11.432
  716    HA   GLU  96           HA       GLU  96   3.261 -10.171  -8.846
  717   1HB   GLU  96          2HB       GLU  96   5.324  -9.314 -10.061
  718   2HB   GLU  96          1HB       GLU  96   4.624 -10.808 -10.668
  719   1HG   GLU  96          2HG       GLU  96   3.472  -8.543 -12.009
  720   2HG   GLU  96          1HG       GLU  96   5.231  -8.499 -12.111
  721    H    LEU  97           H        LEU  97   3.987  -8.620  -7.455
  722    HA   LEU  97           HA       LEU  97   2.801  -5.999  -7.727
  723   1HB   LEU  97          2HB       LEU  97   4.219  -7.485  -5.559
  724   2HB   LEU  97          1HB       LEU  97   4.097  -5.739  -5.449
  725    HG   LEU  97           HG       LEU  97   1.512  -6.376  -5.964
  726   1HD1  LEU  97          1HD1      LEU  97   0.863  -8.398  -5.211
  727   2HD1  LEU  97          2HD1      LEU  97   2.102  -8.453  -3.958
  728   3HD1  LEU  97          3HD1      LEU  97   2.516  -8.848  -5.628
  729   1HD2  LEU  97          1HD2      LEU  97   2.865  -5.161  -3.984
  730   2HD2  LEU  97          2HD2      LEU  97   2.287  -6.589  -3.126
  731   3HD2  LEU  97          3HD2      LEU  97   1.137  -5.509  -3.914
  732    H    ASP  98           H        ASP  98   5.952  -7.454  -8.006
  733    HA   ASP  98           HA       ASP  98   7.582  -5.207  -7.734
  734   1HB   ASP  98          2HB       ASP  98   9.158  -6.490  -9.265
  735   2HB   ASP  98          1HB       ASP  98   8.634  -7.331  -7.808
  736    H    THR  99           H        THR  99   5.557  -6.235 -10.374
  737    HA   THR  99           HA       THR  99   6.739  -4.579 -12.366
  738    HB   THR  99           HB       THR  99   4.338  -4.966 -13.410
  739    HG1  THR  99           1HG      THR  99   3.207  -6.543 -12.491
  740   1HG2  THR  99          1HG2      THR  99   5.054  -7.399 -13.913
  741   2HG2  THR  99          2HG2      THR  99   6.540  -6.948 -13.078
  742   3HG2  THR  99          3HG2      THR  99   6.031  -6.062 -14.515
  743    H    TYR 100           H        TYR 100   4.638  -3.934  -9.743
  744    HA   TYR 100           HA       TYR 100   4.244  -1.212 -10.757
  745   1HB   TYR 100          2HB       TYR 100   2.038  -2.666  -9.309
  746   2HB   TYR 100          1HB       TYR 100   1.945  -1.148 -10.195
  747    HD1  TYR 100           1HD      TYR 100   1.515  -4.684 -10.362
  748    HD2  TYR 100           2HD      TYR 100   2.299  -1.242 -12.736
  749    HE1  TYR 100           1HE      TYR 100   0.793  -5.911 -12.366
  750    HE2  TYR 100           2HE      TYR 100   1.578  -2.459 -14.748
  751    HH   TYR 100           HH       TYR 100   1.348  -4.763 -15.523
  752    H    LEU 101           H        LEU 101   5.967  -2.606  -8.700
  753    HA   LEU 101           HA       LEU 101   5.019  -1.512  -6.188
  754   1HB   LEU 101          2HB       LEU 101   6.756  -3.591  -6.956
  755   2HB   LEU 101          1HB       LEU 101   7.749  -2.418  -6.117
  756    HG   LEU 101           HG       LEU 101   5.221  -3.123  -4.771
  757   1HD1  LEU 101          1HD1      LEU 101   5.654  -5.288  -4.256
  758   2HD1  LEU 101          2HD1      LEU 101   7.399  -5.092  -4.411
  759   3HD1  LEU 101          3HD1      LEU 101   6.398  -5.248  -5.855
  760   1HD2  LEU 101          1HD2      LEU 101   6.863  -3.247  -2.841
  761   2HD2  LEU 101          2HD2      LEU 101   6.669  -1.674  -3.615
  762   3HD2  LEU 101          3HD2      LEU 101   8.081  -2.667  -3.977
  763    H    ILE 102           H        ILE 102   5.430   0.489  -5.535
  764    HA   ILE 102           HA       ILE 102   7.197   2.202  -7.011
  765    HB   ILE 102           HB       ILE 102   5.802   2.805  -4.404
  766   1HG1  ILE 102          2HG1      ILE 102   4.193   2.040  -6.104
  767   2HG1  ILE 102          1HG1      ILE 102   3.996   3.755  -5.757
  768   1HG2  ILE 102          1HG2      ILE 102   7.383   4.369  -6.336
  769   2HG2  ILE 102          2HG2      ILE 102   7.134   4.612  -4.607
  770   3HG2  ILE 102          3HG2      ILE 102   5.901   5.132  -5.757
  771   1HD1  ILE 102          1HD1      ILE 102   4.162   4.176  -7.916
  772   2HD1  ILE 102          2HD1      ILE 102   4.469   2.471  -8.249
  773   3HD1  ILE 102          3HD1      ILE 102   5.813   3.558  -7.897
  774    HA   PRO 103           HA       PRO 103  10.760   0.970  -4.523
  775   1HB   PRO 103          2HB       PRO 103  12.069   3.128  -6.058
  776   2HB   PRO 103          1HB       PRO 103  12.511   1.426  -5.912
  777   1HG   PRO 103          2HG       PRO 103  11.453   2.409  -8.166
  778   2HG   PRO 103          1HG       PRO 103  11.078   0.771  -7.600
  779   1HD   PRO 103          2HD       PRO 103   9.434   3.264  -7.425
  780   2HD   PRO 103          1HD       PRO 103   8.923   1.597  -7.770
  781    H    GLN 104           H        GLN 104  12.730   2.855  -3.935
  782    HA   GLN 104           HA       GLN 104  11.699   5.270  -2.884
  783   1HB   GLN 104          2HB       GLN 104  11.673   2.872  -1.139
  784   2HB   GLN 104          1HB       GLN 104  12.294   4.352  -0.422
  785   1HG   GLN 104          2HG       GLN 104  10.232   5.045  -0.059
  786   2HG   GLN 104          1HG       GLN 104   9.908   5.007  -1.791
  787   1HE2  GLN 104          1HE2      GLN 104  10.225   2.733   0.919
  788   2HE2  GLN 104          2HE2      GLN 104   8.858   1.768   0.492
  789    H    ILE 105           H        ILE 105  14.116   2.733  -2.268
  790    HA   ILE 105           HA       ILE 105  16.143   4.601  -1.498
  791    HB   ILE 105           HB       ILE 105  17.676   2.606  -1.719
  792   1HG1  ILE 105          2HG1      ILE 105  15.409   0.742  -1.761
  793   2HG1  ILE 105          1HG1      ILE 105  15.652   1.586  -3.287
  794   1HG2  ILE 105          1HG2      ILE 105  16.817   3.158   0.423
  795   2HG2  ILE 105          2HG2      ILE 105  16.624   1.416   0.230
  796   3HG2  ILE 105          3HG2      ILE 105  15.233   2.484   0.036
  797   1HD1  ILE 105          1HD1      ILE 105  17.457  -0.314  -1.869
  798   2HD1  ILE 105          2HD1      ILE 105  18.125   0.872  -2.991
  799   3HD1  ILE 105          3HD1      ILE 105  16.935  -0.301  -3.553
  800    HA   PRO 106           HA       PRO 106  17.045   5.901  -5.726
  801   1HB   PRO 106          2HB       PRO 106  19.489   6.861  -4.308
  802   2HB   PRO 106          1HB       PRO 106  18.430   7.719  -5.434
  803   1HG   PRO 106          2HG       PRO 106  18.299   8.204  -2.823
  804   2HG   PRO 106          1HG       PRO 106  16.827   8.145  -3.811
  805   1HD   PRO 106          2HD       PRO 106  17.907   6.129  -1.895
  806   2HD   PRO 106          1HD       PRO 106  16.223   6.561  -2.251
  807    H    HIS 107           H        HIS 107  19.446   4.414  -3.571
  808    HA   HIS 107           HA       HIS 107  20.473   2.915  -5.888
  809   1HB   HIS 107          2HB       HIS 107  22.006   4.771  -5.013
  810   2HB   HIS 107          1HB       HIS 107  22.210   3.770  -3.578
  811    HD1  HIS 107           1HD      HIS 107  22.281   2.853  -7.276
  812    HD2  HIS 107           2HD      HIS 107  24.624   2.593  -3.855
  813    HE1  HIS 107           1HE      HIS 107  24.335   1.579  -7.965
  814    HE2  HIS 107           2HE      HIS 107  25.778   1.508  -5.900
  815    H    SER 108           H        SER 108  20.958   0.770  -5.563
  816    HA   SER 108           HA       SER 108  20.430  -0.319  -2.881
  817   1HB   SER 108          2HB       SER 108  18.558  -0.598  -4.688
  818   2HB   SER 108          1HB       SER 108  19.627  -1.841  -5.341
  819    HG   SER 108           HG       SER 108  18.846  -1.782  -2.622
  820    H    HIS 109           H        HIS 109  22.469  -0.836  -2.294
  821    HA   HIS 109           HA       HIS 109  24.435  -1.860  -4.060
  822   1HB   HIS 109          2HB       HIS 109  24.389  -0.892  -1.445
  823   2HB   HIS 109          1HB       HIS 109  24.881  -2.574  -1.277
  824    HD1  HIS 109           1HD      HIS 109  27.219  -3.196  -2.044
  825    HD2  HIS 109           2HD      HIS 109  26.188   0.726  -2.953
  826    HE1  HIS 109           1HE      HIS 109  29.349  -2.100  -2.807
  827    HE2  HIS 109           2HE      HIS 109  28.719   0.296  -3.265
  828    H    TYR 110           H        TYR 110  24.091  -3.738  -5.079
  829    HA   TYR 110           HA       TYR 110  23.663  -6.118  -3.432
  830   1HB   TYR 110          2HB       TYR 110  21.497  -5.208  -4.567
  831   2HB   TYR 110          1HB       TYR 110  22.195  -5.872  -6.039
  832    HD1  TYR 110           1HD      TYR 110  21.505  -6.902  -2.511
  833    HD2  TYR 110           2HD      TYR 110  21.639  -8.040  -6.608
  834    HE1  TYR 110           1HE      TYR 110  20.623  -9.118  -1.918
  835    HE2  TYR 110           2HE      TYR 110  20.756 -10.259  -6.027
  836    HH   TYR 110           HH       TYR 110  20.786 -11.738  -3.839
  Start of MODEL   10
    1   1H    GLY   1          1HT       GLY   1 -22.568 -27.378  -5.390
    2   2H    GLY   1          2HT       GLY   1 -21.101 -26.689  -5.874
    3   3H    GLY   1          3HT       GLY   1 -22.268 -27.088  -7.030
    4   1HA   GLY   1          1HA       GLY   1 -23.781 -25.433  -6.106
    5   2HA   GLY   1          2HA       GLY   1 -22.545 -25.007  -4.931
    6    H    SER   2           H        SER   2 -22.452 -22.866  -5.650
    7    HA   SER   2           HA       SER   2 -21.155 -22.527  -8.275
    8   1HB   SER   2          2HB       SER   2 -23.401 -21.033  -7.014
    9   2HB   SER   2          1HB       SER   2 -22.228 -20.100  -7.944
   10    HG   SER   2           HG       SER   2 -23.623 -20.722  -9.461
   11    H    GLN   3           H        GLN   3 -19.077 -22.592  -7.403
   12    HA   GLN   3           HA       GLN   3 -18.302 -20.922  -5.210
   13   1HB   GLN   3          2HB       GLN   3 -16.612 -22.391  -7.243
   14   2HB   GLN   3          1HB       GLN   3 -16.006 -21.638  -5.774
   15   1HG   GLN   3          2HG       GLN   3 -16.206 -23.727  -4.973
   16   2HG   GLN   3          1HG       GLN   3 -17.874 -23.223  -4.706
   17   1HE2  GLN   3          1HE2      GLN   3 -19.482 -24.215  -5.790
   18   2HE2  GLN   3          2HE2      GLN   3 -19.249 -25.497  -6.924
   19    H    ASP   4           H        ASP   4 -16.544 -19.294  -5.410
   20    HA   ASP   4           HA       ASP   4 -17.030 -17.601  -7.765
   21   1HB   ASP   4          2HB       ASP   4 -16.484 -17.032  -4.894
   22   2HB   ASP   4          1HB       ASP   4 -15.852 -15.893  -6.080
   23    H    ARG   5           H        ARG   5 -14.547 -19.127  -5.830
   24    HA   ARG   5           HA       ARG   5 -12.320 -19.448  -6.149
   25   1HB   ARG   5          2HB       ARG   5 -13.559 -19.642  -8.708
   26   2HB   ARG   5          1HB       ARG   5 -12.015 -18.829  -8.919
   27   1HG   ARG   5          2HG       ARG   5 -11.238 -20.843  -7.332
   28   2HG   ARG   5          1HG       ARG   5 -12.607 -21.611  -8.138
   29   1HD   ARG   5          2HD       ARG   5 -11.519 -21.756 -10.091
   30   2HD   ARG   5          1HD       ARG   5 -10.872 -20.122  -9.954
   31    HE   ARG   5           HE       ARG   5  -9.394 -21.508  -8.171
   32   1HH1  ARG   5          1HH1      ARG   5 -10.170 -22.043 -11.531
   33   2HH1  ARG   5          2HH1      ARG   5  -8.686 -22.865 -11.873
   34   1HH2  ARG   5          1HH2      ARG   5  -7.439 -22.588  -8.620
   35   2HH2  ARG   5          2HH2      ARG   5  -7.135 -23.175 -10.222
   36    H    LYS   6           H        LYS   6 -11.867 -17.552  -4.898
   37    HA   LYS   6           HA       LYS   6 -11.418 -15.035  -6.220
   38   1HB   LYS   6          2HB       LYS   6 -10.497 -15.792  -3.450
   39   2HB   LYS   6          1HB       LYS   6 -10.837 -14.190  -4.077
   40   1HG   LYS   6          2HG       LYS   6 -12.985 -16.263  -3.892
   41   2HG   LYS   6          1HG       LYS   6 -12.545 -15.259  -2.508
   42   1HD   LYS   6          2HD       LYS   6 -12.788 -13.443  -4.578
   43   2HD   LYS   6          1HD       LYS   6 -14.094 -14.591  -4.878
   44   1HE   LYS   6          2HE       LYS   6 -13.673 -13.544  -2.117
   45   2HE   LYS   6          1HE       LYS   6 -14.458 -12.516  -3.314
   46   1HZ   LYS   6          1HZ       LYS   6 -16.103 -13.740  -2.092
   47   2HZ   LYS   6          2HZ       LYS   6 -15.352 -15.213  -2.452
   48   3HZ   LYS   6          3HZ       LYS   6 -16.074 -14.309  -3.686
   49    H    ILE   7           H        ILE   7  -9.523 -14.157  -6.881
   50    HA   ILE   7           HA       ILE   7  -7.306 -15.942  -7.291
   51    HB   ILE   7           HB       ILE   7  -6.248 -14.012  -8.431
   52   1HG1  ILE   7          2HG1      ILE   7  -8.452 -12.269  -8.702
   53   2HG1  ILE   7          1HG1      ILE   7  -8.280 -12.573  -6.978
   54   1HG2  ILE   7          1HG2      ILE   7  -7.812 -15.629  -9.542
   55   2HG2  ILE   7          2HG2      ILE   7  -7.664 -14.061 -10.333
   56   3HG2  ILE   7          3HG2      ILE   7  -9.082 -14.420  -9.349
   57   1HD1  ILE   7          1HD1      ILE   7  -6.638 -10.990  -8.768
   58   2HD1  ILE   7          2HD1      ILE   7  -5.697 -12.113  -7.785
   59   3HD1  ILE   7          3HD1      ILE   7  -6.771 -10.948  -7.011
   60    H    PHE   8           H        PHE   8  -8.137 -13.557  -4.952
   61    HA   PHE   8           HA       PHE   8  -5.369 -13.242  -4.081
   62   1HB   PHE   8          2HB       PHE   8  -7.952 -11.896  -3.317
   63   2HB   PHE   8          1HB       PHE   8  -6.491 -11.689  -2.365
   64    HD1  PHE   8           1HD      PHE   8  -8.112  -9.560  -3.876
   65    HD2  PHE   8           2HD      PHE   8  -4.634 -11.795  -4.890
   66    HE1  PHE   8           1HE      PHE   8  -7.399  -7.761  -5.391
   67    HE2  PHE   8           2HE      PHE   8  -3.918 -10.000  -6.405
   68    HZ   PHE   8           HZ       PHE   8  -5.300  -7.979  -6.657
   69    H    ARG   9           H        ARG   9  -8.393 -14.709  -3.071
   70    HA   ARG   9           HA       ARG   9  -8.949 -15.809  -1.095
   71   1HB   ARG   9          2HB       ARG   9  -7.793 -18.005  -1.080
   72   2HB   ARG   9          1HB       ARG   9  -8.373 -17.533  -2.671
   73   1HG   ARG   9          2HG       ARG   9  -6.345 -17.813  -3.501
   74   2HG   ARG   9          1HG       ARG   9  -5.712 -16.589  -2.402
   75   1HD   ARG   9          2HD       ARG   9  -5.469 -18.327  -0.663
   76   2HD   ARG   9          1HD       ARG   9  -6.013 -19.533  -1.828
   77    HE   ARG   9           HE       ARG   9  -3.928 -18.398  -3.095
   78   1HH1  ARG   9          1HH1      ARG   9  -4.289 -19.710   0.120
   79   2HH1  ARG   9          2HH1      ARG   9  -2.631 -20.195   0.242
   80   1HH2  ARG   9          1HH2      ARG   9  -1.749 -19.036  -2.935
   81   2HH2  ARG   9          2HH2      ARG   9  -1.190 -19.814  -1.493
   82    H    GLY  10           H        GLY  10  -8.297 -14.173   0.431
   83   1HA   GLY  10          2HA       GLY  10  -7.403 -13.903   2.584
   84   2HA   GLY  10          1HA       GLY  10  -6.265 -15.198   2.246
   85    H    LEU  11           H        LEU  11  -7.035 -11.878   1.322
   86    HA   LEU  11           HA       LEU  11  -4.191 -11.222   1.408
   87   1HB   LEU  11          2HB       LEU  11  -5.194 -11.840  -0.967
   88   2HB   LEU  11          1HB       LEU  11  -5.763 -10.184  -0.900
   89    HG   LEU  11           HG       LEU  11  -2.871 -10.838  -0.442
   90   1HD1  LEU  11          1HD1      LEU  11  -3.844 -10.037  -3.137
   91   2HD1  LEU  11          2HD1      LEU  11  -3.927 -11.735  -2.668
   92   3HD1  LEU  11          3HD1      LEU  11  -2.376 -10.899  -2.676
   93   1HD2  LEU  11          1HD2      LEU  11  -2.881  -8.641  -0.059
   94   2HD2  LEU  11          2HD2      LEU  11  -4.515  -8.456  -0.696
   95   3HD2  LEU  11          3HD2      LEU  11  -3.135  -8.447  -1.793
   96    H    GLU  12           H        GLU  12  -3.768  -8.973   1.675
   97    HA   GLU  12           HA       GLU  12  -6.121  -7.341   2.363
   98   1HB   GLU  12          2HB       GLU  12  -3.759  -8.034   4.016
   99   2HB   GLU  12          1HB       GLU  12  -4.307  -6.365   4.095
  100   1HG   GLU  12          2HG       GLU  12  -6.640  -7.415   4.500
  101   2HG   GLU  12          1HG       GLU  12  -5.722  -8.860   4.920
  102    H    ILE  13           H        ILE  13  -6.187  -5.557   1.165
  103    HA   ILE  13           HA       ILE  13  -3.641  -4.305   0.376
  104    HB   ILE  13           HB       ILE  13  -6.085  -4.461  -1.386
  105   1HG1  ILE  13          2HG1      ILE  13  -3.729  -5.788  -2.415
  106   2HG1  ILE  13          1HG1      ILE  13  -4.204  -6.480  -0.868
  107   1HG2  ILE  13          1HG2      ILE  13  -3.288  -3.568  -2.060
  108   2HG2  ILE  13          2HG2      ILE  13  -4.605  -2.472  -1.642
  109   3HG2  ILE  13          3HG2      ILE  13  -4.722  -3.479  -3.086
  110   1HD1  ILE  13          1HD1      ILE  13  -6.577  -6.497  -1.938
  111   2HD1  ILE  13          2HD1      ILE  13  -5.409  -7.760  -2.328
  112   3HD1  ILE  13          3HD1      ILE  13  -5.675  -6.425  -3.450
  113    H    CYS  14           H        CYS  14  -3.476  -2.273   1.016
  114    HA   CYS  14           HA       CYS  14  -5.938  -0.790   1.627
  115   1HB   CYS  14          2HB       CYS  14  -4.664   0.492   3.229
  116   2HB   CYS  14          1HB       CYS  14  -4.415  -1.222   3.539
  117    HG   CYS  14           HG       CYS  14  -2.050  -0.918   2.308
  118    H    CYS  15           H        CYS  15  -6.309   1.168   0.728
  119    HA   CYS  15           HA       CYS  15  -4.512   1.968  -1.431
  120   1HB   CYS  15          2HB       CYS  15  -6.403   3.408  -2.152
  121   2HB   CYS  15          1HB       CYS  15  -6.843   1.707  -2.046
  122    HG   CYS  15           HG       CYS  15  -8.704   3.225  -0.966
  123    H    TYR  16           H        TYR  16  -2.938   3.294  -0.783
  124    HA   TYR  16           HA       TYR  16  -3.477   5.271   1.293
  125   1HB   TYR  16          2HB       TYR  16  -1.391   3.789   1.244
  126   2HB   TYR  16          1HB       TYR  16  -0.835   4.803  -0.084
  127    HD1  TYR  16           1HD      TYR  16  -1.630   4.726   3.509
  128    HD2  TYR  16           2HD      TYR  16  -0.040   7.034   0.309
  129    HE1  TYR  16           1HE      TYR  16  -0.727   6.340   5.129
  130    HE2  TYR  16           2HE      TYR  16   0.869   8.653   1.919
  131    HH   TYR  16           HH       TYR  16   1.548   8.692   4.309
  132    H    GLY  17           H        GLY  17  -4.295   7.152   0.662
  133   1HA   GLY  17          2HA       GLY  17  -4.045   9.279  -0.345
  134   2HA   GLY  17          1HA       GLY  17  -3.030   8.549  -1.579
  135    HA   PRO  18           HA       PRO  18  -7.470   8.943  -3.110
  136   1HB   PRO  18          2HB       PRO  18  -7.419  11.242  -4.471
  137   2HB   PRO  18          1HB       PRO  18  -7.673  11.218  -2.721
  138   1HG   PRO  18          2HG       PRO  18  -5.185  11.828  -4.265
  139   2HG   PRO  18          1HG       PRO  18  -5.837  12.635  -2.828
  140   1HD   PRO  18          2HD       PRO  18  -3.826  10.745  -2.785
  141   2HD   PRO  18          1HD       PRO  18  -4.876  11.126  -1.408
  142    H    PHE  19           H        PHE  19  -4.375   8.686  -4.333
  143    HA   PHE  19           HA       PHE  19  -3.503   7.878  -6.265
  144   1HB   PHE  19          2HB       PHE  19  -6.387   7.107  -6.676
  145   2HB   PHE  19          1HB       PHE  19  -5.133   6.710  -7.844
  146    HD1  PHE  19           1HD      PHE  19  -5.486   6.548  -4.132
  147    HD2  PHE  19           2HD      PHE  19  -4.421   4.536  -7.726
  148    HE1  PHE  19           1HE      PHE  19  -4.926   4.536  -2.834
  149    HE2  PHE  19           2HE      PHE  19  -3.861   2.519  -6.435
  150    HZ   PHE  19           HZ       PHE  19  -4.113   2.517  -3.985
  151    H    THR  20           H        THR  20  -6.596   8.873  -7.654
  152    HA   THR  20           HA       THR  20  -5.252  11.121  -8.980
  153    HB   THR  20           HB       THR  20  -6.860  10.372 -10.979
  154    HG1  THR  20           1HG      THR  20  -7.424   8.360 -10.904
  155   1HG2  THR  20          1HG2      THR  20  -4.089   9.439 -10.371
  156   2HG2  THR  20          2HG2      THR  20  -4.637  10.635 -11.546
  157   3HG2  THR  20          3HG2      THR  20  -4.920   8.919 -11.837
  158    H    ASN  21           H        ASN  21  -8.486   9.659  -9.224
  159    HA   ASN  21           HA       ASN  21  -9.829  11.504  -7.606
  160   1HB   ASN  21          2HB       ASN  21  -8.991  12.727  -9.932
  161   2HB   ASN  21          1HB       ASN  21 -10.644  12.260 -10.318
  162   1HD2  ASN  21          1HD2      ASN  21 -12.338  13.219  -9.255
  163   2HD2  ASN  21          2HD2      ASN  21 -12.148  14.609  -8.246
  164    H    MET  22           H        MET  22 -10.525   9.247  -7.231
  165    HA   MET  22           HA       MET  22 -13.031   8.767  -8.587
  166   1HB   MET  22          2HB       MET  22 -10.630   7.110  -9.057
  167   2HB   MET  22          1HB       MET  22 -12.102   6.218  -8.701
  168   1HG   MET  22          2HG       MET  22 -13.020   7.976 -10.533
  169   2HG   MET  22          1HG       MET  22 -11.356   7.771 -11.077
  170   1HE   MET  22          1HE       MET  22 -10.437   5.289 -10.437
  171   2HE   MET  22          2HE       MET  22 -10.525   5.026 -12.179
  172   3HE   MET  22          3HE       MET  22 -11.216   3.839 -11.073
  173    HA   PRO  23           HA       PRO  23 -14.390   7.192  -4.715
  174   1HB   PRO  23          2HB       PRO  23 -15.579   4.790  -5.365
  175   2HB   PRO  23          1HB       PRO  23 -16.340   6.370  -5.565
  176   1HG   PRO  23          2HG       PRO  23 -14.949   4.668  -7.589
  177   2HG   PRO  23          1HG       PRO  23 -16.430   5.628  -7.759
  178   1HD   PRO  23          2HD       PRO  23 -14.079   6.489  -8.723
  179   2HD   PRO  23          1HD       PRO  23 -15.260   7.613  -8.021
  180    H    THR  24           H        THR  24 -12.651   6.710  -3.470
  181    HA   THR  24           HA       THR  24 -10.810   4.644  -3.920
  182    HB   THR  24           HB       THR  24 -11.120   5.222  -1.098
  183    HG1  THR  24           1HG      THR  24 -11.744   7.207  -1.242
  184   1HG2  THR  24          1HG2      THR  24  -9.036   4.771  -2.761
  185   2HG2  THR  24          2HG2      THR  24  -8.903   5.476  -1.150
  186   3HG2  THR  24          3HG2      THR  24  -8.950   6.522  -2.569
  187    H    ASP  25           H        ASP  25 -14.021   4.512  -2.762
  188    HA   ASP  25           HA       ASP  25 -13.692   2.066  -1.258
  189   1HB   ASP  25          2HB       ASP  25 -16.007   3.824  -1.991
  190   2HB   ASP  25          1HB       ASP  25 -16.316   2.175  -1.453
  191    H    GLN  26           H        GLN  26 -14.217   3.020  -4.489
  192    HA   GLN  26           HA       GLN  26 -15.473   0.611  -5.392
  193   1HB   GLN  26          2HB       GLN  26 -15.265   3.113  -6.399
  194   2HB   GLN  26          1HB       GLN  26 -13.996   2.310  -7.309
  195   1HG   GLN  26          2HG       GLN  26 -15.884   0.521  -7.707
  196   2HG   GLN  26          1HG       GLN  26 -16.932   1.895  -7.357
  197   1HE2  GLN  26          1HE2      GLN  26 -17.682   1.685  -9.537
  198   2HE2  GLN  26          2HE2      GLN  26 -16.764   2.351 -10.840
  199    H    LEU  27           H        LEU  27 -12.213   1.833  -5.075
  200    HA   LEU  27           HA       LEU  27 -10.959  -0.169  -6.665
  201   1HB   LEU  27          2HB       LEU  27  -9.856   1.952  -6.212
  202   2HB   LEU  27          1HB       LEU  27  -9.856   1.613  -4.492
  203    HG   LEU  27           HG       LEU  27  -8.338  -0.302  -4.891
  204   1HD1  LEU  27          1HD1      LEU  27  -8.998  -0.786  -7.194
  205   2HD1  LEU  27          2HD1      LEU  27  -7.257  -0.549  -7.057
  206   3HD1  LEU  27          3HD1      LEU  27  -8.271   0.731  -7.723
  207   1HD2  LEU  27          1HD2      LEU  27  -7.216   2.216  -6.096
  208   2HD2  LEU  27          2HD2      LEU  27  -6.374   0.990  -5.149
  209   3HD2  LEU  27          3HD2      LEU  27  -7.557   2.043  -4.374
  210    H    GLU  28           H        GLU  28 -11.344   0.270  -3.150
  211    HA   GLU  28           HA       GLU  28 -10.078  -2.124  -2.404
  212   1HB   GLU  28          2HB       GLU  28 -11.585  -1.873  -0.309
  213   2HB   GLU  28          1HB       GLU  28 -10.362  -0.656  -0.637
  214   1HG   GLU  28          2HG       GLU  28 -11.879   0.956  -0.810
  215   2HG   GLU  28          1HG       GLU  28 -12.892  -0.010  -1.882
  216    H    TRP  29           H        TRP  29 -13.264  -1.477  -3.624
  217    HA   TRP  29           HA       TRP  29 -14.514  -3.875  -2.777
  218   1HB   TRP  29          2HB       TRP  29 -16.040  -2.276  -3.514
  219   2HB   TRP  29          1HB       TRP  29 -15.053  -1.826  -4.900
  220    HD1  TRP  29           HD       TRP  29 -17.125  -4.901  -3.762
  221    HE1  TRP  29           1HE      TRP  29 -18.252  -5.915  -5.843
  222    HE3  TRP  29           3HE      TRP  29 -15.164  -1.810  -7.324
  223    HZ2  TRP  29           2HZ      TRP  29 -18.297  -5.463  -8.630
  224    HZ3  TRP  29           3HZ      TRP  29 -15.796  -2.168  -9.676
  225    HH2  TRP  29           HH       TRP  29 -17.329  -3.958 -10.313
  226    H    MET  30           H        MET  30 -12.942  -2.935  -5.799
  227    HA   MET  30           HA       MET  30 -13.209  -5.270  -7.238
  228   1HB   MET  30          2HB       MET  30 -10.860  -3.367  -7.191
  229   2HB   MET  30          1HB       MET  30 -11.135  -4.586  -8.426
  230   1HG   MET  30          2HG       MET  30 -13.208  -3.494  -9.069
  231   2HG   MET  30          1HG       MET  30 -12.970  -2.285  -7.810
  232   1HE   MET  30          1HE       MET  30 -12.609   0.162  -9.784
  233   2HE   MET  30          2HE       MET  30 -13.730  -1.182 -10.003
  234   3HE   MET  30          3HE       MET  30 -12.662  -0.702 -11.320
  235    H    VAL  31           H        VAL  31 -10.523  -4.397  -5.045
  236    HA   VAL  31           HA       VAL  31  -9.139  -6.835  -5.308
  237    HB   VAL  31           HB       VAL  31  -8.043  -6.259  -3.165
  238   1HG1  VAL  31          1HG1      VAL  31  -7.949  -4.842  -5.593
  239   2HG1  VAL  31          2HG1      VAL  31  -6.685  -4.980  -4.371
  240   3HG1  VAL  31          3HG1      VAL  31  -7.832  -3.641  -4.305
  241   1HG2  VAL  31          1HG2      VAL  31  -9.966  -3.947  -3.144
  242   2HG2  VAL  31          2HG2      VAL  31  -8.574  -4.121  -2.078
  243   3HG2  VAL  31          3HG2      VAL  31  -9.905  -5.272  -1.983
  244    H    GLN  32           H        GLN  32 -11.547  -5.734  -2.965
  245    HA   GLN  32           HA       GLN  32 -11.597  -7.997  -1.328
  246   1HB   GLN  32          2HB       GLN  32 -13.274  -5.653  -1.793
  247   2HB   GLN  32          1HB       GLN  32 -14.212  -7.066  -1.335
  248   1HG   GLN  32          2HG       GLN  32 -11.888  -6.786   0.342
  249   2HG   GLN  32          1HG       GLN  32 -12.857  -5.314   0.348
  250   1HE2  GLN  32          1HE2      GLN  32 -13.268  -5.806   2.577
  251   2HE2  GLN  32          2HE2      GLN  32 -14.498  -6.945   2.997
  252    H    LEU  33           H        LEU  33 -13.162  -7.285  -4.367
  253    HA   LEU  33           HA       LEU  33 -14.895  -9.536  -4.402
  254   1HB   LEU  33          2HB       LEU  33 -15.278  -7.519  -5.751
  255   2HB   LEU  33          1HB       LEU  33 -13.830  -7.863  -6.677
  256    HG   LEU  33           HG       LEU  33 -14.893  -9.976  -7.463
  257   1HD1  LEU  33          1HD1      LEU  33 -16.553  -9.800  -5.405
  258   2HD1  LEU  33          2HD1      LEU  33 -17.002 -10.617  -6.901
  259   3HD1  LEU  33          3HD1      LEU  33 -17.545  -8.966  -6.601
  260   1HD2  LEU  33          1HD2      LEU  33 -16.842  -7.913  -8.238
  261   2HD2  LEU  33          2HD2      LEU  33 -15.777  -8.904  -9.235
  262   3HD2  LEU  33          3HD2      LEU  33 -15.146  -7.467  -8.429
  263    H    CYS  34           H        CYS  34 -11.547  -9.110  -5.028
  264    HA   CYS  34           HA       CYS  34 -11.338 -11.546  -6.608
  265   1HB   CYS  34          2HB       CYS  34  -9.585  -9.232  -6.028
  266   2HB   CYS  34          1HB       CYS  34  -8.775 -10.775  -6.272
  267    HG   CYS  34           HG       CYS  34 -10.724 -10.051  -8.506
  268    H    GLY  35           H        GLY  35 -11.495 -10.863  -3.363
  269   1HA   GLY  35          2HA       GLY  35 -11.351 -12.875  -1.938
  270   2HA   GLY  35          1HA       GLY  35  -9.819 -13.213  -2.727
  271    H    ALA  36           H        ALA  36  -9.418 -10.129  -2.548
  272    HA   ALA  36           HA       ALA  36  -7.866 -10.239  -0.139
  273   1HB   ALA  36          1HB       ALA  36  -7.288  -7.894  -0.719
  274   2HB   ALA  36          2HB       ALA  36  -8.397  -8.006  -2.085
  275   3HB   ALA  36          3HB       ALA  36  -6.978  -9.051  -2.013
  276    H    SER  37           H        SER  37  -7.951  -8.041   1.164
  277    HA   SER  37           HA       SER  37 -10.731  -7.458   1.905
  278   1HB   SER  37          2HB       SER  37  -8.982  -9.041   3.442
  279   2HB   SER  37          1HB       SER  37  -9.033  -7.472   4.246
  280    HG   SER  37           HG       SER  37 -10.948  -7.961   4.923
  281    H    VAL  38           H        VAL  38 -11.126  -5.353   2.342
  282    HA   VAL  38           HA       VAL  38  -9.125  -3.427   1.704
  283    HB   VAL  38           HB       VAL  38 -11.500  -3.056   1.192
  284   1HG1  VAL  38          1HG1      VAL  38 -11.940  -2.564   4.126
  285   2HG1  VAL  38          2HG1      VAL  38 -12.308  -4.104   3.350
  286   3HG1  VAL  38          3HG1      VAL  38 -13.141  -2.637   2.836
  287   1HG2  VAL  38          1HG2      VAL  38 -11.634  -0.713   1.998
  288   2HG2  VAL  38          2HG2      VAL  38 -10.065  -1.128   1.307
  289   3HG2  VAL  38          3HG2      VAL  38 -10.261  -1.037   3.057
  290    H    VAL  39           H        VAL  39  -7.588  -2.702   3.012
  291    HA   VAL  39           HA       VAL  39  -7.883  -3.026   5.899
  292    HB   VAL  39           HB       VAL  39  -5.405  -1.875   4.735
  293   1HG1  VAL  39          1HG1      VAL  39  -4.331  -3.157   6.441
  294   2HG1  VAL  39          2HG1      VAL  39  -5.821  -4.038   6.781
  295   3HG1  VAL  39          3HG1      VAL  39  -5.708  -2.318   7.155
  296   1HG2  VAL  39          1HG2      VAL  39  -4.807  -4.491   4.498
  297   2HG2  VAL  39          2HG2      VAL  39  -5.329  -3.482   3.150
  298   3HG2  VAL  39          3HG2      VAL  39  -6.493  -4.509   3.986
  299    H    LYS  40           H        LYS  40  -8.600  -1.397   7.098
  300    HA   LYS  40           HA       LYS  40  -9.131   1.169   6.151
  301   1HB   LYS  40          2HB       LYS  40  -9.654  -0.245   8.473
  302   2HB   LYS  40          1HB       LYS  40  -8.648   1.086   9.026
  303   1HG   LYS  40          2HG       LYS  40 -10.598   2.178   9.161
  304   2HG   LYS  40          1HG       LYS  40 -10.373   2.409   7.427
  305   1HD   LYS  40          2HD       LYS  40 -11.642  -0.131   8.182
  306   2HD   LYS  40          1HD       LYS  40 -12.583   1.312   8.566
  307   1HE   LYS  40          2HE       LYS  40 -13.230   0.643   6.386
  308   2HE   LYS  40          1HE       LYS  40 -12.199   2.060   6.194
  309   1HZ   LYS  40          1HZ       LYS  40 -10.672  -0.339   6.142
  310   2HZ   LYS  40          2HZ       LYS  40 -10.770   0.893   4.988
  311   3HZ   LYS  40          3HZ       LYS  40 -11.889  -0.376   4.967
  312    H    GLU  41           H        GLU  41  -6.371  -0.051   7.981
  313    HA   GLU  41           HA       GLU  41  -4.785   2.199   7.044
  314   1HB   GLU  41          2HB       GLU  41  -5.367   1.645   9.940
  315   2HB   GLU  41          1HB       GLU  41  -3.877   2.441   9.454
  316   1HG   GLU  41          2HG       GLU  41  -6.582   3.452   8.641
  317   2HG   GLU  41          1HG       GLU  41  -5.797   3.931  10.145
  318    H    LEU  42           H        LEU  42  -2.442   1.911   8.024
  319    HA   LEU  42           HA       LEU  42  -1.486  -0.570   7.047
  320   1HB   LEU  42          2HB       LEU  42   0.062   1.338   8.788
  321   2HB   LEU  42          1HB       LEU  42   0.691   0.217   7.596
  322    HG   LEU  42           HG       LEU  42  -0.921   2.701   7.006
  323   1HD1  LEU  42          1HD1      LEU  42   1.418   3.065   5.759
  324   2HD1  LEU  42          2HD1      LEU  42   1.969   2.099   7.129
  325   3HD1  LEU  42          3HD1      LEU  42   1.108   3.614   7.406
  326   1HD2  LEU  42          1HD2      LEU  42  -0.064   0.400   5.347
  327   2HD2  LEU  42          2HD2      LEU  42   0.073   2.010   4.640
  328   3HD2  LEU  42          3HD2      LEU  42  -1.491   1.428   5.213
  329    H    SER  43           H        SER  43  -1.768   0.771  10.322
  330    HA   SER  43           HA       SER  43  -0.620  -1.353  11.719
  331   1HB   SER  43          2HB       SER  43  -1.634   1.045  12.446
  332   2HB   SER  43          1HB       SER  43  -2.929  -0.014  13.004
  333    HG   SER  43           HG       SER  43  -0.888   0.496  14.370
  334    H    SER  44           H        SER  44  -3.687  -1.108  10.150
  335    HA   SER  44           HA       SER  44  -5.099  -3.073  11.602
  336   1HB   SER  44          2HB       SER  44  -5.512  -1.481   9.233
  337   2HB   SER  44          1HB       SER  44  -6.026  -3.142   8.941
  338    HG   SER  44           HG       SER  44  -7.766  -2.450   9.924
  339    H    PHE  45           H        PHE  45  -2.625  -3.274   9.194
  340    HA   PHE  45           HA       PHE  45  -3.096  -5.773   8.081
  341   1HB   PHE  45          2HB       PHE  45  -0.566  -4.248   8.649
  342   2HB   PHE  45          1HB       PHE  45  -0.515  -5.847   7.913
  343    HD1  PHE  45           1HD      PHE  45  -2.518  -5.981   5.979
  344    HD2  PHE  45           2HD      PHE  45  -0.244  -2.573   7.130
  345    HE1  PHE  45           1HE      PHE  45  -2.912  -4.976   3.769
  346    HE2  PHE  45           2HE      PHE  45  -0.637  -1.561   4.923
  347    HZ   PHE  45           HZ       PHE  45  -1.972  -2.762   3.241
  348    H    THR  46           H        THR  46  -3.020  -7.796   8.817
  349    HA   THR  46           HA       THR  46  -1.573  -8.341  11.317
  350    HB   THR  46           HB       THR  46  -3.900  -8.157  11.934
  351    HG1  THR  46           1HG      THR  46  -3.848  -9.933  13.057
  352   1HG2  THR  46          1HG2      THR  46  -5.638  -8.822  10.730
  353   2HG2  THR  46          2HG2      THR  46  -4.939 -10.417  10.454
  354   3HG2  THR  46          3HG2      THR  46  -4.496  -9.068   9.409
  355    H    LEU  47           H        LEU  47  -0.272 -10.057  11.215
  356    HA   LEU  47           HA       LEU  47  -0.179 -11.606   8.778
  357   1HB   LEU  47          2HB       LEU  47   1.558 -11.236  11.156
  358   2HB   LEU  47          1HB       LEU  47   1.704 -12.756  10.294
  359    HG   LEU  47           HG       LEU  47   2.017 -11.309   8.185
  360   1HD1  LEU  47          1HD1      LEU  47   2.659  -9.085   8.414
  361   2HD1  LEU  47          2HD1      LEU  47   2.926  -9.238  10.150
  362   3HD1  LEU  47          3HD1      LEU  47   1.283  -9.229   9.507
  363   1HD2  LEU  47          1HD2      LEU  47   4.129 -11.308  10.338
  364   2HD2  LEU  47          2HD2      LEU  47   4.406 -11.113   8.607
  365   3HD2  LEU  47          3HD2      LEU  47   3.784 -12.639   9.233
  366    H    GLY  48           H        GLY  48  -2.257 -12.657   9.031
  367   1HA   GLY  48          2HA       GLY  48  -2.768 -14.414  11.219
  368   2HA   GLY  48          1HA       GLY  48  -3.650 -14.365   9.701
  369    H    THR  49           H        THR  49  -3.650 -16.282   8.753
  370    HA   THR  49           HA       THR  49  -1.185 -17.895   8.862
  371    HB   THR  49           HB       THR  49  -3.028 -18.916  10.126
  372    HG1  THR  49           1HG      THR  49  -1.529 -20.198   8.810
  373   1HG2  THR  49          1HG2      THR  49  -4.538 -19.344   7.587
  374   2HG2  THR  49          2HG2      THR  49  -4.828 -17.916   8.579
  375   3HG2  THR  49          3HG2      THR  49  -5.077 -19.524   9.257
  376    H    GLY  50           H        GLY  50  -4.038 -17.096   6.904
  377   1HA   GLY  50          2HA       GLY  50  -2.433 -17.741   4.506
  378   2HA   GLY  50          1HA       GLY  50  -4.148 -18.108   4.616
  379    H    VAL  51           H        VAL  51  -2.856 -15.155   5.934
  380    HA   VAL  51           HA       VAL  51  -4.092 -13.670   3.706
  381    HB   VAL  51           HB       VAL  51  -4.393 -11.825   5.476
  382   1HG1  VAL  51          1HG1      VAL  51  -6.581 -12.495   5.843
  383   2HG1  VAL  51          2HG1      VAL  51  -6.143 -14.197   5.984
  384   3HG1  VAL  51          3HG1      VAL  51  -6.135 -13.413   4.405
  385   1HG2  VAL  51          1HG2      VAL  51  -4.494 -12.436   7.750
  386   2HG2  VAL  51          2HG2      VAL  51  -2.970 -13.091   7.155
  387   3HG2  VAL  51          3HG2      VAL  51  -4.359 -14.154   7.378
  388    H    HIS  52           H        HIS  52  -2.568 -12.740   2.515
  389    HA   HIS  52           HA       HIS  52  -0.044 -11.942   3.749
  390   1HB   HIS  52          2HB       HIS  52  -0.325 -13.283   1.519
  391   2HB   HIS  52          1HB       HIS  52  -0.617 -11.696   0.817
  392    HD1  HIS  52           1HD      HIS  52   1.486 -11.201  -0.413
  393    HD2  HIS  52           2HD      HIS  52   2.213 -12.642   3.416
  394    HE1  HIS  52           1HE      HIS  52   3.973 -11.016  -0.086
  395    HE2  HIS  52           2HE      HIS  52   4.377 -11.805   2.273
  396    HA   PRO  53           HA       PRO  53  -1.483  -7.713   3.778
  397   1HB   PRO  53          2HB       PRO  53   0.756  -6.560   4.727
  398   2HB   PRO  53          1HB       PRO  53  -0.296  -7.544   5.751
  399   1HG   PRO  53          2HG       PRO  53   2.273  -8.288   4.408
  400   2HG   PRO  53          1HG       PRO  53   1.720  -8.661   6.050
  401   1HD   PRO  53          2HD       PRO  53   1.576 -10.430   3.975
  402   2HD   PRO  53          1HD       PRO  53   0.458 -10.444   5.353
  403    H    ILE  54           H        ILE  54  -1.533  -6.179   2.257
  404    HA   ILE  54           HA       ILE  54   0.813  -5.697   0.574
  405    HB   ILE  54           HB       ILE  54  -1.924  -6.097  -0.630
  406   1HG1  ILE  54          2HG1      ILE  54  -0.963  -8.217   0.305
  407   2HG1  ILE  54          1HG1      ILE  54  -1.201  -8.242  -1.439
  408   1HG2  ILE  54          1HG2      ILE  54  -0.205  -6.380  -2.660
  409   2HG2  ILE  54          2HG2      ILE  54   0.726  -5.280  -1.643
  410   3HG2  ILE  54          3HG2      ILE  54  -0.890  -4.826  -2.186
  411   1HD1  ILE  54          1HD1      ILE  54   0.959  -9.217  -0.497
  412   2HD1  ILE  54          2HD1      ILE  54   1.450  -7.541  -0.246
  413   3HD1  ILE  54          3HD1      ILE  54   1.078  -8.119  -1.871
  414    H    VAL  55           H        VAL  55   0.832  -3.634  -0.422
  415    HA   VAL  55           HA       VAL  55  -1.264  -1.769   0.472
  416    HB   VAL  55           HB       VAL  55   1.697  -1.159   0.485
  417   1HG1  VAL  55          1HG1      VAL  55   0.550   0.772   1.971
  418   2HG1  VAL  55          2HG1      VAL  55  -0.739   0.469   0.806
  419   3HG1  VAL  55          3HG1      VAL  55   0.869   0.925   0.243
  420   1HG2  VAL  55          1HG2      VAL  55   0.252  -1.057   3.025
  421   2HG2  VAL  55          2HG2      VAL  55   1.832  -1.740   2.644
  422   3HG2  VAL  55          3HG2      VAL  55   0.370  -2.675   2.336
  423    H    VAL  56           H        VAL  56  -1.655   0.016  -0.895
  424    HA   VAL  56           HA       VAL  56  -0.415  -0.207  -3.561
  425    HB   VAL  56           HB       VAL  56  -3.244   0.613  -2.932
  426   1HG1  VAL  56          1HG1      VAL  56  -2.469   1.807  -4.868
  427   2HG1  VAL  56          2HG1      VAL  56  -3.560   0.523  -5.390
  428   3HG1  VAL  56          3HG1      VAL  56  -1.817   0.325  -5.567
  429   1HG2  VAL  56          1HG2      VAL  56  -3.978  -1.460  -3.607
  430   2HG2  VAL  56          2HG2      VAL  56  -2.481  -1.873  -2.770
  431   3HG2  VAL  56          3HG2      VAL  56  -2.514  -1.792  -4.533
  432    H    VAL  57           H        VAL  57  -0.363   1.804  -4.820
  433    HA   VAL  57           HA       VAL  57  -0.618   4.287  -3.323
  434    HB   VAL  57           HB       VAL  57   1.767   4.870  -4.317
  435   1HG1  VAL  57          1HG1      VAL  57   1.184   5.110  -1.996
  436   2HG1  VAL  57          2HG1      VAL  57   2.741   4.292  -2.119
  437   3HG1  VAL  57          3HG1      VAL  57   1.285   3.367  -1.751
  438   1HG2  VAL  57          1HG2      VAL  57   2.256   2.799  -5.384
  439   2HG2  VAL  57          2HG2      VAL  57   1.867   1.885  -3.928
  440   3HG2  VAL  57          3HG2      VAL  57   3.299   2.915  -3.967
  441    H    GLN  58           H        GLN  58   0.357   6.126  -4.870
  442    HA   GLN  58           HA       GLN  58   0.397   5.970  -7.598
  443   1HB   GLN  58          2HB       GLN  58  -2.260   5.502  -6.620
  444   2HB   GLN  58          1HB       GLN  58  -2.235   7.009  -7.523
  445   1HG   GLN  58          2HG       GLN  58  -0.770   4.958  -8.913
  446   2HG   GLN  58          1HG       GLN  58  -2.408   4.426  -8.541
  447   1HE2  GLN  58          1HE2      GLN  58  -4.172   5.731  -9.285
  448   2HE2  GLN  58          2HE2      GLN  58  -3.987   6.722 -10.688
  449    HA   PRO  59           HA       PRO  59   1.072  10.140  -5.720
  450   1HB   PRO  59          2HB       PRO  59   3.441  10.595  -6.956
  451   2HB   PRO  59          1HB       PRO  59   3.311   9.690  -5.444
  452   1HG   PRO  59          2HG       PRO  59   3.578   8.669  -8.246
  453   2HG   PRO  59          1HG       PRO  59   4.394   8.116  -6.772
  454   1HD   PRO  59          2HD       PRO  59   2.256   6.830  -7.829
  455   2HD   PRO  59          1HD       PRO  59   2.581   6.871  -6.084
  456    H    ASP  60           H        ASP  60  -0.337  11.452  -6.746
  457    HA   ASP  60           HA       ASP  60   0.411  12.770  -9.126
  458   1HB   ASP  60          2HB       ASP  60  -0.672  10.365  -9.731
  459   2HB   ASP  60          1HB       ASP  60  -2.127  11.355  -9.674
  460    H    ALA  61           H        ALA  61  -2.268  11.842  -7.025
  461    HA   ALA  61           HA       ALA  61  -3.251  14.619  -7.174
  462   1HB   ALA  61          1HB       ALA  61  -4.773  12.842  -8.100
  463   2HB   ALA  61          2HB       ALA  61  -5.470  13.853  -6.835
  464   3HB   ALA  61          3HB       ALA  61  -4.921  12.220  -6.457
  465    H    TRP  62           H        TRP  62  -1.180  13.821  -5.419
  466    HA   TRP  62           HA       TRP  62  -2.226  13.267  -2.820
  467   1HB   TRP  62          2HB       TRP  62   0.284  13.211  -3.974
  468   2HB   TRP  62          1HB       TRP  62   0.386  14.583  -2.876
  469    HD1  TRP  62           HD       TRP  62  -1.605  11.367  -2.135
  470    HE1  TRP  62           1HE      TRP  62  -0.592  10.253  -0.048
  471    HE3  TRP  62           3HE      TRP  62   2.429  14.435  -1.452
  472    HZ2  TRP  62           2HZ      TRP  62   1.623  10.624   1.661
  473    HZ3  TRP  62           3HZ      TRP  62   3.946  13.986   0.432
  474    HH2  TRP  62           HH       TRP  62   3.548  12.121   1.957
  475    H    THR  63           H        THR  63  -1.818  16.126  -4.700
  476    HA   THR  63           HA       THR  63  -2.439  18.282  -4.322
  477    HB   THR  63           HB       THR  63  -3.341  17.784  -1.536
  478    HG1  THR  63           1HG      THR  63  -4.935  16.468  -2.080
  479   1HG2  THR  63          1HG2      THR  63  -5.361  18.971  -2.358
  480   2HG2  THR  63          2HG2      THR  63  -4.553  19.167  -3.914
  481   3HG2  THR  63          3HG2      THR  63  -3.872  19.911  -2.466
  482    H    GLU  64           H        GLU  64  -1.512  17.153  -1.085
  483    HA   GLU  64           HA       GLU  64   0.255  19.438  -0.790
  484   1HB   GLU  64          2HB       GLU  64  -1.060  17.524   0.998
  485   2HB   GLU  64          1HB       GLU  64   0.591  17.904   1.472
  486   1HG   GLU  64          2HG       GLU  64  -1.422  20.040   0.854
  487   2HG   GLU  64          1HG       GLU  64  -1.264  19.325   2.459
  488    H    ASP  65           H        ASP  65   2.447  19.035   0.218
  489    HA   ASP  65           HA       ASP  65   3.703  16.584  -0.791
  490   1HB   ASP  65          2HB       ASP  65   4.200  19.339  -1.700
  491   2HB   ASP  65          1HB       ASP  65   5.655  18.438  -1.284
  492    H    ASN  66           H        ASN  66   3.445  16.227   1.600
  493    HA   ASN  66           HA       ASN  66   5.264  17.701   3.308
  494   1HB   ASN  66          2HB       ASN  66   3.008  16.846   4.067
  495   2HB   ASN  66          1HB       ASN  66   3.682  15.221   4.001
  496   1HD2  ASN  66          1HD2      ASN  66   2.750  15.860   6.340
  497   2HD2  ASN  66          2HD2      ASN  66   3.996  16.267   7.466
  498    H    GLY  67           H        GLY  67   4.919  14.350   2.163
  499   1HA   GLY  67          2HA       GLY  67   7.571  13.872   1.601
  500   2HA   GLY  67          1HA       GLY  67   7.389  13.487   3.307
  501    H    PHE  68           H        PHE  68   6.821  12.472   0.080
  502    HA   PHE  68           HA       PHE  68   5.133  10.244   0.901
  503   1HB   PHE  68          2HB       PHE  68   4.655  11.541  -1.189
  504   2HB   PHE  68          1HB       PHE  68   6.152  10.903  -1.867
  505    HD1  PHE  68           1HD      PHE  68   2.713  10.153  -0.929
  506    HD2  PHE  68           2HD      PHE  68   6.346   8.560  -2.467
  507    HE1  PHE  68           1HE      PHE  68   1.507   8.145  -1.687
  508    HE2  PHE  68           2HE      PHE  68   5.149   6.551  -3.229
  509    HZ   PHE  68           HZ       PHE  68   2.728   6.342  -2.837
  510    H    HIS  69           H        HIS  69   8.405  10.849   0.746
  511    HA   HIS  69           HA       HIS  69   9.238   8.270  -0.236
  512   1HB   HIS  69          2HB       HIS  69  11.514   9.063   0.548
  513   2HB   HIS  69          1HB       HIS  69  10.739  10.062  -0.677
  514    HD1  HIS  69           1HD      HIS  69  11.535  10.033   3.009
  515    HD2  HIS  69           2HD      HIS  69  10.259  12.671   0.063
  516    HE1  HIS  69           1HE      HIS  69  11.623  12.312   4.066
  517    HE2  HIS  69           2HE      HIS  69  10.748  13.879   2.298
  518    H    ALA  70           H        ALA  70   7.558   7.549   1.614
  519    HA   ALA  70           HA       ALA  70   9.128   6.126   3.500
  520   1HB   ALA  70          1HB       ALA  70   9.031   8.442   4.514
  521   2HB   ALA  70          2HB       ALA  70   8.494   7.115   5.545
  522   3HB   ALA  70          3HB       ALA  70   7.308   8.159   4.760
  523    H    ILE  71           H        ILE  71   7.037   5.696   1.486
  524    HA   ILE  71           HA       ILE  71   4.582   5.064   2.755
  525    HB   ILE  71           HB       ILE  71   5.643   3.777   0.244
  526   1HG1  ILE  71          2HG1      ILE  71   5.882   6.133  -0.107
  527   2HG1  ILE  71          1HG1      ILE  71   4.407   5.639  -0.931
  528   1HG2  ILE  71          1HG2      ILE  71   2.931   4.150   1.459
  529   2HG2  ILE  71          2HG2      ILE  71   3.694   2.672   0.877
  530   3HG2  ILE  71          3HG2      ILE  71   3.126   3.882  -0.273
  531   1HD1  ILE  71          1HD1      ILE  71   4.570   6.996   1.751
  532   2HD1  ILE  71          2HD1      ILE  71   3.085   6.486   0.944
  533   3HD1  ILE  71          3HD1      ILE  71   4.094   7.742   0.225
  534    H    GLY  72           H        GLY  72   6.967   2.799   1.362
  535   1HA   GLY  72          2HA       GLY  72   5.960   0.583   2.836
  536   2HA   GLY  72          1HA       GLY  72   7.455   0.620   1.914
  537    H    GLN  73           H        GLN  73   8.235   3.063   3.583
  538    HA   GLN  73           HA       GLN  73   9.723   1.615   5.538
  539   1HB   GLN  73          2HB       GLN  73  10.304   3.831   4.284
  540   2HB   GLN  73          1HB       GLN  73   9.416   4.595   5.594
  541   1HG   GLN  73          2HG       GLN  73  11.330   2.664   6.578
  542   2HG   GLN  73          1HG       GLN  73  12.093   3.901   5.580
  543   1HE2  GLN  73          1HE2      GLN  73  12.985   5.319   6.899
  544   2HE2  GLN  73          2HE2      GLN  73  12.225   6.052   8.266
  545    H    MET  74           H        MET  74   6.693   3.298   5.539
  546    HA   MET  74           HA       MET  74   6.581   3.357   8.454
  547   1HB   MET  74          2HB       MET  74   4.851   4.484   6.273
  548   2HB   MET  74          1HB       MET  74   4.256   4.373   7.923
  549   1HG   MET  74          2HG       MET  74   5.819   5.899   8.720
  550   2HG   MET  74          1HG       MET  74   6.858   5.714   7.308
  551   1HE   MET  74          1HE       MET  74   3.005   5.987   6.589
  552   2HE   MET  74          2HE       MET  74   2.714   7.688   6.950
  553   3HE   MET  74          3HE       MET  74   3.184   6.583   8.241
  554    H    CYS  75           H        CYS  75   5.303   1.597   5.733
  555    HA   CYS  75           HA       CYS  75   3.542   0.062   7.515
  556   1HB   CYS  75          2HB       CYS  75   2.464   1.001   5.524
  557   2HB   CYS  75          1HB       CYS  75   3.629   0.179   4.492
  558    HG   CYS  75           HG       CYS  75   2.497  -2.084   5.624
  559    H    GLU  76           H        GLU  76   3.519  -2.262   7.346
  560    HA   GLU  76           HA       GLU  76   6.188  -3.329   6.763
  561   1HB   GLU  76          2HB       GLU  76   4.974  -3.567   9.055
  562   2HB   GLU  76          1HB       GLU  76   4.057  -4.832   8.247
  563   1HG   GLU  76          2HG       GLU  76   5.797  -5.953   9.315
  564   2HG   GLU  76          1HG       GLU  76   6.308  -5.845   7.631
  565    H    ALA  77           H        ALA  77   4.358  -2.820   4.630
  566    HA   ALA  77           HA       ALA  77   4.167  -5.534   3.560
  567   1HB   ALA  77          1HB       ALA  77   1.889  -3.888   2.771
  568   2HB   ALA  77          2HB       ALA  77   1.916  -4.280   4.490
  569   3HB   ALA  77          3HB       ALA  77   1.947  -5.572   3.291
  570    HA   PRO  78           HA       PRO  78   5.625  -3.727  -0.188
  571   1HB   PRO  78          2HB       PRO  78   4.322  -5.080  -2.121
  572   2HB   PRO  78          1HB       PRO  78   5.529  -5.853  -1.085
  573   1HG   PRO  78          2HG       PRO  78   2.540  -5.906  -0.876
  574   2HG   PRO  78          1HG       PRO  78   3.694  -7.242  -0.710
  575   1HD   PRO  78          2HD       PRO  78   2.597  -5.973   1.424
  576   2HD   PRO  78          1HD       PRO  78   4.223  -6.684   1.459
  577    H    VAL  79           H        VAL  79   5.258  -1.930  -1.346
  578    HA   VAL  79           HA       VAL  79   2.481  -0.985  -1.586
  579    HB   VAL  79           HB       VAL  79   4.868   0.775  -2.027
  580   1HG1  VAL  79          1HG1      VAL  79   2.587   1.845  -0.592
  581   2HG1  VAL  79          2HG1      VAL  79   2.134   1.161  -2.152
  582   3HG1  VAL  79          3HG1      VAL  79   3.367   2.417  -2.065
  583   1HG2  VAL  79          1HG2      VAL  79   5.175  -0.424   0.145
  584   2HG2  VAL  79          2HG2      VAL  79   3.646   0.273   0.683
  585   3HG2  VAL  79          3HG2      VAL  79   5.007   1.325   0.297
  586    H    VAL  80           H        VAL  80   1.561  -0.890  -3.560
  587    HA   VAL  80           HA       VAL  80   3.322  -0.668  -5.909
  588    HB   VAL  80           HB       VAL  80   2.014  -2.364  -7.115
  589   1HG1  VAL  80          1HG1      VAL  80   2.820  -4.364  -5.817
  590   2HG1  VAL  80          2HG1      VAL  80   3.326  -3.242  -4.555
  591   3HG1  VAL  80          3HG1      VAL  80   4.041  -3.140  -6.163
  592   1HG2  VAL  80          1HG2      VAL  80   0.734  -3.003  -4.461
  593   2HG2  VAL  80          2HG2      VAL  80   0.425  -3.782  -6.013
  594   3HG2  VAL  80          3HG2      VAL  80  -0.058  -2.106  -5.757
  595    H    THR  81           H        THR  81   2.178   0.019  -7.871
  596    HA   THR  81           HA       THR  81   0.268   2.067  -7.313
  597    HB   THR  81           HB       THR  81   0.452   2.673  -9.578
  598    HG1  THR  81           1HG      THR  81   1.043  -0.044 -10.002
  599   1HG2  THR  81          1HG2      THR  81   2.690   2.903  -9.989
  600   2HG2  THR  81          2HG2      THR  81   3.077   1.284  -9.405
  601   3HG2  THR  81          3HG2      THR  81   2.692   2.567  -8.258
  602    H    ARG  82           H        ARG  82  -1.821   2.216  -8.589
  603    HA   ARG  82           HA       ARG  82  -3.504   0.099  -7.890
  604   1HB   ARG  82          2HB       ARG  82  -5.140   1.240  -9.510
  605   2HB   ARG  82          1HB       ARG  82  -4.576   2.153  -8.122
  606   1HG   ARG  82          2HG       ARG  82  -3.941   3.770  -9.487
  607   2HG   ARG  82          1HG       ARG  82  -2.756   2.676 -10.200
  608   1HD   ARG  82          2HD       ARG  82  -5.352   2.085 -11.245
  609   2HD   ARG  82          1HD       ARG  82  -5.034   3.811 -11.412
  610    HE   ARG  82           HE       ARG  82  -2.789   2.323 -12.262
  611   1HH1  ARG  82          1HH1      ARG  82  -6.029   3.164 -13.247
  612   2HH1  ARG  82          2HH1      ARG  82  -5.686   3.025 -14.939
  613   1HH2  ARG  82          1HH2      ARG  82  -2.335   2.140 -14.487
  614   2HH2  ARG  82          2HH2      ARG  82  -3.589   2.440 -15.643
  615    H    GLU  83           H        GLU  83  -1.459   0.435 -10.624
  616    HA   GLU  83           HA       GLU  83  -2.758  -0.891 -12.645
  617   1HB   GLU  83          2HB       GLU  83   0.049  -0.520 -11.860
  618   2HB   GLU  83          1HB       GLU  83  -0.233  -1.947 -12.847
  619   1HG   GLU  83          2HG       GLU  83  -0.545  -0.744 -14.691
  620   2HG   GLU  83          1HG       GLU  83  -1.587   0.414 -13.867
  621    H    TRP  84           H        TRP  84  -1.118  -2.303  -9.851
  622    HA   TRP  84           HA       TRP  84  -1.348  -5.006 -10.570
  623   1HB   TRP  84          2HB       TRP  84   0.045  -4.185  -8.702
  624   2HB   TRP  84          1HB       TRP  84  -1.408  -3.776  -7.806
  625    HD1  TRP  84           HD       TRP  84   0.404  -6.907  -9.184
  626    HE1  TRP  84           1HE      TRP  84  -0.211  -8.903  -7.679
  627    HE3  TRP  84           3HE      TRP  84  -2.998  -4.607  -6.138
  628    HZ2  TRP  84           2HZ      TRP  84  -1.916  -9.430  -5.488
  629    HZ3  TRP  84           3HZ      TRP  84  -4.077  -5.928  -4.366
  630    HH2  TRP  84           HH       TRP  84  -3.548  -8.286  -4.046
  631    H    VAL  85           H        VAL  85  -3.345  -3.087  -8.384
  632    HA   VAL  85           HA       VAL  85  -5.353  -4.938  -7.901
  633    HB   VAL  85           HB       VAL  85  -5.630  -1.932  -8.047
  634   1HG1  VAL  85          1HG1      VAL  85  -7.810  -2.387  -7.800
  635   2HG1  VAL  85          2HG1      VAL  85  -7.379  -2.792  -6.139
  636   3HG1  VAL  85          3HG1      VAL  85  -7.508  -4.066  -7.352
  637   1HG2  VAL  85          1HG2      VAL  85  -3.879  -2.571  -6.513
  638   2HG2  VAL  85          2HG2      VAL  85  -4.939  -3.755  -5.747
  639   3HG2  VAL  85          3HG2      VAL  85  -5.289  -2.033  -5.601
  640    H    LEU  86           H        LEU  86  -4.982  -2.682 -10.582
  641    HA   LEU  86           HA       LEU  86  -7.577  -3.232 -11.677
  642   1HB   LEU  86          2HB       LEU  86  -5.727  -1.239 -12.016
  643   2HB   LEU  86          1HB       LEU  86  -5.548  -2.153 -13.501
  644    HG   LEU  86           HG       LEU  86  -8.177  -1.065 -12.497
  645   1HD1  LEU  86          1HD1      LEU  86  -7.932   0.638 -14.234
  646   2HD1  LEU  86          2HD1      LEU  86  -6.314   0.036 -14.596
  647   3HD1  LEU  86          3HD1      LEU  86  -6.655   0.759 -13.024
  648   1HD2  LEU  86          1HD2      LEU  86  -8.906  -1.524 -14.809
  649   2HD2  LEU  86          2HD2      LEU  86  -8.442  -2.986 -13.938
  650   3HD2  LEU  86          3HD2      LEU  86  -7.347  -2.283 -15.127
  651    H    ASP  87           H        ASP  87  -4.261  -4.011 -12.724
  652    HA   ASP  87           HA       ASP  87  -4.934  -5.629 -14.887
  653   1HB   ASP  87          2HB       ASP  87  -2.653  -4.805 -14.451
  654   2HB   ASP  87          1HB       ASP  87  -2.534  -5.876 -13.059
  655    H    SER  88           H        SER  88  -4.856  -6.329 -11.466
  656    HA   SER  88           HA       SER  88  -5.036  -9.175 -11.781
  657   1HB   SER  88          2HB       SER  88  -5.550  -7.421  -9.366
  658   2HB   SER  88          1HB       SER  88  -5.460  -9.183  -9.340
  659    HG   SER  88           HG       SER  88  -3.370  -7.465 -10.199
  660    H    VAL  89           H        VAL  89  -7.334  -6.627 -10.813
  661    HA   VAL  89           HA       VAL  89  -9.555  -8.401 -10.659
  662    HB   VAL  89           HB       VAL  89  -9.592  -5.397 -10.972
  663   1HG1  VAL  89          1HG1      VAL  89 -11.734  -6.608 -11.428
  664   2HG1  VAL  89          2HG1      VAL  89 -11.807  -5.473 -10.081
  665   3HG1  VAL  89          3HG1      VAL  89 -11.681  -7.205  -9.769
  666   1HG2  VAL  89          1HG2      VAL  89  -9.192  -5.142  -8.765
  667   2HG2  VAL  89          2HG2      VAL  89  -8.376  -6.695  -8.953
  668   3HG2  VAL  89          3HG2      VAL  89 -10.025  -6.636  -8.332
  669    H    ALA  90           H        ALA  90  -8.078  -6.619 -13.249
  670    HA   ALA  90           HA       ALA  90 -10.331  -6.615 -14.996
  671   1HB   ALA  90          1HB       ALA  90  -8.772  -4.991 -15.532
  672   2HB   ALA  90          2HB       ALA  90  -8.460  -6.231 -16.748
  673   3HB   ALA  90          3HB       ALA  90  -7.407  -6.092 -15.339
  674    H    LEU  91           H        LEU  91  -7.320  -8.523 -15.023
  675    HA   LEU  91           HA       LEU  91  -8.519 -10.421 -16.871
  676   1HB   LEU  91          2HB       LEU  91  -6.198  -9.622 -17.182
  677   2HB   LEU  91          1HB       LEU  91  -5.758 -10.366 -15.656
  678    HG   LEU  91           HG       LEU  91  -6.852 -12.481 -17.011
  679   1HD1  LEU  91          1HD1      LEU  91  -5.264 -10.902 -19.023
  680   2HD1  LEU  91          2HD1      LEU  91  -7.019 -11.070 -19.045
  681   3HD1  LEU  91          3HD1      LEU  91  -5.996 -12.491 -19.248
  682   1HD2  LEU  91          1HD2      LEU  91  -4.482 -13.155 -17.397
  683   2HD2  LEU  91          2HD2      LEU  91  -4.824 -12.619 -15.752
  684   3HD2  LEU  91          3HD2      LEU  91  -3.993 -11.543 -16.876
  685    H    TYR  92           H        TYR  92  -8.178 -10.053 -13.518
  686    HA   TYR  92           HA       TYR  92  -8.751 -11.379 -11.762
  687   1HB   TYR  92          2HB       TYR  92 -10.265 -12.398 -13.907
  688   2HB   TYR  92          1HB       TYR  92  -9.567 -13.800 -13.104
  689    HD1  TYR  92           1HD      TYR  92  -9.524 -12.724 -10.281
  690    HD2  TYR  92           2HD      TYR  92 -12.527 -12.608 -13.297
  691    HE1  TYR  92           1HE      TYR  92 -11.258 -12.588  -8.544
  692    HE2  TYR  92           2HE      TYR  92 -14.267 -12.471 -11.566
  693    HH   TYR  92           HH       TYR  92 -14.498 -13.127  -9.131
  694    H    GLN  93           H        GLN  93  -6.485 -11.489 -11.320
  695    HA   GLN  93           HA       GLN  93  -5.529 -14.080 -10.876
  696   1HB   GLN  93          2HB       GLN  93  -5.202 -13.524 -13.497
  697   2HB   GLN  93          1HB       GLN  93  -3.704 -12.856 -12.864
  698   1HG   GLN  93          2HG       GLN  93  -4.365 -15.527 -11.861
  699   2HG   GLN  93          1HG       GLN  93  -4.070 -15.439 -13.598
  700   1HE2  GLN  93          1HE2      GLN  93  -2.699 -15.263 -10.452
  701   2HE2  GLN  93          2HE2      GLN  93  -1.048 -15.115 -10.939
  702    H    CYS  94           H        CYS  94  -3.918 -14.045  -9.389
  703    HA   CYS  94           HA       CYS  94  -3.275 -11.604  -8.124
  704   1HB   CYS  94          2HB       CYS  94  -3.275 -14.083  -7.235
  705   2HB   CYS  94          1HB       CYS  94  -1.587 -14.044  -7.733
  706    HG   CYS  94           HG       CYS  94  -2.705 -12.786  -5.243
  707    H    GLN  95           H        GLN  95  -2.387 -10.282  -9.773
  708    HA   GLN  95           HA       GLN  95  -0.175 -10.919 -11.357
  709   1HB   GLN  95          2HB       GLN  95  -1.600  -8.473 -10.566
  710   2HB   GLN  95          1HB       GLN  95   0.089  -8.218 -10.981
  711   1HG   GLN  95          2HG       GLN  95  -1.990  -9.519 -12.722
  712   2HG   GLN  95          1HG       GLN  95  -1.339  -7.892 -12.909
  713   1HE2  GLN  95          1HE2      GLN  95  -1.245  -9.653 -14.985
  714   2HE2  GLN  95          2HE2      GLN  95   0.388 -10.137 -15.275
  715    H    GLU  96           H        GLU  96   1.973  -9.699 -11.179
  716    HA   GLU  96           HA       GLU  96   3.090 -10.307  -8.554
  717   1HB   GLU  96          2HB       GLU  96   5.292  -9.834  -9.799
  718   2HB   GLU  96          1HB       GLU  96   4.396 -11.281 -10.232
  719   1HG   GLU  96          2HG       GLU  96   3.847  -8.816 -11.781
  720   2HG   GLU  96          1HG       GLU  96   5.391  -9.625 -12.042
  721    H    LEU  97           H        LEU  97   3.328  -8.771  -7.098
  722    HA   LEU  97           HA       LEU  97   2.843  -6.052  -7.563
  723   1HB   LEU  97          2HB       LEU  97   4.033  -7.605  -5.303
  724   2HB   LEU  97          1HB       LEU  97   4.091  -5.854  -5.271
  725    HG   LEU  97           HG       LEU  97   1.468  -6.228  -5.815
  726   1HD1  LEU  97          1HD1      LEU  97   0.579  -8.135  -4.996
  727   2HD1  LEU  97          2HD1      LEU  97   1.812  -8.305  -3.747
  728   3HD1  LEU  97          3HD1      LEU  97   2.167  -8.780  -5.408
  729   1HD2  LEU  97          1HD2      LEU  97   2.954  -5.171  -3.791
  730   2HD2  LEU  97          2HD2      LEU  97   2.062  -6.442  -2.955
  731   3HD2  LEU  97          3HD2      LEU  97   1.191  -5.195  -3.846
  732    H    ASP  98           H        ASP  98   5.827  -7.901  -7.507
  733    HA   ASP  98           HA       ASP  98   7.702  -5.874  -7.350
  734   1HB   ASP  98          2HB       ASP  98   8.240  -8.286  -7.307
  735   2HB   ASP  98          1HB       ASP  98   7.887  -8.384  -9.029
  736    H    THR  99           H        THR  99   5.579  -6.666  -9.965
  737    HA   THR  99           HA       THR  99   7.104  -5.273 -11.972
  738    HB   THR  99           HB       THR  99   4.251  -6.273 -12.034
  739    HG1  THR  99           1HG      THR  99   6.101  -7.809 -11.778
  740   1HG2  THR  99          1HG2      THR  99   4.804  -4.554 -13.762
  741   2HG2  THR  99          2HG2      THR  99   4.327  -6.130 -14.394
  742   3HG2  THR  99          3HG2      THR  99   6.028  -5.664 -14.376
  743    H    TYR 100           H        TYR 100   4.787  -4.407  -9.584
  744    HA   TYR 100           HA       TYR 100   4.691  -1.696 -10.709
  745   1HB   TYR 100          2HB       TYR 100   2.292  -2.912  -9.356
  746   2HB   TYR 100          1HB       TYR 100   2.373  -1.459 -10.346
  747    HD1  TYR 100           1HD      TYR 100   1.679  -4.953 -10.306
  748    HD2  TYR 100           2HD      TYR 100   2.915  -1.768 -12.842
  749    HE1  TYR 100           1HE      TYR 100   1.011  -6.268 -12.273
  750    HE2  TYR 100           2HE      TYR 100   2.249  -3.073 -14.817
  751    HH   TYR 100           HH       TYR 100   1.864  -5.366 -15.466
  752    H    LEU 101           H        LEU 101   6.346  -2.832  -8.629
  753    HA   LEU 101           HA       LEU 101   5.270  -1.599  -6.194
  754   1HB   LEU 101          2HB       LEU 101   6.684  -3.955  -6.641
  755   2HB   LEU 101          1HB       LEU 101   7.868  -2.871  -5.948
  756    HG   LEU 101           HG       LEU 101   5.285  -2.978  -4.531
  757   1HD1  LEU 101          1HD1      LEU 101   6.184  -5.391  -5.354
  758   2HD1  LEU 101          2HD1      LEU 101   5.300  -5.119  -3.853
  759   3HD1  LEU 101          3HD1      LEU 101   7.061  -5.209  -3.834
  760   1HD2  LEU 101          1HD2      LEU 101   7.258  -3.395  -2.722
  761   2HD2  LEU 101          2HD2      LEU 101   6.705  -1.804  -3.245
  762   3HD2  LEU 101          3HD2      LEU 101   8.134  -2.527  -3.984
  763    H    ILE 102           H        ILE 102   7.129  -0.605  -4.795
  764    HA   ILE 102           HA       ILE 102   8.872   1.050  -6.488
  765    HB   ILE 102           HB       ILE 102   7.391   2.134  -4.093
  766   1HG1  ILE 102          2HG1      ILE 102   6.340   3.462  -6.223
  767   2HG1  ILE 102          1HG1      ILE 102   6.569   1.860  -6.917
  768   1HG2  ILE 102          1HG2      ILE 102   9.367   3.195  -6.023
  769   2HG2  ILE 102          2HG2      ILE 102   9.133   3.569  -4.314
  770   3HG2  ILE 102          3HG2      ILE 102   8.068   4.280  -5.527
  771   1HD1  ILE 102          1HD1      ILE 102   5.159   2.265  -4.306
  772   2HD1  ILE 102          2HD1      ILE 102   5.116   0.867  -5.379
  773   3HD1  ILE 102          3HD1      ILE 102   4.321   2.369  -5.854
  774    HA   PRO 103           HA       PRO 103  11.343  -0.721  -3.054
  775   1HB   PRO 103          2HB       PRO 103  13.351  -1.701  -4.522
  776   2HB   PRO 103          1HB       PRO 103  11.805  -2.549  -4.397
  777   1HG   PRO 103          2HG       PRO 103  12.867  -0.861  -6.619
  778   2HG   PRO 103          1HG       PRO 103  11.918  -2.355  -6.699
  779   1HD   PRO 103          2HD       PRO 103  10.899   0.217  -6.983
  780   2HD   PRO 103          1HD       PRO 103   9.945  -1.223  -6.583
  781    H    GLN 104           H        GLN 104  14.001  -0.560  -3.021
  782    HA   GLN 104           HA       GLN 104  15.155   1.765  -4.120
  783   1HB   GLN 104          2HB       GLN 104  13.411   2.376  -2.072
  784   2HB   GLN 104          1HB       GLN 104  14.964   2.315  -1.252
  785   1HG   GLN 104          2HG       GLN 104  15.666   3.792  -3.356
  786   2HG   GLN 104          1HG       GLN 104  13.957   4.214  -3.278
  787   1HE2  GLN 104          1HE2      GLN 104  13.681   6.052  -2.255
  788   2HE2  GLN 104          2HE2      GLN 104  14.527   6.575  -0.843
  789    H    ILE 105           H        ILE 105  15.105  -0.466  -1.378
  790    HA   ILE 105           HA       ILE 105  17.769  -0.236  -0.585
  791    HB   ILE 105           HB       ILE 105  17.524  -2.531   0.333
  792   1HG1  ILE 105          2HG1      ILE 105  14.884  -3.170   0.083
  793   2HG1  ILE 105          1HG1      ILE 105  15.225  -2.510  -1.513
  794   1HG2  ILE 105          1HG2      ILE 105  16.818  -0.732   1.711
  795   2HG2  ILE 105          2HG2      ILE 105  15.579  -1.980   1.826
  796   3HG2  ILE 105          3HG2      ILE 105  15.306  -0.556   0.821
  797   1HD1  ILE 105          1HD1      ILE 105  17.266  -4.102  -1.453
  798   2HD1  ILE 105          2HD1      ILE 105  15.661  -4.750  -1.793
  799   3HD1  ILE 105          3HD1      ILE 105  16.359  -4.923  -0.182
  800    HA   PRO 106           HA       PRO 106  19.862  -2.129  -4.022
  801   1HB   PRO 106          2HB       PRO 106  22.332  -2.284  -2.980
  802   2HB   PRO 106          1HB       PRO 106  21.602  -0.734  -3.415
  803   1HG   PRO 106          2HG       PRO 106  21.863  -2.017  -0.726
  804   2HG   PRO 106          1HG       PRO 106  22.102  -0.322  -1.186
  805   1HD   PRO 106          2HD       PRO 106  19.813  -1.287  -0.021
  806   2HD   PRO 106          1HD       PRO 106  19.866   0.151  -1.058
  807    H    HIS 107           H        HIS 107  20.517  -3.471  -0.785
  808    HA   HIS 107           HA       HIS 107  20.266  -6.161  -1.930
  809   1HB   HIS 107          2HB       HIS 107  22.687  -5.022  -1.025
  810   2HB   HIS 107          1HB       HIS 107  22.198  -6.185   0.203
  811    HD1  HIS 107           1HD      HIS 107  20.846  -8.107  -2.041
  812    HD2  HIS 107           2HD      HIS 107  24.750  -6.693  -1.916
  813    HE1  HIS 107           1HE      HIS 107  22.194  -9.735  -3.403
  814    HE2  HIS 107           2HE      HIS 107  24.569  -8.907  -3.240
  815    H    SER 108           H        SER 108  20.659  -7.660   0.314
  816    HA   SER 108           HA       SER 108  18.788  -6.609   2.317
  817   1HB   SER 108          2HB       SER 108  18.523  -9.483   1.593
  818   2HB   SER 108          1HB       SER 108  17.296  -8.342   2.141
  819    HG   SER 108           HG       SER 108  17.036  -8.905  -0.066
  820    H    HIS 109           H        HIS 109  19.301  -7.088   4.381
  821    HA   HIS 109           HA       HIS 109  21.652  -8.807   4.800
  822   1HB   HIS 109          2HB       HIS 109  20.564  -6.586   6.544
  823   2HB   HIS 109          1HB       HIS 109  22.004  -7.541   6.883
  824    HD1  HIS 109           1HD      HIS 109  22.446  -7.187   3.502
  825    HD2  HIS 109           2HD      HIS 109  22.557  -4.429   6.608
  826    HE1  HIS 109           1HE      HIS 109  23.803  -5.255   2.637
  827    HE2  HIS 109           2HE      HIS 109  23.927  -3.635   4.563
  828    H    TYR 110           H        TYR 110  21.516 -10.569   6.056
  829    HA   TYR 110           HA       TYR 110  18.918 -11.142   7.299
  830   1HB   TYR 110          2HB       TYR 110  20.056 -12.679   5.524
  831   2HB   TYR 110          1HB       TYR 110  21.060 -13.199   6.873
  832    HD1  TYR 110           1HD      TYR 110  20.168 -14.584   8.623
  833    HD2  TYR 110           2HD      TYR 110  17.642 -13.145   5.516
  834    HE1  TYR 110           1HE      TYR 110  18.421 -16.171   9.316
  835    HE2  TYR 110           2HE      TYR 110  15.889 -14.727   6.201
  836    HH   TYR 110           HH       TYR 110  15.215 -15.994   8.164
  Start of MODEL   11
    1   1H    GLY   1          1HT       GLY   1 -15.021 -28.911   1.298
    2   2H    GLY   1          2HT       GLY   1 -13.378 -29.188   1.008
    3   3H    GLY   1          3HT       GLY   1 -14.419 -28.845  -0.281
    4   1HA   GLY   1          1HA       GLY   1 -13.716 -26.979   1.920
    5   2HA   GLY   1          2HA       GLY   1 -13.068 -26.917   0.288
    6    H    SER   2           H        SER   2 -13.888 -24.748   0.177
    7    HA   SER   2           HA       SER   2 -16.794 -24.654  -0.308
    8   1HB   SER   2          2HB       SER   2 -15.547 -23.245   1.627
    9   2HB   SER   2          1HB       SER   2 -15.373 -22.118   0.283
   10    HG   SER   2           HG       SER   2 -17.604 -22.818   1.705
   11    H    GLN   3           H        GLN   3 -17.270 -22.555  -1.699
   12    HA   GLN   3           HA       GLN   3 -15.405 -22.600  -3.982
   13   1HB   GLN   3          2HB       GLN   3 -18.421 -22.472  -3.955
   14   2HB   GLN   3          1HB       GLN   3 -17.459 -22.107  -5.381
   15   1HG   GLN   3          2HG       GLN   3 -17.552 -24.730  -3.908
   16   2HG   GLN   3          1HG       GLN   3 -18.277 -24.375  -5.476
   17   1HE2  GLN   3          1HE2      GLN   3 -16.434 -26.449  -4.962
   18   2HE2  GLN   3          2HE2      GLN   3 -15.004 -26.129  -5.877
   19    H    ASP   4           H        ASP   4 -14.281 -20.760  -3.346
   20    HA   ASP   4           HA       ASP   4 -15.794 -18.284  -2.999
   21   1HB   ASP   4          2HB       ASP   4 -13.514 -19.262  -1.763
   22   2HB   ASP   4          1HB       ASP   4 -12.886 -18.052  -2.879
   23    H    ARG   5           H        ARG   5 -13.448 -19.791  -5.136
   24    HA   ARG   5           HA       ARG   5 -12.686 -19.257  -7.213
   25   1HB   ARG   5          2HB       ARG   5 -15.195 -19.280  -7.587
   26   2HB   ARG   5          1HB       ARG   5 -15.147 -17.528  -7.452
   27   1HG   ARG   5          2HG       ARG   5 -13.163 -18.182  -9.306
   28   2HG   ARG   5          1HG       ARG   5 -14.544 -19.207  -9.703
   29   1HD   ARG   5          2HD       ARG   5 -14.847 -16.262  -9.206
   30   2HD   ARG   5          1HD       ARG   5 -14.422 -16.895 -10.795
   31    HE   ARG   5           HE       ARG   5 -16.625 -18.318 -10.122
   32   1HH1  ARG   5          1HH1      ARG   5 -15.920 -14.902 -10.238
   33   2HH1  ARG   5          2HH1      ARG   5 -17.550 -14.451 -10.609
   34   1HH2  ARG   5          1HH2      ARG   5 -18.770 -17.726 -10.610
   35   2HH2  ARG   5          2HH2      ARG   5 -19.168 -16.054 -10.820
   36    H    LYS   6           H        LYS   6 -11.882 -17.599  -4.969
   37    HA   LYS   6           HA       LYS   6 -11.590 -14.951  -6.186
   38   1HB   LYS   6          2HB       LYS   6 -10.616 -15.727  -3.447
   39   2HB   LYS   6          1HB       LYS   6 -11.017 -14.132  -4.054
   40   1HG   LYS   6          2HG       LYS   6 -13.209 -16.108  -4.000
   41   2HG   LYS   6          1HG       LYS   6 -12.621 -15.518  -2.445
   42   1HD   LYS   6          2HD       LYS   6 -12.805 -13.192  -3.785
   43   2HD   LYS   6          1HD       LYS   6 -14.086 -14.105  -4.585
   44   1HE   LYS   6          2HE       LYS   6 -15.434 -13.745  -2.858
   45   2HE   LYS   6          1HE       LYS   6 -14.292 -14.551  -1.785
   46   1HZ   LYS   6          1HZ       LYS   6 -13.488 -12.603  -1.030
   47   2HZ   LYS   6          2HZ       LYS   6 -14.995 -12.010  -1.519
   48   3HZ   LYS   6          3HZ       LYS   6 -13.644 -11.814  -2.519
   49    H    ILE   7           H        ILE   7  -9.723 -14.247  -7.029
   50    HA   ILE   7           HA       ILE   7  -7.574 -16.077  -7.433
   51    HB   ILE   7           HB       ILE   7  -6.435 -14.156  -8.531
   52   1HG1  ILE   7          2HG1      ILE   7  -8.603 -12.350  -8.755
   53   2HG1  ILE   7          1HG1      ILE   7  -8.401 -12.681  -7.039
   54   1HG2  ILE   7          1HG2      ILE   7  -9.087 -15.214  -9.262
   55   2HG2  ILE   7          2HG2      ILE   7  -7.558 -15.270 -10.138
   56   3HG2  ILE   7          3HG2      ILE   7  -8.536 -13.804 -10.164
   57   1HD1  ILE   7          1HD1      ILE   7  -6.998 -10.908  -7.295
   58   2HD1  ILE   7          2HD1      ILE   7  -6.559 -11.349  -8.945
   59   3HD1  ILE   7          3HD1      ILE   7  -5.875 -12.236  -7.583
   60    H    PHE   8           H        PHE   8  -8.241 -13.649  -5.067
   61    HA   PHE   8           HA       PHE   8  -5.453 -13.527  -4.210
   62   1HB   PHE   8          2HB       PHE   8  -7.938 -12.036  -3.375
   63   2HB   PHE   8          1HB       PHE   8  -6.432 -11.913  -2.483
   64    HD1  PHE   8           1HD      PHE   8  -7.868  -9.611  -3.719
   65    HD2  PHE   8           2HD      PHE   8  -4.831 -12.162  -5.266
   66    HE1  PHE   8           1HE      PHE   8  -7.133  -7.816  -5.228
   67    HE2  PHE   8           2HE      PHE   8  -4.092 -10.369  -6.776
   68    HZ   PHE   8           HZ       PHE   8  -5.244  -8.192  -6.758
   69    H    ARG   9           H        ARG   9  -8.629 -14.479  -2.947
   70    HA   ARG   9           HA       ARG   9  -9.230 -15.642  -1.070
   71   1HB   ARG   9          2HB       ARG   9  -7.976 -17.873  -0.939
   72   2HB   ARG   9          1HB       ARG   9  -8.839 -17.510  -2.427
   73   1HG   ARG   9          2HG       ARG   9  -6.758 -16.847  -3.494
   74   2HG   ARG   9          1HG       ARG   9  -5.878 -17.156  -1.996
   75   1HD   ARG   9          2HD       ARG   9  -5.625 -19.276  -2.601
   76   2HD   ARG   9          1HD       ARG   9  -7.376 -19.480  -2.585
   77    HE   ARG   9           HE       ARG   9  -7.287 -19.587  -4.852
   78   1HH1  ARG   9          1HH1      ARG   9  -4.534 -17.743  -3.759
   79   2HH1  ARG   9          2HH1      ARG   9  -3.887 -17.530  -5.352
   80   1HH2  ARG   9          1HH2      ARG   9  -6.438 -19.309  -6.947
   81   2HH2  ARG   9          2HH2      ARG   9  -4.967 -18.418  -7.161
   82    H    GLY  10           H        GLY  10  -8.697 -14.224   0.580
   83   1HA   GLY  10          2HA       GLY  10  -7.787 -13.911   2.697
   84   2HA   GLY  10          1HA       GLY  10  -6.641 -15.200   2.360
   85    H    LEU  11           H        LEU  11  -7.384 -11.830   1.635
   86    HA   LEU  11           HA       LEU  11  -4.533 -11.224   1.710
   87   1HB   LEU  11          2HB       LEU  11  -6.021 -11.410  -0.704
   88   2HB   LEU  11          1HB       LEU  11  -5.639  -9.722  -0.442
   89    HG   LEU  11           HG       LEU  11  -3.384 -11.588  -0.077
   90   1HD1  LEU  11          1HD1      LEU  11  -3.011 -11.961  -2.409
   91   2HD1  LEU  11          2HD1      LEU  11  -4.444 -11.027  -2.837
   92   3HD1  LEU  11          3HD1      LEU  11  -4.614 -12.570  -2.000
   93   1HD2  LEU  11          1HD2      LEU  11  -3.511  -9.160  -1.821
   94   2HD2  LEU  11          2HD2      LEU  11  -2.139  -9.827  -0.936
   95   3HD2  LEU  11          3HD2      LEU  11  -3.436  -9.009  -0.066
   96    H    GLU  12           H        GLU  12  -4.109  -8.885   1.789
   97    HA   GLU  12           HA       GLU  12  -6.381  -7.253   2.639
   98   1HB   GLU  12          2HB       GLU  12  -4.288  -8.285   4.375
   99   2HB   GLU  12          1HB       GLU  12  -4.346  -6.528   4.401
  100   1HG   GLU  12          2HG       GLU  12  -6.335  -6.471   5.455
  101   2HG   GLU  12          1HG       GLU  12  -6.939  -7.905   4.626
  102    H    ILE  13           H        ILE  13  -6.320  -5.614   1.230
  103    HA   ILE  13           HA       ILE  13  -3.705  -4.372   0.671
  104    HB   ILE  13           HB       ILE  13  -6.039  -4.418  -1.234
  105   1HG1  ILE  13          2HG1      ILE  13  -3.716  -5.943  -2.069
  106   2HG1  ILE  13          1HG1      ILE  13  -4.389  -6.578  -0.570
  107   1HG2  ILE  13          1HG2      ILE  13  -3.205  -3.456  -1.405
  108   2HG2  ILE  13          2HG2      ILE  13  -4.696  -2.581  -1.754
  109   3HG2  ILE  13          3HG2      ILE  13  -4.139  -3.846  -2.850
  110   1HD1  ILE  13          1HD1      ILE  13  -6.642  -6.493  -1.792
  111   2HD1  ILE  13          2HD1      ILE  13  -5.495  -7.762  -2.225
  112   3HD1  ILE  13          3HD1      ILE  13  -5.673  -6.343  -3.257
  113    H    CYS  14           H        CYS  14  -3.509  -2.296   1.184
  114    HA   CYS  14           HA       CYS  14  -5.960  -0.753   1.702
  115   1HB   CYS  14          2HB       CYS  14  -4.712   0.546   3.316
  116   2HB   CYS  14          1HB       CYS  14  -4.536  -1.163   3.688
  117    HG   CYS  14           HG       CYS  14  -2.123  -0.841   3.591
  118    H    CYS  15           H        CYS  15  -6.300   1.106   0.642
  119    HA   CYS  15           HA       CYS  15  -4.293   1.908  -1.335
  120   1HB   CYS  15          2HB       CYS  15  -6.155   3.174  -2.380
  121   2HB   CYS  15          1HB       CYS  15  -6.498   1.453  -2.239
  122    HG   CYS  15           HG       CYS  15  -8.041   3.701  -0.883
  123    H    TYR  16           H        TYR  16  -2.918   3.392  -0.589
  124    HA   TYR  16           HA       TYR  16  -3.841   5.410   1.309
  125   1HB   TYR  16          2HB       TYR  16  -1.688   4.117   1.638
  126   2HB   TYR  16          1HB       TYR  16  -1.033   5.010   0.270
  127    HD1  TYR  16           1HD      TYR  16  -1.427   4.972   3.776
  128    HD2  TYR  16           2HD      TYR  16  -1.174   7.620   0.456
  129    HE1  TYR  16           1HE      TYR  16  -0.778   6.798   5.290
  130    HE2  TYR  16           2HE      TYR  16  -0.524   9.453   1.960
  131    HH   TYR  16           HH       TYR  16  -0.760   9.205   5.371
  132    H    GLY  17           H        GLY  17  -4.338   7.420   0.735
  133   1HA   GLY  17          2HA       GLY  17  -3.966   9.463  -0.408
  134   2HA   GLY  17          1HA       GLY  17  -3.130   8.575  -1.673
  135    HA   PRO  18           HA       PRO  18  -7.668   9.296  -2.804
  136   1HB   PRO  18          2HB       PRO  18  -7.607  11.605  -4.155
  137   2HB   PRO  18          1HB       PRO  18  -7.730  11.573  -2.392
  138   1HG   PRO  18          2HG       PRO  18  -5.338  12.078  -4.117
  139   2HG   PRO  18          1HG       PRO  18  -5.838  12.899  -2.628
  140   1HD   PRO  18          2HD       PRO  18  -3.924  10.918  -2.750
  141   2HD   PRO  18          1HD       PRO  18  -4.855  11.323  -1.296
  142    H    PHE  19           H        PHE  19  -4.671   9.037  -4.334
  143    HA   PHE  19           HA       PHE  19  -4.002   8.220  -6.342
  144   1HB   PHE  19          2HB       PHE  19  -6.897   7.398  -6.400
  145   2HB   PHE  19          1HB       PHE  19  -5.815   7.053  -7.743
  146    HD1  PHE  19           1HD      PHE  19  -4.891   4.957  -7.776
  147    HD2  PHE  19           2HD      PHE  19  -5.788   6.754  -4.024
  148    HE1  PHE  19           1HE      PHE  19  -4.109   2.930  -6.619
  149    HE2  PHE  19           2HE      PHE  19  -5.008   4.731  -2.863
  150    HZ   PHE  19           HZ       PHE  19  -4.166   2.815  -4.161
  151    H    THR  20           H        THR  20  -7.239   9.196  -7.376
  152    HA   THR  20           HA       THR  20  -6.127  11.510  -8.768
  153    HB   THR  20           HB       THR  20  -7.362  10.833 -10.858
  154    HG1  THR  20           1HG      THR  20  -8.329   8.967 -10.955
  155   1HG2  THR  20          1HG2      THR  20  -4.826  10.057 -10.030
  156   2HG2  THR  20          2HG2      THR  20  -5.454  10.079 -11.678
  157   3HG2  THR  20          3HG2      THR  20  -5.553   8.604 -10.716
  158    H    ASN  21           H        ASN  21  -9.196   9.717  -8.933
  159    HA   ASN  21           HA       ASN  21 -10.680  11.439  -7.294
  160   1HB   ASN  21          2HB       ASN  21 -10.209  12.419  -9.981
  161   2HB   ASN  21          1HB       ASN  21 -11.930  12.183  -9.693
  162   1HD2  ASN  21          1HD2      ASN  21 -12.274  14.412  -9.771
  163   2HD2  ASN  21          2HD2      ASN  21 -11.837  15.444  -8.456
  164    H    MET  22           H        MET  22 -10.493   8.706  -7.621
  165    HA   MET  22           HA       MET  22 -13.178   7.925  -7.715
  166   1HB   MET  22          2HB       MET  22 -12.109   8.196 -10.277
  167   2HB   MET  22          1HB       MET  22 -12.047   6.468  -9.959
  168   1HG   MET  22          2HG       MET  22 -14.457   6.567  -9.342
  169   2HG   MET  22          1HG       MET  22 -14.468   8.248  -9.870
  170   1HE   MET  22          1HE       MET  22 -16.357   7.745 -11.044
  171   2HE   MET  22          2HE       MET  22 -16.618   6.289 -12.004
  172   3HE   MET  22          3HE       MET  22 -16.144   7.793 -12.795
  173    HA   PRO  23           HA       PRO  23 -10.377   3.903  -7.639
  174   1HB   PRO  23          2HB       PRO  23  -7.674   4.544  -7.496
  175   2HB   PRO  23          1HB       PRO  23  -8.510   3.946  -8.931
  176   1HG   PRO  23          2HG       PRO  23  -7.801   6.745  -8.178
  177   2HG   PRO  23          1HG       PRO  23  -7.771   5.968  -9.771
  178   1HD   PRO  23          2HD       PRO  23  -9.735   7.644  -9.084
  179   2HD   PRO  23          1HD       PRO  23 -10.062   6.201 -10.066
  180    H    THR  24           H        THR  24 -11.409   4.232  -5.574
  181    HA   THR  24           HA       THR  24  -9.468   4.425  -3.427
  182    HB   THR  24           HB       THR  24 -11.914   5.969  -2.845
  183    HG1  THR  24           1HG      THR  24 -11.362   7.724  -4.024
  184   1HG2  THR  24          1HG2      THR  24  -9.385   5.710  -1.727
  185   2HG2  THR  24          2HG2      THR  24 -10.651   6.845  -1.258
  186   3HG2  THR  24          3HG2      THR  24  -9.418   7.331  -2.421
  187    H    ASP  25           H        ASP  25 -13.022   4.529  -3.686
  188    HA   ASP  25           HA       ASP  25 -13.235   2.359  -1.769
  189   1HB   ASP  25          2HB       ASP  25 -14.770   4.511  -2.050
  190   2HB   ASP  25          1HB       ASP  25 -15.617   3.472  -3.191
  191    H    GLN  26           H        GLN  26 -13.505   2.947  -5.169
  192    HA   GLN  26           HA       GLN  26 -14.814   0.489  -5.827
  193   1HB   GLN  26          2HB       GLN  26 -14.354   2.837  -7.151
  194   2HB   GLN  26          1HB       GLN  26 -13.164   1.782  -7.895
  195   1HG   GLN  26          2HG       GLN  26 -15.208   0.151  -8.100
  196   2HG   GLN  26          1HG       GLN  26 -16.129   1.648  -7.962
  197   1HE2  GLN  26          1HE2      GLN  26 -13.115   0.725  -9.596
  198   2HE2  GLN  26          2HE2      GLN  26 -13.577   1.314 -11.151
  199    H    LEU  27           H        LEU  27 -11.551   1.547  -5.309
  200    HA   LEU  27           HA       LEU  27 -10.262  -0.639  -6.615
  201   1HB   LEU  27          2HB       LEU  27  -9.163   1.534  -6.187
  202   2HB   LEU  27          1HB       LEU  27  -9.220   1.210  -4.465
  203    HG   LEU  27           HG       LEU  27  -7.792  -0.826  -4.903
  204   1HD1  LEU  27          1HD1      LEU  27  -7.527   0.478  -7.608
  205   2HD1  LEU  27          2HD1      LEU  27  -8.231  -1.102  -7.265
  206   3HD1  LEU  27          3HD1      LEU  27  -6.509  -0.829  -7.003
  207   1HD2  LEU  27          1HD2      LEU  27  -5.847   0.379  -4.660
  208   2HD2  LEU  27          2HD2      LEU  27  -7.057   1.581  -4.209
  209   3HD2  LEU  27          3HD2      LEU  27  -6.340   1.614  -5.820
  210    H    GLU  28           H        GLU  28 -10.900   0.145  -3.189
  211    HA   GLU  28           HA       GLU  28  -9.869  -2.291  -2.191
  212   1HB   GLU  28          2HB       GLU  28 -10.987  -1.715  -0.104
  213   2HB   GLU  28          1HB       GLU  28 -10.171  -0.312  -0.779
  214   1HG   GLU  28          2HG       GLU  28 -12.099   0.732  -0.348
  215   2HG   GLU  28          1HG       GLU  28 -12.642  -0.028  -1.843
  216    H    TRP  29           H        TRP  29 -12.922  -1.398  -3.566
  217    HA   TRP  29           HA       TRP  29 -14.402  -3.645  -2.604
  218   1HB   TRP  29          2HB       TRP  29 -15.805  -1.926  -3.309
  219   2HB   TRP  29          1HB       TRP  29 -14.806  -1.545  -4.706
  220    HD1  TRP  29           HD       TRP  29 -17.164  -4.395  -3.555
  221    HE1  TRP  29           1HE      TRP  29 -18.389  -5.304  -5.629
  222    HE3  TRP  29           3HE      TRP  29 -14.882  -1.564  -7.141
  223    HZ2  TRP  29           2HZ      TRP  29 -18.382  -4.876  -8.420
  224    HZ3  TRP  29           3HZ      TRP  29 -15.545  -1.874  -9.490
  225    HH2  TRP  29           HH       TRP  29 -17.258  -3.498 -10.115
  226    H    MET  30           H        MET  30 -12.846  -2.831  -5.665
  227    HA   MET  30           HA       MET  30 -13.332  -5.165  -7.073
  228   1HB   MET  30          2HB       MET  30 -11.642  -2.865  -7.342
  229   2HB   MET  30          1HB       MET  30 -10.719  -4.302  -7.754
  230   1HG   MET  30          2HG       MET  30 -12.551  -4.948  -9.311
  231   2HG   MET  30          1HG       MET  30 -13.305  -3.389  -8.983
  232   1HE   MET  30          1HE       MET  30 -12.043  -1.338  -8.943
  233   2HE   MET  30          2HE       MET  30 -11.952  -0.883 -10.645
  234   3HE   MET  30          3HE       MET  30 -10.476  -1.027  -9.691
  235    H    VAL  31           H        VAL  31 -10.567  -4.403  -4.937
  236    HA   VAL  31           HA       VAL  31  -9.252  -6.876  -5.269
  237    HB   VAL  31           HB       VAL  31  -8.121  -6.377  -3.127
  238   1HG1  VAL  31          1HG1      VAL  31  -6.765  -5.184  -4.424
  239   2HG1  VAL  31          2HG1      VAL  31  -7.752  -3.758  -4.102
  240   3HG1  VAL  31          3HG1      VAL  31  -8.105  -4.779  -5.497
  241   1HG2  VAL  31          1HG2      VAL  31  -8.597  -4.245  -1.988
  242   2HG2  VAL  31          2HG2      VAL  31  -9.938  -5.386  -1.894
  243   3HG2  VAL  31          3HG2      VAL  31 -10.003  -4.039  -3.029
  244    H    GLN  32           H        GLN  32 -11.613  -5.738  -2.911
  245    HA   GLN  32           HA       GLN  32 -11.768  -7.995  -1.286
  246   1HB   GLN  32          2HB       GLN  32 -13.311  -5.591  -1.740
  247   2HB   GLN  32          1HB       GLN  32 -14.376  -6.959  -1.458
  248   1HG   GLN  32          2HG       GLN  32 -13.517  -7.341   0.673
  249   2HG   GLN  32          1HG       GLN  32 -12.072  -6.380   0.363
  250   1HE2  GLN  32          1HE2      GLN  32 -12.921  -4.053  -0.526
  251   2HE2  GLN  32          2HE2      GLN  32 -13.964  -3.269   0.607
  252    H    LEU  33           H        LEU  33 -13.263  -7.240  -4.353
  253    HA   LEU  33           HA       LEU  33 -15.018  -9.474  -4.453
  254   1HB   LEU  33          2HB       LEU  33 -15.181  -7.323  -5.788
  255   2HB   LEU  33          1HB       LEU  33 -13.894  -7.952  -6.798
  256    HG   LEU  33           HG       LEU  33 -15.274  -9.759  -7.563
  257   1HD1  LEU  33          1HD1      LEU  33 -16.974  -8.956  -5.275
  258   2HD1  LEU  33          2HD1      LEU  33 -16.605 -10.560  -5.909
  259   3HD1  LEU  33          3HD1      LEU  33 -17.792  -9.541  -6.724
  260   1HD2  LEU  33          1HD2      LEU  33 -16.522  -8.534  -8.992
  261   2HD2  LEU  33          2HD2      LEU  33 -15.649  -7.193  -8.251
  262   3HD2  LEU  33          3HD2      LEU  33 -17.276  -7.596  -7.702
  263    H    CYS  34           H        CYS  34 -11.657  -9.057  -5.003
  264    HA   CYS  34           HA       CYS  34 -11.416 -11.477  -6.603
  265   1HB   CYS  34          2HB       CYS  34  -9.383  -9.441  -5.684
  266   2HB   CYS  34          1HB       CYS  34  -8.980 -10.870  -6.629
  267    HG   CYS  34           HG       CYS  34 -10.877  -9.625  -8.341
  268    H    GLY  35           H        GLY  35 -11.660 -10.810  -3.367
  269   1HA   GLY  35          2HA       GLY  35 -11.562 -12.841  -1.954
  270   2HA   GLY  35          1HA       GLY  35  -9.990 -13.144  -2.671
  271    H    ALA  36           H        ALA  36  -9.204 -10.334  -2.562
  272    HA   ALA  36           HA       ALA  36  -7.939 -10.319  -0.052
  273   1HB   ALA  36          1HB       ALA  36  -8.366  -8.056  -1.995
  274   2HB   ALA  36          2HB       ALA  36  -6.999  -9.171  -1.965
  275   3HB   ALA  36          3HB       ALA  36  -7.242  -8.040  -0.635
  276    H    SER  37           H        SER  37  -8.063  -8.102   1.221
  277    HA   SER  37           HA       SER  37 -10.866  -7.448   1.786
  278   1HB   SER  37          2HB       SER  37  -9.254  -9.084   3.442
  279   2HB   SER  37          1HB       SER  37  -9.399  -7.528   4.258
  280    HG   SER  37           HG       SER  37 -11.334  -8.115   4.780
  281    H    VAL  38           H        VAL  38 -11.227  -5.346   2.359
  282    HA   VAL  38           HA       VAL  38  -9.158  -3.462   1.813
  283    HB   VAL  38           HB       VAL  38 -11.499  -2.976   1.277
  284   1HG1  VAL  38          1HG1      VAL  38 -12.245  -4.092   3.528
  285   2HG1  VAL  38          2HG1      VAL  38 -13.204  -2.803   2.800
  286   3HG1  VAL  38          3HG1      VAL  38 -12.117  -2.443   4.142
  287   1HG2  VAL  38          1HG2      VAL  38 -11.288  -0.739   1.608
  288   2HG2  VAL  38          2HG2      VAL  38  -9.664  -1.221   2.097
  289   3HG2  VAL  38          3HG2      VAL  38 -10.899  -0.916   3.318
  290    H    VAL  39           H        VAL  39  -7.678  -2.688   3.156
  291    HA   VAL  39           HA       VAL  39  -8.002  -3.147   6.032
  292    HB   VAL  39           HB       VAL  39  -5.491  -2.160   4.715
  293   1HG1  VAL  39          1HG1      VAL  39  -5.632  -4.021   7.035
  294   2HG1  VAL  39          2HG1      VAL  39  -5.958  -2.303   7.275
  295   3HG1  VAL  39          3HG1      VAL  39  -4.404  -2.825   6.622
  296   1HG2  VAL  39          1HG2      VAL  39  -6.751  -4.762   4.386
  297   2HG2  VAL  39          2HG2      VAL  39  -5.117  -4.865   5.039
  298   3HG2  VAL  39          3HG2      VAL  39  -5.403  -4.038   3.509
  299    H    LYS  40           H        LYS  40  -8.518  -1.531   7.349
  300    HA   LYS  40           HA       LYS  40  -9.048   1.069   6.487
  301   1HB   LYS  40          2HB       LYS  40  -8.956  -0.342   9.064
  302   2HB   LYS  40          1HB       LYS  40  -8.672   1.389   9.174
  303   1HG   LYS  40          2HG       LYS  40 -10.939   1.324   9.405
  304   2HG   LYS  40          1HG       LYS  40 -10.807   1.517   7.656
  305   1HD   LYS  40          2HD       LYS  40 -10.822  -1.079   7.626
  306   2HD   LYS  40          1HD       LYS  40 -11.503  -0.922   9.246
  307   1HE   LYS  40          2HE       LYS  40 -13.327   0.424   8.373
  308   2HE   LYS  40          1HE       LYS  40 -12.629   0.355   6.756
  309   1HZ   LYS  40          1HZ       LYS  40 -13.895  -1.814   8.307
  310   2HZ   LYS  40          2HZ       LYS  40 -12.845  -2.159   7.027
  311   3HZ   LYS  40          3HZ       LYS  40 -14.260  -1.278   6.744
  312    H    GLU  41           H        GLU  41  -6.271  -0.189   8.292
  313    HA   GLU  41           HA       GLU  41  -4.690   2.073   7.308
  314   1HB   GLU  41          2HB       GLU  41  -4.806   1.178  10.193
  315   2HB   GLU  41          1HB       GLU  41  -3.635   2.320   9.546
  316   1HG   GLU  41          2HG       GLU  41  -5.277   3.948   9.151
  317   2HG   GLU  41          1HG       GLU  41  -6.590   2.786   9.339
  318    H    LEU  42           H        LEU  42  -2.290   1.701   7.896
  319    HA   LEU  42           HA       LEU  42  -1.487  -0.735   6.712
  320   1HB   LEU  42          2HB       LEU  42   0.246   1.131   8.326
  321   2HB   LEU  42          1HB       LEU  42   0.768   0.000   7.091
  322    HG   LEU  42           HG       LEU  42  -1.056   2.312   6.466
  323   1HD1  LEU  42          1HD1      LEU  42   1.484   2.640   7.439
  324   2HD1  LEU  42          2HD1      LEU  42   0.629   3.776   6.397
  325   3HD1  LEU  42          3HD1      LEU  42   1.742   2.604   5.695
  326   1HD2  LEU  42          1HD2      LEU  42  -0.467   0.147   4.983
  327   2HD2  LEU  42          2HD2      LEU  42   0.862   1.209   4.517
  328   3HD2  LEU  42          3HD2      LEU  42  -0.806   1.736   4.299
  329    H    SER  43           H        SER  43  -1.213   0.461  10.053
  330    HA   SER  43           HA       SER  43  -0.005  -1.808  11.147
  331   1HB   SER  43          2HB       SER  43  -0.259   0.434  12.264
  332   2HB   SER  43          1HB       SER  43  -1.943   0.018  12.580
  333    HG   SER  43           HG       SER  43   0.206  -1.632  13.394
  334    H    SER  44           H        SER  44  -3.243  -1.300  10.096
  335    HA   SER  44           HA       SER  44  -4.602  -3.135  11.731
  336   1HB   SER  44          2HB       SER  44  -5.209  -1.503   9.480
  337   2HB   SER  44          1HB       SER  44  -5.765  -3.137   9.119
  338    HG   SER  44           HG       SER  44  -7.415  -2.232  10.215
  339    H    PHE  45           H        PHE  45  -2.436  -3.609   9.079
  340    HA   PHE  45           HA       PHE  45  -3.237  -6.060   8.071
  341   1HB   PHE  45          2HB       PHE  45  -0.485  -4.883   8.445
  342   2HB   PHE  45          1HB       PHE  45  -0.752  -6.416   7.623
  343    HD1  PHE  45           1HD      PHE  45   0.057  -3.261   6.920
  344    HD2  PHE  45           2HD      PHE  45  -3.035  -6.028   5.977
  345    HE1  PHE  45           1HE      PHE  45  -0.385  -2.047   4.826
  346    HE2  PHE  45           2HE      PHE  45  -3.479  -4.821   3.879
  347    HZ   PHE  45           HZ       PHE  45  -2.155  -2.827   3.305
  348    H    THR  46           H        THR  46  -3.707  -7.846   9.151
  349    HA   THR  46           HA       THR  46  -2.744  -8.414  11.761
  350    HB   THR  46           HB       THR  46  -4.028 -10.366   9.849
  351    HG1  THR  46           1HG      THR  46  -5.403  -8.656   9.911
  352   1HG2  THR  46          1HG2      THR  46  -3.303 -11.481  11.816
  353   2HG2  THR  46          2HG2      THR  46  -5.048 -11.251  11.940
  354   3HG2  THR  46          3HG2      THR  46  -3.954 -10.207  12.847
  355    H    LEU  47           H        LEU  47  -1.747  -9.343   8.543
  356    HA   LEU  47           HA       LEU  47   0.069 -10.463   7.757
  357   1HB   LEU  47          2HB       LEU  47   1.085  -8.829   9.528
  358   2HB   LEU  47          1HB       LEU  47   1.355 -10.294  10.454
  359    HG   LEU  47           HG       LEU  47   2.334 -10.113   7.630
  360   1HD1  LEU  47          1HD1      LEU  47   3.580  -8.887  10.070
  361   2HD1  LEU  47          2HD1      LEU  47   3.288  -8.152   8.494
  362   3HD1  LEU  47          3HD1      LEU  47   4.537  -9.384   8.675
  363   1HD2  LEU  47          1HD2      LEU  47   3.938 -11.733   8.379
  364   2HD2  LEU  47          2HD2      LEU  47   2.330 -12.267   8.870
  365   3HD2  LEU  47          3HD2      LEU  47   3.419 -11.540  10.052
  366    H    GLY  48           H        GLY  48  -1.430 -12.329   7.764
  367   1HA   GLY  48          2HA       GLY  48  -0.563 -14.388   9.700
  368   2HA   GLY  48          1HA       GLY  48  -2.174 -14.327   9.004
  369    H    THR  49           H        THR  49  -1.376 -16.655   8.632
  370    HA   THR  49           HA       THR  49   0.422 -17.007   6.405
  371    HB   THR  49           HB       THR  49  -0.097 -19.398   6.648
  372    HG1  THR  49           1HG      THR  49  -1.538 -20.026   8.307
  373   1HG2  THR  49          1HG2      THR  49   1.228 -17.871   8.518
  374   2HG2  THR  49          2HG2      THR  49   1.262 -19.629   8.384
  375   3HG2  THR  49          3HG2      THR  49   0.121 -18.849   9.481
  376    H    GLY  50           H        GLY  50  -3.026 -16.843   6.925
  377   1HA   GLY  50          2HA       GLY  50  -3.570 -17.730   4.191
  378   2HA   GLY  50          1HA       GLY  50  -4.769 -17.417   5.438
  379    H    VAL  51           H        VAL  51  -3.467 -14.808   6.085
  380    HA   VAL  51           HA       VAL  51  -4.513 -13.303   3.778
  381    HB   VAL  51           HB       VAL  51  -4.802 -11.430   5.498
  382   1HG1  VAL  51          1HG1      VAL  51  -6.438 -13.865   5.138
  383   2HG1  VAL  51          2HG1      VAL  51  -6.832 -12.173   4.829
  384   3HG1  VAL  51          3HG1      VAL  51  -6.883 -12.804   6.475
  385   1HG2  VAL  51          1HG2      VAL  51  -5.075 -12.121   7.816
  386   2HG2  VAL  51          2HG2      VAL  51  -3.434 -12.451   7.261
  387   3HG2  VAL  51          3HG2      VAL  51  -4.599 -13.767   7.396
  388    H    HIS  52           H        HIS  52  -2.997 -12.332   2.616
  389    HA   HIS  52           HA       HIS  52  -0.445 -11.647   3.875
  390   1HB   HIS  52          2HB       HIS  52  -0.936 -12.904   1.520
  391   2HB   HIS  52          1HB       HIS  52  -0.774 -11.240   0.966
  392    HD1  HIS  52           1HD      HIS  52   1.556 -10.238   0.931
  393    HD2  HIS  52           2HD      HIS  52   1.420 -13.995   2.703
  394    HE1  HIS  52           1HE      HIS  52   3.955 -10.929   1.227
  395    HE2  HIS  52           2HE      HIS  52   3.848 -13.231   2.245
  396    HA   PRO  53           HA       PRO  53  -1.674  -7.368   3.805
  397   1HB   PRO  53          2HB       PRO  53   0.586  -6.280   4.739
  398   2HB   PRO  53          1HB       PRO  53  -0.455  -7.271   5.770
  399   1HG   PRO  53          2HG       PRO  53   2.085  -8.009   4.371
  400   2HG   PRO  53          1HG       PRO  53   1.549  -8.422   6.010
  401   1HD   PRO  53          2HD       PRO  53   1.352 -10.108   3.843
  402   2HD   PRO  53          1HD       PRO  53   0.320 -10.206   5.283
  403    H    ILE  54           H        ILE  54  -1.686  -5.838   2.276
  404    HA   ILE  54           HA       ILE  54   0.657  -5.469   0.554
  405    HB   ILE  54           HB       ILE  54  -2.091  -5.570  -0.662
  406   1HG1  ILE  54          2HG1      ILE  54  -1.630  -7.780   0.350
  407   2HG1  ILE  54          1HG1      ILE  54  -1.663  -7.843  -1.409
  408   1HG2  ILE  54          1HG2      ILE  54   0.586  -5.013  -1.581
  409   2HG2  ILE  54          2HG2      ILE  54  -0.959  -4.768  -2.395
  410   3HG2  ILE  54          3HG2      ILE  54  -0.145  -6.329  -2.500
  411   1HD1  ILE  54          1HD1      ILE  54   0.991  -7.389  -0.280
  412   2HD1  ILE  54          2HD1      ILE  54   0.462  -8.500  -1.543
  413   3HD1  ILE  54          3HD1      ILE  54   0.262  -8.934   0.154
  414    H    VAL  55           H        VAL  55   0.930  -3.381  -0.186
  415    HA   VAL  55           HA       VAL  55  -1.098  -1.418   0.676
  416    HB   VAL  55           HB       VAL  55   1.892  -0.966   0.650
  417   1HG1  VAL  55          1HG1      VAL  55   1.510   1.189   1.161
  418   2HG1  VAL  55          2HG1      VAL  55   0.129   0.806   2.190
  419   3HG1  VAL  55          3HG1      VAL  55  -0.073   0.895   0.439
  420   1HG2  VAL  55          1HG2      VAL  55   0.513  -0.877   3.224
  421   2HG2  VAL  55          2HG2      VAL  55   2.044  -1.632   2.781
  422   3HG2  VAL  55          3HG2      VAL  55   0.525  -2.476   2.480
  423    H    VAL  56           H        VAL  56  -1.686   0.117  -0.786
  424    HA   VAL  56           HA       VAL  56  -0.243   0.117  -3.354
  425    HB   VAL  56           HB       VAL  56  -3.201   0.521  -2.985
  426   1HG1  VAL  56          1HG1      VAL  56  -2.462   1.727  -4.898
  427   2HG1  VAL  56          2HG1      VAL  56  -3.224   0.246  -5.476
  428   3HG1  VAL  56          3HG1      VAL  56  -1.466   0.375  -5.437
  429   1HG2  VAL  56          1HG2      VAL  56  -1.715  -1.868  -4.061
  430   2HG2  VAL  56          2HG2      VAL  56  -3.467  -1.667  -4.040
  431   3HG2  VAL  56          3HG2      VAL  56  -2.576  -1.787  -2.524
  432    H    VAL  57           H        VAL  57  -0.388   2.096  -4.600
  433    HA   VAL  57           HA       VAL  57  -1.206   4.522  -3.232
  434    HB   VAL  57           HB       VAL  57   1.593   4.595  -4.244
  435   1HG1  VAL  57          1HG1      VAL  57  -0.168   6.166  -2.540
  436   2HG1  VAL  57          2HG1      VAL  57   1.274   6.652  -3.433
  437   3HG1  VAL  57          3HG1      VAL  57   1.429   5.929  -1.831
  438   1HG2  VAL  57          1HG2      VAL  57   0.828   3.359  -1.602
  439   2HG2  VAL  57          2HG2      VAL  57   2.448   3.932  -1.995
  440   3HG2  VAL  57          3HG2      VAL  57   1.734   2.609  -2.915
  441    H    GLN  58           H        GLN  58  -0.164   6.439  -4.790
  442    HA   GLN  58           HA       GLN  58   0.005   5.885  -7.541
  443   1HB   GLN  58          2HB       GLN  58  -2.606   5.728  -6.602
  444   2HB   GLN  58          1HB       GLN  58  -2.503   7.338  -7.301
  445   1HG   GLN  58          2HG       GLN  58  -1.612   4.882  -8.777
  446   2HG   GLN  58          1HG       GLN  58  -3.272   5.473  -8.825
  447   1HE2  GLN  58          1HE2      GLN  58  -3.458   7.842  -9.395
  448   2HE2  GLN  58          2HE2      GLN  58  -2.447   8.412 -10.676
  449    HA   PRO  59           HA       PRO  59   1.495  10.042  -6.278
  450   1HB   PRO  59          2HB       PRO  59   3.634  10.035  -7.954
  451   2HB   PRO  59          1HB       PRO  59   3.662   9.284  -6.355
  452   1HG   PRO  59          2HG       PRO  59   3.260   8.014  -9.036
  453   2HG   PRO  59          1HG       PRO  59   4.249   7.460  -7.672
  454   1HD   PRO  59          2HD       PRO  59   1.804   6.434  -8.198
  455   2HD   PRO  59          1HD       PRO  59   2.435   6.588  -6.546
  456    H    ASP  60           H        ASP  60  -0.467  10.810  -7.348
  457    HA   ASP  60           HA       ASP  60   0.175  12.132  -9.853
  458   1HB   ASP  60          2HB       ASP  60  -1.133   9.808 -10.110
  459   2HB   ASP  60          1HB       ASP  60  -2.510  10.862  -9.800
  460    H    ALA  61           H        ALA  61  -2.297  11.573  -7.384
  461    HA   ALA  61           HA       ALA  61  -3.162  14.365  -7.662
  462   1HB   ALA  61          1HB       ALA  61  -5.108  13.601  -6.244
  463   2HB   ALA  61          2HB       ALA  61  -4.500  11.959  -6.451
  464   3HB   ALA  61          3HB       ALA  61  -5.004  12.896  -7.857
  465    H    TRP  62           H        TRP  62  -0.697  13.541  -6.297
  466    HA   TRP  62           HA       TRP  62  -1.231  13.880  -3.473
  467   1HB   TRP  62          2HB       TRP  62   1.047  13.086  -5.130
  468   2HB   TRP  62          1HB       TRP  62   1.500  14.132  -3.789
  469    HD1  TRP  62           HD       TRP  62  -1.387  11.688  -3.331
  470    HE1  TRP  62           1HE      TRP  62  -0.677   9.865  -1.658
  471    HE3  TRP  62           3HE      TRP  62   3.569  12.866  -2.902
  472    HZ2  TRP  62           2HZ      TRP  62   1.673   9.036  -0.333
  473    HZ3  TRP  62           3HZ      TRP  62   4.979  11.508  -1.411
  474    HH2  TRP  62           HH       TRP  62   4.049   9.634  -0.154
  475    H    THR  63           H        THR  63  -0.229  15.822  -6.185
  476    HA   THR  63           HA       THR  63  -0.023  18.074  -6.439
  477    HB   THR  63           HB       THR  63  -0.797  18.533  -3.580
  478    HG1  THR  63           1HG      THR  63  -2.378  17.163  -4.095
  479   1HG2  THR  63          1HG2      THR  63  -0.430  20.237  -5.713
  480   2HG2  THR  63          2HG2      THR  63  -1.289  20.597  -4.216
  481   3HG2  THR  63          3HG2      THR  63  -2.179  20.034  -5.631
  482    H    GLU  64           H        GLU  64   0.838  17.560  -3.032
  483    HA   GLU  64           HA       GLU  64   3.463  18.761  -3.608
  484   1HB   GLU  64          2HB       GLU  64   1.636  19.581  -1.767
  485   2HB   GLU  64          1HB       GLU  64   2.621  18.500  -0.792
  486   1HG   GLU  64          2HG       GLU  64   4.257  19.985  -0.652
  487   2HG   GLU  64          1HG       GLU  64   4.268  20.238  -2.397
  488    H    ASP  65           H        ASP  65   4.826  17.122  -4.022
  489    HA   ASP  65           HA       ASP  65   4.655  14.540  -2.908
  490   1HB   ASP  65          2HB       ASP  65   5.993  15.538  -4.996
  491   2HB   ASP  65          1HB       ASP  65   7.301  15.553  -3.817
  492    H    ASN  66           H        ASN  66   4.451  14.833  -0.652
  493    HA   ASN  66           HA       ASN  66   6.308  16.217   0.947
  494   1HB   ASN  66          2HB       ASN  66   3.985  15.423   1.609
  495   2HB   ASN  66          1HB       ASN  66   4.694  13.826   1.834
  496   1HD2  ASN  66          1HD2      ASN  66   4.977  17.195   2.844
  497   2HD2  ASN  66          2HD2      ASN  66   5.563  16.855   4.433
  498    H    GLY  67           H        GLY  67   6.296  12.997  -0.398
  499   1HA   GLY  67          2HA       GLY  67   8.752  12.267  -0.642
  500   2HA   GLY  67          1HA       GLY  67   8.737  12.341   1.113
  501    H    PHE  68           H        PHE  68   8.626  10.255  -1.359
  502    HA   PHE  68           HA       PHE  68   6.580   8.481  -0.312
  503   1HB   PHE  68          2HB       PHE  68   7.212   8.859  -2.811
  504   2HB   PHE  68          1HB       PHE  68   8.520   7.729  -2.476
  505    HD1  PHE  68           1HD      PHE  68   8.034   5.404  -1.889
  506    HD2  PHE  68           2HD      PHE  68   4.941   8.130  -2.949
  507    HE1  PHE  68           1HE      PHE  68   6.495   3.517  -2.233
  508    HE2  PHE  68           2HE      PHE  68   3.396   6.246  -3.296
  509    HZ   PHE  68           HZ       PHE  68   4.173   3.937  -2.933
  510    H    HIS  69           H        HIS  69   9.490   9.196   0.822
  511    HA   HIS  69           HA       HIS  69  10.628   6.566   1.102
  512   1HB   HIS  69          2HB       HIS  69  11.334   9.263   2.246
  513   2HB   HIS  69          1HB       HIS  69  12.189   7.795   2.707
  514    HD1  HIS  69           1HD      HIS  69  13.715   6.699   0.920
  515    HD2  HIS  69           2HD      HIS  69  11.915  10.239  -0.304
  516    HE1  HIS  69           1HE      HIS  69  14.925   7.379  -1.177
  517    HE2  HIS  69           2HE      HIS  69  13.745   9.463  -1.959
  518    H    ALA  70           H        ALA  70   7.999   7.943   2.504
  519    HA   ALA  70           HA       ALA  70   8.480   6.702   5.124
  520   1HB   ALA  70          1HB       ALA  70   7.465   9.187   4.502
  521   2HB   ALA  70          2HB       ALA  70   7.342   8.373   6.061
  522   3HB   ALA  70          3HB       ALA  70   6.028   8.243   4.892
  523    H    ILE  71           H        ILE  71   6.943   6.125   2.192
  524    HA   ILE  71           HA       ILE  71   4.545   4.899   3.013
  525    HB   ILE  71           HB       ILE  71   6.111   4.055   0.590
  526   1HG1  ILE  71          2HG1      ILE  71   6.148   6.437   0.454
  527   2HG1  ILE  71          1HG1      ILE  71   4.840   5.902  -0.593
  528   1HG2  ILE  71          1HG2      ILE  71   3.676   4.007  -0.287
  529   2HG2  ILE  71          2HG2      ILE  71   3.238   4.019   1.421
  530   3HG2  ILE  71          3HG2      ILE  71   4.231   2.714   0.775
  531   1HD1  ILE  71          1HD1      ILE  71   4.453   6.891   2.219
  532   2HD1  ILE  71          2HD1      ILE  71   3.202   6.531   1.029
  533   3HD1  ILE  71          3HD1      ILE  71   4.296   7.890   0.774
  534    H    GLY  72           H        GLY  72   7.763   3.552   2.333
  535   1HA   GLY  72          2HA       GLY  72   6.935   0.899   3.149
  536   2HA   GLY  72          1HA       GLY  72   8.546   1.381   2.637
  537    H    GLN  73           H        GLN  73   8.451   3.657   4.607
  538    HA   GLN  73           HA       GLN  73   9.581   2.195   6.812
  539   1HB   GLN  73          2HB       GLN  73  10.196   4.568   5.741
  540   2HB   GLN  73          1HB       GLN  73   9.113   5.123   7.012
  541   1HG   GLN  73          2HG       GLN  73  10.479   4.074   8.695
  542   2HG   GLN  73          1HG       GLN  73  11.519   3.370   7.457
  543   1HE2  GLN  73          1HE2      GLN  73  13.198   4.470   8.710
  544   2HE2  GLN  73          2HE2      GLN  73  13.539   6.129   8.362
  545    H    MET  74           H        MET  74   6.495   3.446   6.040
  546    HA   MET  74           HA       MET  74   5.670   3.627   8.834
  547   1HB   MET  74          2HB       MET  74   4.472   4.435   6.219
  548   2HB   MET  74          1HB       MET  74   3.401   4.147   7.584
  549   1HG   MET  74          2HG       MET  74   4.119   5.976   8.717
  550   2HG   MET  74          1HG       MET  74   5.745   5.895   8.041
  551   1HE   MET  74          1HE       MET  74   1.991   6.722   6.010
  552   2HE   MET  74          2HE       MET  74   2.180   8.221   6.919
  553   3HE   MET  74          3HE       MET  74   2.210   6.670   7.759
  554    H    CYS  75           H        CYS  75   5.246   1.622   5.992
  555    HA   CYS  75           HA       CYS  75   3.717  -0.284   7.641
  556   1HB   CYS  75          2HB       CYS  75   2.297   0.705   5.898
  557   2HB   CYS  75          1HB       CYS  75   3.450   0.204   4.666
  558    HG   CYS  75           HG       CYS  75   1.739  -1.817   6.303
  559    H    GLU  76           H        GLU  76   4.060  -2.529   7.189
  560    HA   GLU  76           HA       GLU  76   6.745  -3.049   6.112
  561   1HB   GLU  76          2HB       GLU  76   6.736  -5.078   7.482
  562   2HB   GLU  76          1HB       GLU  76   6.447  -3.650   8.466
  563   1HG   GLU  76          2HG       GLU  76   3.911  -4.480   7.759
  564   2HG   GLU  76          1HG       GLU  76   4.786  -5.984   8.042
  565    H    ALA  77           H        ALA  77   4.363  -2.781   4.466
  566    HA   ALA  77           HA       ALA  77   4.228  -5.518   3.376
  567   1HB   ALA  77          1HB       ALA  77   2.108  -4.035   4.312
  568   2HB   ALA  77          2HB       ALA  77   2.004  -5.411   3.214
  569   3HB   ALA  77          3HB       ALA  77   2.043  -3.770   2.570
  570    HA   PRO  78           HA       PRO  78   5.641  -4.010  -0.513
  571   1HB   PRO  78          2HB       PRO  78   4.055  -5.215  -2.340
  572   2HB   PRO  78          1HB       PRO  78   5.238  -6.104  -1.376
  573   1HG   PRO  78          2HG       PRO  78   2.284  -5.842  -0.978
  574   2HG   PRO  78          1HG       PRO  78   3.308  -7.282  -0.834
  575   1HD   PRO  78          2HD       PRO  78   2.463  -5.842   1.312
  576   2HD   PRO  78          1HD       PRO  78   3.999  -6.731   1.288
  577    H    VAL  79           H        VAL  79   5.451  -1.999  -1.235
  578    HA   VAL  79           HA       VAL  79   2.840  -0.739  -1.472
  579    HB   VAL  79           HB       VAL  79   5.534   0.489  -2.062
  580   1HG1  VAL  79          1HG1      VAL  79   2.837   1.663  -1.408
  581   2HG1  VAL  79          2HG1      VAL  79   3.706   1.772  -2.939
  582   3HG1  VAL  79          3HG1      VAL  79   4.333   2.590  -1.508
  583   1HG2  VAL  79          1HG2      VAL  79   4.039   0.491   0.558
  584   2HG2  VAL  79          2HG2      VAL  79   5.551   1.331   0.216
  585   3HG2  VAL  79          3HG2      VAL  79   5.502  -0.432   0.218
  586    H    VAL  80           H        VAL  80   1.749  -0.567  -3.359
  587    HA   VAL  80           HA       VAL  80   3.269  -0.552  -5.865
  588    HB   VAL  80           HB       VAL  80   1.725  -2.181  -6.902
  589   1HG1  VAL  80          1HG1      VAL  80   2.619  -4.208  -5.659
  590   2HG1  VAL  80          2HG1      VAL  80   3.387  -3.064  -4.558
  591   3HG1  VAL  80          3HG1      VAL  80   3.812  -3.063  -6.270
  592   1HG2  VAL  80          1HG2      VAL  80   0.629  -3.679  -4.962
  593   2HG2  VAL  80          2HG2      VAL  80  -0.228  -2.370  -5.775
  594   3HG2  VAL  80          3HG2      VAL  80   0.525  -2.090  -4.205
  595    H    THR  81           H        THR  81   1.579  -0.310  -7.756
  596    HA   THR  81           HA       THR  81  -0.119   1.955  -7.009
  597    HB   THR  81           HB       THR  81  -0.008   2.660  -9.270
  598    HG1  THR  81           1HG      THR  81   0.995   0.073  -9.840
  599   1HG2  THR  81          1HG2      THR  81   2.132   2.929  -8.036
  600   2HG2  THR  81          2HG2      THR  81   2.303   2.847  -9.790
  601   3HG2  THR  81          3HG2      THR  81   2.696   1.442  -8.799
  602    H    ARG  82           H        ARG  82  -2.201   2.153  -8.285
  603    HA   ARG  82           HA       ARG  82  -3.868  -0.012  -7.700
  604   1HB   ARG  82          2HB       ARG  82  -5.398   1.257  -9.485
  605   2HB   ARG  82          1HB       ARG  82  -5.150   1.852  -7.851
  606   1HG   ARG  82          2HG       ARG  82  -3.768   3.563  -8.541
  607   2HG   ARG  82          1HG       ARG  82  -3.327   2.745 -10.038
  608   1HD   ARG  82          2HD       ARG  82  -6.173   3.502  -9.640
  609   2HD   ARG  82          1HD       ARG  82  -5.017   4.784 -10.001
  610    HE   ARG  82           HE       ARG  82  -5.976   2.753 -11.795
  611   1HH1  ARG  82          1HH1      ARG  82  -3.368   4.972 -11.121
  612   2HH1  ARG  82          2HH1      ARG  82  -2.832   5.038 -12.765
  613   1HH2  ARG  82          1HH2      ARG  82  -5.273   2.840 -13.960
  614   2HH2  ARG  82          2HH2      ARG  82  -3.914   3.829 -14.378
  615    H    GLU  83           H        GLU  83  -1.810   0.480 -10.396
  616    HA   GLU  83           HA       GLU  83  -3.087  -0.792 -12.477
  617   1HB   GLU  83          2HB       GLU  83  -0.246  -0.503 -11.651
  618   2HB   GLU  83          1HB       GLU  83  -0.601  -1.714 -12.875
  619   1HG   GLU  83          2HG       GLU  83  -1.819   0.120 -14.130
  620   2HG   GLU  83          1HG       GLU  83  -1.067   1.246 -13.001
  621    H    TRP  84           H        TRP  84  -1.215  -2.301  -9.859
  622    HA   TRP  84           HA       TRP  84  -1.344  -4.952 -10.615
  623   1HB   TRP  84          2HB       TRP  84  -0.103  -4.152  -8.652
  624   2HB   TRP  84          1HB       TRP  84  -1.612  -3.803  -7.829
  625    HD1  TRP  84           HD       TRP  84   0.241  -6.901  -9.263
  626    HE1  TRP  84           1HE      TRP  84  -0.347  -8.919  -7.776
  627    HE3  TRP  84           3HE      TRP  84  -3.076  -4.639  -6.102
  628    HZ2  TRP  84           2HZ      TRP  84  -2.001  -9.476  -5.552
  629    HZ3  TRP  84           3HZ      TRP  84  -4.116  -5.980  -4.324
  630    HH2  TRP  84           HH       TRP  84  -3.592  -8.348  -4.054
  631    H    VAL  85           H        VAL  85  -3.579  -3.256  -8.478
  632    HA   VAL  85           HA       VAL  85  -5.486  -5.237  -8.162
  633    HB   VAL  85           HB       VAL  85  -5.956  -2.257  -8.266
  634   1HG1  VAL  85          1HG1      VAL  85  -7.830  -3.016  -6.604
  635   2HG1  VAL  85          2HG1      VAL  85  -7.678  -4.555  -7.454
  636   3HG1  VAL  85          3HG1      VAL  85  -8.098  -3.092  -8.346
  637   1HG2  VAL  85          1HG2      VAL  85  -5.375  -4.061  -5.918
  638   2HG2  VAL  85          2HG2      VAL  85  -5.714  -2.331  -5.841
  639   3HG2  VAL  85          3HG2      VAL  85  -4.250  -2.908  -6.636
  640    H    LEU  86           H        LEU  86  -5.404  -2.656 -10.596
  641    HA   LEU  86           HA       LEU  86  -7.781  -3.390 -11.912
  642   1HB   LEU  86          2HB       LEU  86  -5.743  -1.443 -12.219
  643   2HB   LEU  86          1HB       LEU  86  -5.921  -2.249 -13.766
  644    HG   LEU  86           HG       LEU  86  -8.504  -1.567 -12.637
  645   1HD1  LEU  86          1HD1      LEU  86  -6.715   0.268 -11.850
  646   2HD1  LEU  86          2HD1      LEU  86  -8.379   0.658 -12.284
  647   3HD1  LEU  86          3HD1      LEU  86  -7.086   0.885 -13.460
  648   1HD2  LEU  86          1HD2      LEU  86  -7.006  -1.170 -15.189
  649   2HD2  LEU  86          2HD2      LEU  86  -8.500  -0.278 -14.902
  650   3HD2  LEU  86          3HD2      LEU  86  -8.511  -2.041 -14.893
  651    H    ASP  87           H        ASP  87  -4.389  -4.134 -12.663
  652    HA   ASP  87           HA       ASP  87  -4.886  -5.722 -14.922
  653   1HB   ASP  87          2HB       ASP  87  -2.665  -4.777 -14.268
  654   2HB   ASP  87          1HB       ASP  87  -2.574  -5.979 -12.985
  655    H    SER  88           H        SER  88  -4.916  -6.436 -11.498
  656    HA   SER  88           HA       SER  88  -5.013  -9.286 -11.838
  657   1HB   SER  88          2HB       SER  88  -5.599  -7.536  -9.440
  658   2HB   SER  88          1HB       SER  88  -5.568  -9.300  -9.401
  659    HG   SER  88           HG       SER  88  -3.535  -8.894  -8.921
  660    H    VAL  89           H        VAL  89  -7.391  -6.766 -11.046
  661    HA   VAL  89           HA       VAL  89  -9.590  -8.566 -10.887
  662    HB   VAL  89           HB       VAL  89  -9.693  -5.592 -11.407
  663   1HG1  VAL  89          1HG1      VAL  89 -11.725  -7.460 -11.421
  664   2HG1  VAL  89          2HG1      VAL  89 -11.911  -5.720 -11.197
  665   3HG1  VAL  89          3HG1      VAL  89 -11.798  -6.783  -9.795
  666   1HG2  VAL  89          1HG2      VAL  89  -9.270  -5.153  -9.243
  667   2HG2  VAL  89          2HG2      VAL  89  -8.488  -6.734  -9.255
  668   3HG2  VAL  89          3HG2      VAL  89 -10.147  -6.576  -8.677
  669    H    ALA  90           H        ALA  90  -8.054  -6.833 -13.488
  670    HA   ALA  90           HA       ALA  90 -10.184  -6.960 -15.353
  671   1HB   ALA  90          1HB       ALA  90  -8.638  -5.420 -16.018
  672   2HB   ALA  90          2HB       ALA  90  -8.112  -6.795 -16.990
  673   3HB   ALA  90          3HB       ALA  90  -7.271  -6.400 -15.491
  674    H    LEU  91           H        LEU  91  -7.211  -8.917 -15.099
  675    HA   LEU  91           HA       LEU  91  -8.396 -10.924 -16.852
  676   1HB   LEU  91          2HB       LEU  91  -6.129 -10.271 -17.344
  677   2HB   LEU  91          1HB       LEU  91  -5.627 -10.617 -15.699
  678    HG   LEU  91           HG       LEU  91  -6.805 -12.907 -17.126
  679   1HD1  LEU  91          1HD1      LEU  91  -5.679 -12.119 -19.025
  680   2HD1  LEU  91          2HD1      LEU  91  -4.579 -13.292 -18.300
  681   3HD1  LEU  91          3HD1      LEU  91  -4.296 -11.565 -18.082
  682   1HD2  LEU  91          1HD2      LEU  91  -4.387 -13.674 -16.189
  683   2HD2  LEU  91          2HD2      LEU  91  -5.866 -13.670 -15.229
  684   3HD2  LEU  91          3HD2      LEU  91  -4.739 -12.319 -15.117
  685    H    TYR  92           H        TYR  92  -8.384 -10.305 -13.597
  686    HA   TYR  92           HA       TYR  92  -8.857 -11.522 -11.738
  687   1HB   TYR  92          2HB       TYR  92 -10.257 -12.768 -13.907
  688   2HB   TYR  92          1HB       TYR  92  -9.714 -14.016 -12.791
  689    HD1  TYR  92           1HD      TYR  92 -12.576 -12.806 -13.511
  690    HD2  TYR  92           2HD      TYR  92  -9.894 -12.414 -10.227
  691    HE1  TYR  92           1HE      TYR  92 -14.471 -12.294 -12.030
  692    HE2  TYR  92           2HE      TYR  92 -11.783 -11.901  -8.741
  693    HH   TYR  92           HH       TYR  92 -14.302 -12.394  -8.726
  694    H    GLN  93           H        GLN  93  -6.566 -11.620 -11.303
  695    HA   GLN  93           HA       GLN  93  -5.665 -14.178 -10.631
  696   1HB   GLN  93          2HB       GLN  93  -5.341 -13.840 -13.306
  697   2HB   GLN  93          1HB       GLN  93  -3.802 -13.227 -12.715
  698   1HG   GLN  93          2HG       GLN  93  -3.061 -15.262 -12.178
  699   2HG   GLN  93          1HG       GLN  93  -4.610 -15.752 -11.495
  700   1HE2  GLN  93          1HE2      GLN  93  -4.413 -17.788 -12.471
  701   2HE2  GLN  93          2HE2      GLN  93  -4.689 -18.011 -14.162
  702    H    CYS  94           H        CYS  94  -3.935 -14.085  -9.250
  703    HA   CYS  94           HA       CYS  94  -3.256 -11.561  -8.169
  704   1HB   CYS  94          2HB       CYS  94  -3.292 -13.732  -6.907
  705   2HB   CYS  94          1HB       CYS  94  -1.804 -14.177  -7.736
  706    HG   CYS  94           HG       CYS  94  -2.022 -12.309  -5.360
  707    H    GLN  95           H        GLN  95  -2.447 -10.405  -9.997
  708    HA   GLN  95           HA       GLN  95  -0.212 -11.206 -11.507
  709   1HB   GLN  95          2HB       GLN  95  -1.079  -8.375 -10.901
  710   2HB   GLN  95          1HB       GLN  95  -0.096  -8.906 -12.258
  711   1HG   GLN  95          2HG       GLN  95  -2.965  -9.680 -11.781
  712   2HG   GLN  95          1HG       GLN  95  -2.413  -8.433 -12.897
  713   1HE2  GLN  95          1HE2      GLN  95  -0.602  -9.309 -14.405
  714   2HE2  GLN  95          2HE2      GLN  95  -0.961 -10.815 -15.170
  715    H    GLU  96           H        GLU  96   1.910 -10.046 -11.510
  716    HA   GLU  96           HA       GLU  96   3.119 -10.290  -8.930
  717   1HB   GLU  96          2HB       GLU  96   5.189  -9.510 -10.173
  718   2HB   GLU  96          1HB       GLU  96   4.445 -10.990 -10.761
  719   1HG   GLU  96          2HG       GLU  96   3.375  -8.664 -12.098
  720   2HG   GLU  96          1HG       GLU  96   5.129  -8.757 -12.250
  721    H    LEU  97           H        LEU  97   3.906  -8.726  -7.586
  722    HA   LEU  97           HA       LEU  97   2.811  -6.061  -7.953
  723   1HB   LEU  97          2HB       LEU  97   4.045  -7.557  -5.678
  724   2HB   LEU  97          1HB       LEU  97   3.970  -5.806  -5.612
  725    HG   LEU  97           HG       LEU  97   1.421  -6.253  -6.201
  726   1HD1  LEU  97          1HD1      LEU  97   0.790  -8.286  -4.725
  727   2HD1  LEU  97          2HD1      LEU  97   2.432  -8.827  -5.072
  728   3HD1  LEU  97          3HD1      LEU  97   1.296  -8.552  -6.393
  729   1HD2  LEU  97          1HD2      LEU  97   2.764  -5.371  -4.041
  730   2HD2  LEU  97          2HD2      LEU  97   2.016  -6.821  -3.372
  731   3HD2  LEU  97          3HD2      LEU  97   1.012  -5.563  -4.093
  732    H    ASP  98           H        ASP  98   5.896  -7.684  -7.970
  733    HA   ASP  98           HA       ASP  98   7.652  -5.571  -7.639
  734   1HB   ASP  98          2HB       ASP  98   7.778  -8.172  -9.092
  735   2HB   ASP  98          1HB       ASP  98   9.055  -6.996  -9.390
  736    H    THR  99           H        THR  99   5.742  -6.453 -10.436
  737    HA   THR  99           HA       THR  99   7.095  -4.669 -12.231
  738    HB   THR  99           HB       THR  99   4.422  -6.059 -12.491
  739    HG1  THR  99           1HG      THR  99   5.647  -7.498 -13.795
  740   1HG2  THR  99          1HG2      THR  99   6.054  -4.509 -14.459
  741   2HG2  THR  99          2HG2      THR  99   4.325  -4.413 -14.122
  742   3HG2  THR  99          3HG2      THR  99   4.981  -5.810 -14.976
  743    H    TYR 100           H        TYR 100   4.887  -4.190  -9.739
  744    HA   TYR 100           HA       TYR 100   4.298  -1.506 -10.748
  745   1HB   TYR 100          2HB       TYR 100   2.167  -3.089  -9.327
  746   2HB   TYR 100          1HB       TYR 100   1.995  -1.610 -10.265
  747    HD1  TYR 100           1HD      TYR 100   1.508  -5.074 -10.302
  748    HD2  TYR 100           2HD      TYR 100   2.708  -1.858 -12.815
  749    HE1  TYR 100           1HE      TYR 100   0.915  -6.407 -12.281
  750    HE2  TYR 100           2HE      TYR 100   2.116  -3.181 -14.801
  751    HH   TYR 100           HH       TYR 100   0.273  -5.993 -14.656
  752    H    LEU 101           H        LEU 101   6.196  -2.560  -8.806
  753    HA   LEU 101           HA       LEU 101   5.132  -1.603  -6.256
  754   1HB   LEU 101          2HB       LEU 101   6.956  -3.630  -6.999
  755   2HB   LEU 101          1HB       LEU 101   7.880  -2.427  -6.124
  756    HG   LEU 101           HG       LEU 101   5.367  -3.112  -4.798
  757   1HD1  LEU 101          1HD1      LEU 101   7.358  -5.272  -4.527
  758   2HD1  LEU 101          2HD1      LEU 101   6.401  -5.270  -6.008
  759   3HD1  LEU 101          3HD1      LEU 101   5.598  -5.328  -4.439
  760   1HD2  LEU 101          1HD2      LEU 101   8.161  -2.498  -4.158
  761   2HD2  LEU 101          2HD2      LEU 101   7.401  -3.669  -3.080
  762   3HD2  LEU 101          3HD2      LEU 101   6.678  -2.076  -3.302
  763    H    ILE 102           H        ILE 102   5.120   0.598  -6.386
  764    HA   ILE 102           HA       ILE 102   5.914   2.729  -6.352
  765    HB   ILE 102           HB       ILE 102   8.623   1.485  -5.875
  766   1HG1  ILE 102          2HG1      ILE 102   7.748   2.237  -3.418
  767   2HG1  ILE 102          1HG1      ILE 102   6.231   1.734  -4.153
  768   1HG2  ILE 102          1HG2      ILE 102   8.839   3.799  -6.373
  769   2HG2  ILE 102          2HG2      ILE 102   8.991   3.631  -4.624
  770   3HG2  ILE 102          3HG2      ILE 102   7.483   4.216  -5.324
  771   1HD1  ILE 102          1HD1      ILE 102   8.649  -0.024  -4.236
  772   2HD1  ILE 102          2HD1      ILE 102   6.950  -0.460  -4.420
  773   3HD1  ILE 102          3HD1      ILE 102   7.576   0.006  -2.838
  774    HA   PRO 103           HA       PRO 103   7.252   2.617 -10.707
  775   1HB   PRO 103          2HB       PRO 103   5.877   4.859 -11.429
  776   2HB   PRO 103          1HB       PRO 103   5.168   3.244 -11.394
  777   1HG   PRO 103          2HG       PRO 103   4.907   5.470  -9.436
  778   2HG   PRO 103          1HG       PRO 103   3.712   4.264  -9.935
  779   1HD   PRO 103          2HD       PRO 103   5.129   4.162  -7.583
  780   2HD   PRO 103          1HD       PRO 103   4.427   2.746  -8.387
  781    H    GLN 104           H        GLN 104   6.672   5.977  -9.793
  782    HA   GLN 104           HA       GLN 104   9.343   6.682 -10.616
  783   1HB   GLN 104          2HB       GLN 104   7.252   8.485  -9.395
  784   2HB   GLN 104          1HB       GLN 104   8.644   8.965 -10.355
  785   1HG   GLN 104          2HG       GLN 104   6.773   7.110 -11.665
  786   2HG   GLN 104          1HG       GLN 104   6.147   8.723 -11.325
  787   1HE2  GLN 104          1HE2      GLN 104   6.862   7.338 -13.856
  788   2HE2  GLN 104          2HE2      GLN 104   7.958   8.406 -14.658
  789    H    ILE 105           H        ILE 105  10.094   8.713  -9.004
  790    HA   ILE 105           HA       ILE 105  11.207   9.199  -7.079
  791    HB   ILE 105           HB       ILE 105   9.272   7.348  -5.691
  792   1HG1  ILE 105          2HG1      ILE 105   8.901  10.315  -6.082
  793   2HG1  ILE 105          1HG1      ILE 105   8.226   9.136  -7.202
  794   1HG2  ILE 105          1HG2      ILE 105  10.242   9.819  -4.416
  795   2HG2  ILE 105          2HG2      ILE 105  11.450   8.559  -4.666
  796   3HG2  ILE 105          3HG2      ILE 105   9.992   8.211  -3.736
  797   1HD1  ILE 105          1HD1      ILE 105   7.431   8.238  -4.706
  798   2HD1  ILE 105          2HD1      ILE 105   6.442   9.089  -5.893
  799   3HD1  ILE 105          3HD1      ILE 105   7.266   9.992  -4.622
  800    HA   PRO 106           HA       PRO 106  13.431   5.105  -7.371
  801   1HB   PRO 106          2HB       PRO 106  15.774   6.116  -8.282
  802   2HB   PRO 106          1HB       PRO 106  14.443   5.673  -9.357
  803   1HG   PRO 106          2HG       PRO 106  15.229   8.373  -8.327
  804   2HG   PRO 106          1HG       PRO 106  14.737   7.900  -9.963
  805   1HD   PRO 106          2HD       PRO 106  13.046   9.098  -8.216
  806   2HD   PRO 106          1HD       PRO 106  12.495   7.929  -9.433
  807    H    HIS 107           H        HIS 107  15.725   4.658  -6.448
  808    HA   HIS 107           HA       HIS 107  15.836   5.949  -3.837
  809   1HB   HIS 107          2HB       HIS 107  16.423   3.314  -4.864
  810   2HB   HIS 107          1HB       HIS 107  17.803   3.943  -3.972
  811    HD1  HIS 107           1HD      HIS 107  14.387   4.940  -2.878
  812    HD2  HIS 107           2HD      HIS 107  17.280   2.129  -1.875
  813    HE1  HIS 107           1HE      HIS 107  13.667   3.995  -0.662
  814    HE2  HIS 107           2HE      HIS 107  15.387   2.238  -0.116
  815    H    SER 108           H        SER 108  17.145   7.613  -3.535
  816    HA   SER 108           HA       SER 108  19.455   7.970  -5.289
  817   1HB   SER 108          2HB       SER 108  17.587   9.765  -4.489
  818   2HB   SER 108          1HB       SER 108  18.832  10.040  -3.270
  819    HG   SER 108           HG       SER 108  20.308  10.163  -5.155
  820    H    HIS 109           H        HIS 109  21.332   7.183  -4.624
  821    HA   HIS 109           HA       HIS 109  21.823   6.778  -1.780
  822   1HB   HIS 109          2HB       HIS 109  23.015   5.749  -4.309
  823   2HB   HIS 109          1HB       HIS 109  24.052   5.817  -2.887
  824    HD1  HIS 109           1HD      HIS 109  24.168   3.263  -2.663
  825    HD2  HIS 109           2HD      HIS 109  20.307   4.787  -2.483
  826    HE1  HIS 109           1HE      HIS 109  22.733   1.363  -1.853
  827    HE2  HIS 109           2HE      HIS 109  20.388   2.284  -1.836
  828    H    TYR 110           H        TYR 110  22.911   8.756  -4.448
  829    HA   TYR 110           HA       TYR 110  25.093   9.883  -2.891
  830   1HB   TYR 110          2HB       TYR 110  24.131  10.611  -5.665
  831   2HB   TYR 110          1HB       TYR 110  25.629  11.145  -4.909
  832    HD1  TYR 110           1HD      TYR 110  27.499   9.589  -4.623
  833    HD2  TYR 110           2HD      TYR 110  23.917   8.390  -6.579
  834    HE1  TYR 110           1HE      TYR 110  28.662   7.623  -5.534
  835    HE2  TYR 110           2HE      TYR 110  25.069   6.421  -7.496
  836    HH   TYR 110           HH       TYR 110  27.001   5.040  -7.042
  Start of MODEL   12
    1   1H    GLY   1          1HT       GLY   1  -9.436 -15.527   2.280
    2   2H    GLY   1          2HT       GLY   1  -9.607 -16.571   0.960
    3   3H    GLY   1          3HT       GLY   1  -9.396 -17.203   2.516
    4   1HA   GLY   1          1HA       GLY   1 -11.520 -16.440   3.222
    5   2HA   GLY   1          2HA       GLY   1 -11.726 -15.550   1.722
    6    H    SER   2           H        SER   2 -12.918 -18.067   3.248
    7    HA   SER   2           HA       SER   2 -12.971 -19.886   0.950
    8   1HB   SER   2          2HB       SER   2 -12.436 -21.014   2.993
    9   2HB   SER   2          1HB       SER   2 -13.780 -20.246   3.839
   10    HG   SER   2           HG       SER   2 -14.735 -22.060   3.313
   11    H    GLN   3           H        GLN   3 -14.433 -19.013  -0.452
   12    HA   GLN   3           HA       GLN   3 -17.217 -19.021   0.440
   13   1HB   GLN   3          2HB       GLN   3 -15.878 -16.736  -1.008
   14   2HB   GLN   3          1HB       GLN   3 -17.623 -16.921  -0.885
   15   1HG   GLN   3          2HG       GLN   3 -16.191 -17.050   1.670
   16   2HG   GLN   3          1HG       GLN   3 -16.088 -15.501   0.835
   17   1HE2  GLN   3          1HE2      GLN   3 -17.294 -15.307   3.108
   18   2HE2  GLN   3          2HE2      GLN   3 -19.014 -15.233   2.962
   19    H    ASP   4           H        ASP   4 -15.023 -18.693  -2.320
   20    HA   ASP   4           HA       ASP   4 -16.557 -20.672  -3.779
   21   1HB   ASP   4          2HB       ASP   4 -17.473 -18.287  -4.251
   22   2HB   ASP   4          1HB       ASP   4 -15.995 -18.079  -5.185
   23    H    ARG   5           H        ARG   5 -14.105 -18.200  -4.473
   24    HA   ARG   5           HA       ARG   5 -12.025 -20.152  -4.744
   25   1HB   ARG   5          2HB       ARG   5 -13.582 -19.717  -7.006
   26   2HB   ARG   5          1HB       ARG   5 -12.154 -18.725  -7.271
   27   1HG   ARG   5          2HG       ARG   5 -11.652 -21.467  -6.319
   28   2HG   ARG   5          1HG       ARG   5 -12.325 -21.318  -7.944
   29   1HD   ARG   5          2HD       ARG   5  -9.949 -19.715  -7.044
   30   2HD   ARG   5          1HD       ARG   5  -9.782 -21.334  -7.721
   31    HE   ARG   5           HE       ARG   5 -10.322 -18.922  -9.149
   32   1HH1  ARG   5          1HH1      ARG   5 -10.861 -22.370  -9.155
   33   2HH1  ARG   5          2HH1      ARG   5 -11.071 -22.460 -10.872
   34   1HH2  ARG   5          1HH2      ARG   5 -10.600 -19.038 -11.407
   35   2HH2  ARG   5          2HH2      ARG   5 -10.924 -20.569 -12.150
   36    H    LYS   6           H        LYS   6 -12.585 -17.040  -6.344
   37    HA   LYS   6           HA       LYS   6 -11.513 -15.035  -6.219
   38   1HB   LYS   6          2HB       LYS   6 -10.461 -15.738  -3.498
   39   2HB   LYS   6          1HB       LYS   6 -10.995 -14.183  -4.111
   40   1HG   LYS   6          2HG       LYS   6 -12.881 -16.472  -3.656
   41   2HG   LYS   6          1HG       LYS   6 -12.486 -15.287  -2.410
   42   1HD   LYS   6          2HD       LYS   6 -13.357 -13.499  -3.754
   43   2HD   LYS   6          1HD       LYS   6 -13.583 -14.581  -5.129
   44   1HE   LYS   6          2HE       LYS   6 -14.933 -15.621  -2.816
   45   2HE   LYS   6          1HE       LYS   6 -15.430 -13.956  -3.108
   46   1HZ   LYS   6          1HZ       LYS   6 -16.462 -14.506  -5.014
   47   2HZ   LYS   6          2HZ       LYS   6 -16.521 -16.051  -4.325
   48   3HZ   LYS   6          3HZ       LYS   6 -15.314 -15.671  -5.448
   49    H    ILE   7           H        ILE   7  -9.589 -14.275  -6.948
   50    HA   ILE   7           HA       ILE   7  -7.488 -16.171  -7.409
   51    HB   ILE   7           HB       ILE   7  -6.295 -14.179  -8.418
   52   1HG1  ILE   7          2HG1      ILE   7  -8.685 -12.598  -8.741
   53   2HG1  ILE   7          1HG1      ILE   7  -8.302 -12.764  -7.033
   54   1HG2  ILE   7          1HG2      ILE   7  -7.257 -15.482 -10.020
   55   2HG2  ILE   7          2HG2      ILE   7  -8.176 -13.998 -10.255
   56   3HG2  ILE   7          3HG2      ILE   7  -8.875 -15.328  -9.335
   57   1HD1  ILE   7          1HD1      ILE   7  -6.901 -11.073  -7.318
   58   2HD1  ILE   7          2HD1      ILE   7  -7.016 -11.178  -9.075
   59   3HD1  ILE   7          3HD1      ILE   7  -5.868 -12.194  -8.203
   60    H    PHE   8           H        PHE   8  -8.128 -13.756  -5.035
   61    HA   PHE   8           HA       PHE   8  -5.344 -13.675  -4.165
   62   1HB   PHE   8          2HB       PHE   8  -7.816 -12.167  -3.316
   63   2HB   PHE   8          1HB       PHE   8  -6.298 -12.051  -2.451
   64    HD1  PHE   8           1HD      PHE   8  -7.718  -9.734  -3.640
   65    HD2  PHE   8           2HD      PHE   8  -4.761 -12.320  -5.278
   66    HE1  PHE   8           1HE      PHE   8  -6.996  -7.940  -5.157
   67    HE2  PHE   8           2HE      PHE   8  -4.036 -10.530  -6.799
   68    HZ   PHE   8           HZ       PHE   8  -5.154  -8.336  -6.739
   69    H    ARG   9           H        ARG   9  -8.544 -14.511  -2.851
   70    HA   ARG   9           HA       ARG   9  -9.158 -15.719  -1.009
   71   1HB   ARG   9          2HB       ARG   9  -8.556 -17.475  -2.613
   72   2HB   ARG   9          1HB       ARG   9  -6.897 -17.442  -2.035
   73   1HG   ARG   9          2HG       ARG   9  -7.760 -18.099   0.220
   74   2HG   ARG   9          1HG       ARG   9  -9.343 -18.327  -0.527
   75   1HD   ARG   9          2HD       ARG   9  -7.701 -19.736  -2.203
   76   2HD   ARG   9          1HD       ARG   9  -6.950 -20.007  -0.632
   77    HE   ARG   9           HE       ARG   9  -9.562 -20.496  -0.149
   78   1HH1  ARG   9          1HH1      ARG   9  -7.331 -21.666  -2.564
   79   2HH1  ARG   9          2HH1      ARG   9  -8.113 -23.202  -2.722
   80   1HH2  ARG   9          1HH2      ARG   9 -10.590 -22.517  -0.355
   81   2HH2  ARG   9          2HH2      ARG   9  -9.963 -23.686  -1.469
   82    H    GLY  10           H        GLY  10  -8.625 -14.332   0.677
   83   1HA   GLY  10          2HA       GLY  10  -7.683 -14.023   2.782
   84   2HA   GLY  10          1HA       GLY  10  -6.550 -15.315   2.424
   85    H    LEU  11           H        LEU  11  -7.287 -11.943   1.697
   86    HA   LEU  11           HA       LEU  11  -4.439 -11.335   1.773
   87   1HB   LEU  11          2HB       LEU  11  -5.902 -11.579  -0.649
   88   2HB   LEU  11          1HB       LEU  11  -5.550  -9.880  -0.417
   89    HG   LEU  11           HG       LEU  11  -3.280 -11.734  -0.023
   90   1HD1  LEU  11          1HD1      LEU  11  -4.324 -11.128  -2.781
   91   2HD1  LEU  11          2HD1      LEU  11  -4.463 -12.693  -1.979
   92   3HD1  LEU  11          3HD1      LEU  11  -2.872 -12.040  -2.368
   93   1HD2  LEU  11          1HD2      LEU  11  -3.006  -9.334   0.173
   94   2HD2  LEU  11          2HD2      LEU  11  -3.650  -9.109  -1.454
   95   3HD2  LEU  11          3HD2      LEU  11  -2.111  -9.940  -1.220
   96    H    GLU  12           H        GLU  12  -4.016  -9.008   1.858
   97    HA   GLU  12           HA       GLU  12  -6.301  -7.351   2.619
   98   1HB   GLU  12          2HB       GLU  12  -4.016  -8.130   4.376
   99   2HB   GLU  12          1HB       GLU  12  -4.656  -6.498   4.514
  100   1HG   GLU  12          2HG       GLU  12  -6.944  -7.636   4.753
  101   2HG   GLU  12          1HG       GLU  12  -6.017  -9.102   5.069
  102    H    ILE  13           H        ILE  13  -6.177  -5.737   1.195
  103    HA   ILE  13           HA       ILE  13  -3.530  -4.543   0.687
  104    HB   ILE  13           HB       ILE  13  -5.858  -4.599  -1.230
  105   1HG1  ILE  13          2HG1      ILE  13  -3.532  -6.040  -2.130
  106   2HG1  ILE  13          1HG1      ILE  13  -4.058  -6.676  -0.573
  107   1HG2  ILE  13          1HG2      ILE  13  -3.821  -4.037  -2.795
  108   2HG2  ILE  13          2HG2      ILE  13  -3.129  -3.416  -1.296
  109   3HG2  ILE  13          3HG2      ILE  13  -4.657  -2.770  -1.896
  110   1HD1  ILE  13          1HD1      ILE  13  -6.419  -6.589  -1.770
  111   2HD1  ILE  13          2HD1      ILE  13  -5.322  -7.960  -1.939
  112   3HD1  ILE  13          3HD1      ILE  13  -5.404  -6.735  -3.204
  113    H    CYS  14           H        CYS  14  -3.295  -2.495   1.271
  114    HA   CYS  14           HA       CYS  14  -5.713  -0.880   1.727
  115   1HB   CYS  14          2HB       CYS  14  -4.406   0.378   3.381
  116   2HB   CYS  14          1HB       CYS  14  -4.469  -1.334   3.778
  117    HG   CYS  14           HG       CYS  14  -1.971  -1.408   2.684
  118    H    CYS  15           H        CYS  15  -5.830   1.183   0.951
  119    HA   CYS  15           HA       CYS  15  -3.762   1.920  -1.006
  120   1HB   CYS  15          2HB       CYS  15  -5.571   3.389  -1.973
  121   2HB   CYS  15          1HB       CYS  15  -5.882   1.660  -2.078
  122    HG   CYS  15           HG       CYS  15  -7.236   2.727   0.359
  123    H    TYR  16           H        TYR  16  -2.442   3.508  -0.443
  124    HA   TYR  16           HA       TYR  16  -3.196   5.296   1.736
  125   1HB   TYR  16          2HB       TYR  16  -0.825   4.030   1.105
  126   2HB   TYR  16          1HB       TYR  16  -0.542   5.681   0.563
  127    HD1  TYR  16           1HD      TYR  16  -0.802   3.480   3.403
  128    HD2  TYR  16           2HD      TYR  16  -0.808   7.564   2.212
  129    HE1  TYR  16           1HE      TYR  16  -0.322   4.149   5.720
  130    HE2  TYR  16           2HE      TYR  16  -0.328   8.245   4.525
  131    HH   TYR  16           HH       TYR  16  -0.812   6.495   7.097
  132    H    GLY  17           H        GLY  17  -4.088   7.189   1.297
  133   1HA   GLY  17          2HA       GLY  17  -4.436   9.246   0.322
  134   2HA   GLY  17          1HA       GLY  17  -2.995   8.974  -0.645
  135    HA   PRO  18           HA       PRO  18  -7.310   8.351  -2.901
  136   1HB   PRO  18          2HB       PRO  18  -6.635  11.051  -3.952
  137   2HB   PRO  18          1HB       PRO  18  -8.211  10.364  -3.544
  138   1HG   PRO  18          2HG       PRO  18  -7.044  12.154  -1.950
  139   2HG   PRO  18          1HG       PRO  18  -7.959  10.789  -1.283
  140   1HD   PRO  18          2HD       PRO  18  -5.010  11.195  -1.450
  141   2HD   PRO  18          1HD       PRO  18  -5.971  10.406  -0.184
  142    H    PHE  19           H        PHE  19  -7.365   7.742  -5.055
  143    HA   PHE  19           HA       PHE  19  -4.762   7.723  -6.409
  144   1HB   PHE  19          2HB       PHE  19  -7.157   5.913  -6.534
  145   2HB   PHE  19          1HB       PHE  19  -5.964   5.918  -7.829
  146    HD1  PHE  19           1HD      PHE  19  -5.628   6.134  -4.121
  147    HD2  PHE  19           2HD      PHE  19  -4.717   3.993  -7.685
  148    HE1  PHE  19           1HE      PHE  19  -4.220   4.588  -2.827
  149    HE2  PHE  19           2HE      PHE  19  -3.308   2.442  -6.396
  150    HZ   PHE  19           HZ       PHE  19  -3.059   2.739  -3.963
  151    H    THR  20           H        THR  20  -8.104   7.547  -7.565
  152    HA   THR  20           HA       THR  20  -7.723   9.951  -9.162
  153    HB   THR  20           HB       THR  20  -8.793   8.523 -11.119
  154    HG1  THR  20           1HG      THR  20  -8.874   6.579  -9.976
  155   1HG2  THR  20          1HG2      THR  20  -6.450   9.659 -10.925
  156   2HG2  THR  20          2HG2      THR  20  -6.779   8.476 -12.192
  157   3HG2  THR  20          3HG2      THR  20  -5.894   7.995 -10.744
  158    H    ASN  21           H        ASN  21  -9.383   9.141  -6.883
  159    HA   ASN  21           HA       ASN  21 -11.845  10.253  -7.757
  160   1HB   ASN  21          2HB       ASN  21 -11.653   7.485  -8.114
  161   2HB   ASN  21          1HB       ASN  21 -12.590   7.681  -6.636
  162   1HD2  ASN  21          1HD2      ASN  21 -13.445   6.688  -9.214
  163   2HD2  ASN  21          2HD2      ASN  21 -14.730   7.718  -9.734
  164    H    MET  22           H        MET  22 -13.432  10.407  -5.965
  165    HA   MET  22           HA       MET  22 -12.034  10.933  -3.490
  166   1HB   MET  22          2HB       MET  22 -13.913  12.344  -4.656
  167   2HB   MET  22          1HB       MET  22 -14.992  11.251  -3.801
  168   1HG   MET  22          2HG       MET  22 -14.852  12.708  -2.129
  169   2HG   MET  22          1HG       MET  22 -13.269  11.995  -1.825
  170   1HE   MET  22          1HE       MET  22 -14.079  14.388  -0.705
  171   2HE   MET  22          2HE       MET  22 -14.353  15.802  -1.721
  172   3HE   MET  22          3HE       MET  22 -12.778  15.550  -0.969
  173    HA   PRO  23           HA       PRO  23 -15.554   7.659  -2.141
  174   1HB   PRO  23          2HB       PRO  23 -15.107   5.977  -4.570
  175   2HB   PRO  23          1HB       PRO  23 -16.571   6.193  -3.605
  176   1HG   PRO  23          2HG       PRO  23 -16.312   7.411  -5.954
  177   2HG   PRO  23          1HG       PRO  23 -17.075   8.236  -4.581
  178   1HD   PRO  23          2HD       PRO  23 -14.368   8.624  -5.762
  179   2HD   PRO  23          1HD       PRO  23 -15.452   9.807  -5.005
  180    H    THR  24           H        THR  24 -13.196   6.094  -4.326
  181    HA   THR  24           HA       THR  24 -11.296   4.893  -3.893
  182    HB   THR  24           HB       THR  24 -11.498   5.215  -0.945
  183    HG1  THR  24           1HG      THR  24 -11.659   7.287  -1.085
  184   1HG2  THR  24          1HG2      THR  24  -9.035   6.112  -1.891
  185   2HG2  THR  24          2HG2      THR  24  -9.435   4.701  -2.872
  186   3HG2  THR  24          3HG2      THR  24  -9.391   4.569  -1.114
  187    H    ASP  25           H        ASP  25 -14.347   4.221  -2.802
  188    HA   ASP  25           HA       ASP  25 -13.787   1.739  -1.448
  189   1HB   ASP  25          2HB       ASP  25 -16.377   2.945  -2.446
  190   2HB   ASP  25          1HB       ASP  25 -16.267   1.450  -1.522
  191    H    GLN  26           H        GLN  26 -14.372   2.860  -4.643
  192    HA   GLN  26           HA       GLN  26 -15.224   0.440  -5.825
  193   1HB   GLN  26          2HB       GLN  26 -15.070   3.010  -6.645
  194   2HB   GLN  26          1HB       GLN  26 -13.656   2.350  -7.448
  195   1HG   GLN  26          2HG       GLN  26 -15.267   0.507  -8.266
  196   2HG   GLN  26          1HG       GLN  26 -16.532   1.647  -7.808
  197   1HE2  GLN  26          1HE2      GLN  26 -14.653   0.614 -10.294
  198   2HE2  GLN  26          2HE2      GLN  26 -14.731   2.004 -11.316
  199    H    LEU  27           H        LEU  27 -12.076   1.867  -5.197
  200    HA   LEU  27           HA       LEU  27 -10.578  -0.021  -6.707
  201   1HB   LEU  27          2HB       LEU  27  -9.627   2.134  -6.127
  202   2HB   LEU  27          1HB       LEU  27  -9.778   1.778  -4.417
  203    HG   LEU  27           HG       LEU  27  -8.108  -0.005  -4.628
  204   1HD1  LEU  27          1HD1      LEU  27  -8.671  -0.488  -7.040
  205   2HD1  LEU  27          2HD1      LEU  27  -6.954  -0.466  -6.636
  206   3HD1  LEU  27          3HD1      LEU  27  -7.683   0.912  -7.459
  207   1HD2  LEU  27          1HD2      LEU  27  -7.645   2.647  -4.506
  208   2HD2  LEU  27          2HD2      LEU  27  -6.717   2.231  -5.947
  209   3HD2  LEU  27          3HD2      LEU  27  -6.377   1.423  -4.418
  210    H    GLU  28           H        GLU  28 -11.101   0.335  -3.188
  211    HA   GLU  28           HA       GLU  28  -9.861  -2.091  -2.493
  212   1HB   GLU  28          2HB       GLU  28 -11.381  -1.902  -0.411
  213   2HB   GLU  28          1HB       GLU  28 -10.170  -0.661  -0.695
  214   1HG   GLU  28          2HG       GLU  28 -11.710   0.927  -0.778
  215   2HG   GLU  28          1HG       GLU  28 -12.659   0.029  -1.962
  216    H    TRP  29           H        TRP  29 -13.012  -1.375  -3.761
  217    HA   TRP  29           HA       TRP  29 -14.335  -3.756  -3.019
  218   1HB   TRP  29          2HB       TRP  29 -15.775  -2.102  -3.832
  219   2HB   TRP  29          1HB       TRP  29 -14.718  -1.707  -5.181
  220    HD1  TRP  29           HD       TRP  29 -16.850  -4.761  -4.090
  221    HE1  TRP  29           1HE      TRP  29 -17.952  -5.754  -6.194
  222    HE3  TRP  29           3HE      TRP  29 -14.837  -1.644  -7.600
  223    HZ2  TRP  29           2HZ      TRP  29 -17.961  -5.278  -8.976
  224    HZ3  TRP  29           3HZ      TRP  29 -15.439  -1.981  -9.962
  225    HH2  TRP  29           HH       TRP  29 -16.968  -3.762 -10.634
  226    H    MET  30           H        MET  30 -12.560  -2.832  -5.926
  227    HA   MET  30           HA       MET  30 -12.797  -5.136  -7.420
  228   1HB   MET  30          2HB       MET  30 -10.277  -3.482  -7.209
  229   2HB   MET  30          1HB       MET  30 -10.799  -4.456  -8.576
  230   1HG   MET  30          2HG       MET  30 -12.909  -2.756  -8.246
  231   2HG   MET  30          1HG       MET  30 -11.536  -1.741  -7.811
  232   1HE   MET  30          1HE       MET  30 -12.471  -0.229  -9.953
  233   2HE   MET  30          2HE       MET  30 -11.243  -0.291 -11.218
  234   3HE   MET  30          3HE       MET  30 -10.761  -0.184  -9.525
  235    H    VAL  31           H        VAL  31 -10.161  -4.370  -5.125
  236    HA   VAL  31           HA       VAL  31  -8.871  -6.850  -5.288
  237    HB   VAL  31           HB       VAL  31  -7.909  -6.321  -3.056
  238   1HG1  VAL  31          1HG1      VAL  31  -7.569  -3.725  -4.294
  239   2HG1  VAL  31          2HG1      VAL  31  -7.492  -5.034  -5.476
  240   3HG1  VAL  31          3HG1      VAL  31  -6.407  -5.037  -4.085
  241   1HG2  VAL  31          1HG2      VAL  31  -8.421  -4.144  -2.037
  242   2HG2  VAL  31          2HG2      VAL  31  -9.806  -5.233  -2.030
  243   3HG2  VAL  31          3HG2      VAL  31  -9.720  -3.922  -3.206
  244    H    GLN  32           H        GLN  32 -11.398  -5.695  -3.097
  245    HA   GLN  32           HA       GLN  32 -11.598  -7.975  -1.482
  246   1HB   GLN  32          2HB       GLN  32 -13.182  -5.578  -2.007
  247   2HB   GLN  32          1HB       GLN  32 -14.180  -6.971  -1.617
  248   1HG   GLN  32          2HG       GLN  32 -11.935  -6.763   0.180
  249   2HG   GLN  32          1HG       GLN  32 -12.880  -5.276   0.159
  250   1HE2  GLN  32          1HE2      GLN  32 -13.650  -5.584   2.235
  251   2HE2  GLN  32          2HE2      GLN  32 -14.825  -6.790   2.621
  252    H    LEU  33           H        LEU  33 -12.920  -7.207  -4.617
  253    HA   LEU  33           HA       LEU  33 -14.750  -9.375  -4.779
  254   1HB   LEU  33          2HB       LEU  33 -14.937  -7.353  -6.161
  255   2HB   LEU  33          1HB       LEU  33 -13.439  -7.768  -6.972
  256    HG   LEU  33           HG       LEU  33 -14.521  -9.822  -7.846
  257   1HD1  LEU  33          1HD1      LEU  33 -16.562 -10.503  -7.244
  258   2HD1  LEU  33          2HD1      LEU  33 -17.232  -8.874  -7.339
  259   3HD1  LEU  33          3HD1      LEU  33 -16.385  -9.395  -5.883
  260   1HD2  LEU  33          1HD2      LEU  33 -14.493  -8.137  -9.419
  261   2HD2  LEU  33          2HD2      LEU  33 -15.550  -7.091  -8.471
  262   3HD2  LEU  33          3HD2      LEU  33 -16.217  -8.492  -9.307
  263    H    CYS  34           H        CYS  34 -11.345  -9.108  -5.160
  264    HA   CYS  34           HA       CYS  34 -11.141 -11.576  -6.696
  265   1HB   CYS  34          2HB       CYS  34  -9.268  -9.381  -5.948
  266   2HB   CYS  34          1HB       CYS  34  -8.588 -10.970  -6.280
  267    HG   CYS  34           HG       CYS  34 -10.320  -9.535  -8.426
  268    H    GLY  35           H        GLY  35 -11.495 -10.822  -3.489
  269   1HA   GLY  35          2HA       GLY  35 -11.554 -12.794  -2.011
  270   2HA   GLY  35          1HA       GLY  35  -9.995 -13.236  -2.684
  271    H    ALA  36           H        ALA  36  -9.256 -10.284  -2.592
  272    HA   ALA  36           HA       ALA  36  -7.907 -10.364  -0.103
  273   1HB   ALA  36          1HB       ALA  36  -8.285  -8.154  -2.108
  274   2HB   ALA  36          2HB       ALA  36  -6.885  -9.207  -1.912
  275   3HB   ALA  36          3HB       ALA  36  -7.270  -8.013  -0.673
  276    H    SER  37           H        SER  37  -7.976  -8.223   1.256
  277    HA   SER  37           HA       SER  37 -10.774  -7.542   1.849
  278   1HB   SER  37          2HB       SER  37  -9.169  -9.179   3.455
  279   2HB   SER  37          1HB       SER  37  -9.139  -7.604   4.248
  280    HG   SER  37           HG       SER  37 -11.543  -8.812   3.379
  281    H    VAL  38           H        VAL  38 -11.144  -5.428   2.267
  282    HA   VAL  38           HA       VAL  38  -9.077  -3.546   1.714
  283    HB   VAL  38           HB       VAL  38 -11.423  -3.123   1.104
  284   1HG1  VAL  38          1HG1      VAL  38 -12.169  -4.103   3.437
  285   2HG1  VAL  38          2HG1      VAL  38 -13.152  -2.914   2.581
  286   3HG1  VAL  38          3HG1      VAL  38 -12.105  -2.404   3.906
  287   1HG2  VAL  38          1HG2      VAL  38 -11.543  -0.772   1.984
  288   2HG2  VAL  38          2HG2      VAL  38 -10.014  -1.212   1.222
  289   3HG2  VAL  38          3HG2      VAL  38 -10.137  -1.150   2.980
  290    H    VAL  39           H        VAL  39  -7.577  -2.873   3.091
  291    HA   VAL  39           HA       VAL  39  -8.014  -3.178   5.964
  292    HB   VAL  39           HB       VAL  39  -5.464  -2.179   4.756
  293   1HG1  VAL  39          1HG1      VAL  39  -4.462  -2.879   6.689
  294   2HG1  VAL  39          2HG1      VAL  39  -5.677  -4.121   6.997
  295   3HG1  VAL  39          3HG1      VAL  39  -6.057  -2.423   7.288
  296   1HG2  VAL  39          1HG2      VAL  39  -6.308  -5.068   4.888
  297   2HG2  VAL  39          2HG2      VAL  39  -4.693  -4.487   4.480
  298   3HG2  VAL  39          3HG2      VAL  39  -6.055  -4.125   3.420
  299    H    LYS  40           H        LYS  40  -8.559  -1.528   7.223
  300    HA   LYS  40           HA       LYS  40  -9.147   1.024   6.298
  301   1HB   LYS  40          2HB       LYS  40  -9.560  -0.328   8.629
  302   2HB   LYS  40          1HB       LYS  40  -8.381   0.872   9.138
  303   1HG   LYS  40          2HG       LYS  40 -10.025   2.337   9.337
  304   2HG   LYS  40          1HG       LYS  40 -10.264   2.256   7.590
  305   1HD   LYS  40          2HD       LYS  40 -11.513   0.286   9.491
  306   2HD   LYS  40          1HD       LYS  40 -12.300   1.799   9.038
  307   1HE   LYS  40          2HE       LYS  40 -11.910   1.041   6.616
  308   2HE   LYS  40          1HE       LYS  40 -11.602  -0.552   7.308
  309   1HZ   LYS  40          1HZ       LYS  40 -13.948  -0.083   6.563
  310   2HZ   LYS  40          2HZ       LYS  40 -14.076   0.970   7.880
  311   3HZ   LYS  40          3HZ       LYS  40 -13.778  -0.675   8.139
  312    H    GLU  41           H        GLU  41  -6.120  -0.308   7.339
  313    HA   GLU  41           HA       GLU  41  -4.578   1.746   6.281
  314   1HB   GLU  41          2HB       GLU  41  -5.696   2.691   8.560
  315   2HB   GLU  41          1HB       GLU  41  -4.211   2.014   9.195
  316   1HG   GLU  41          2HG       GLU  41  -3.281   3.957   8.659
  317   2HG   GLU  41          1HG       GLU  41  -3.353   3.396   6.989
  318    H    LEU  42           H        LEU  42  -2.330   1.779   7.605
  319    HA   LEU  42           HA       LEU  42  -1.198  -0.757   7.138
  320   1HB   LEU  42          2HB       LEU  42   0.041   1.382   8.856
  321   2HB   LEU  42          1HB       LEU  42   0.857   0.168   7.887
  322    HG   LEU  42           HG       LEU  42  -0.730   2.496   6.798
  323   1HD1  LEU  42          1HD1      LEU  42   1.687   3.005   5.926
  324   2HD1  LEU  42          2HD1      LEU  42   2.165   2.059   7.336
  325   3HD1  LEU  42          3HD1      LEU  42   1.184   3.511   7.538
  326   1HD2  LEU  42          1HD2      LEU  42   0.398   0.067   5.583
  327   2HD2  LEU  42          2HD2      LEU  42   0.773   1.576   4.749
  328   3HD2  LEU  42          3HD2      LEU  42  -0.907   1.117   5.030
  329    H    SER  43           H        SER  43  -1.995   0.929  10.161
  330    HA   SER  43           HA       SER  43  -1.076  -1.154  11.858
  331   1HB   SER  43          2HB       SER  43  -2.563   1.383  12.183
  332   2HB   SER  43          1HB       SER  43  -2.845   0.166  13.428
  333    HG   SER  43           HG       SER  43  -0.615   0.104  13.801
  334    H    SER  44           H        SER  44  -3.800  -0.942   9.875
  335    HA   SER  44           HA       SER  44  -5.421  -2.687  11.566
  336   1HB   SER  44          2HB       SER  44  -5.955  -1.062   9.106
  337   2HB   SER  44          1HB       SER  44  -7.022  -2.405   9.507
  338    HG   SER  44           HG       SER  44  -6.368  -0.275  11.265
  339    H    PHE  45           H        PHE  45  -2.896  -3.542  10.186
  340    HA   PHE  45           HA       PHE  45  -3.823  -5.400   8.164
  341   1HB   PHE  45          2HB       PHE  45  -1.189  -4.485   9.178
  342   2HB   PHE  45          1HB       PHE  45  -1.257  -6.125   8.540
  343    HD1  PHE  45           1HD      PHE  45  -0.276  -3.043   7.650
  344    HD2  PHE  45           2HD      PHE  45  -2.948  -6.062   6.289
  345    HE1  PHE  45           1HE      PHE  45  -0.115  -2.151   5.365
  346    HE2  PHE  45           2HE      PHE  45  -2.788  -5.176   3.999
  347    HZ   PHE  45           HZ       PHE  45  -1.368  -3.218   3.537
  348    H    THR  46           H        THR  46  -5.076  -6.950   9.082
  349    HA   THR  46           HA       THR  46  -4.569  -8.171  11.579
  350    HB   THR  46           HB       THR  46  -6.076  -9.614   9.440
  351    HG1  THR  46           1HG      THR  46  -7.036  -7.773   9.032
  352   1HG2  THR  46          1HG2      THR  46  -5.935  -9.766  12.246
  353   2HG2  THR  46          2HG2      THR  46  -6.971 -10.681  11.149
  354   3HG2  THR  46          3HG2      THR  46  -7.539  -9.158  11.834
  355    H    LEU  47           H        LEU  47  -4.046 -10.449  11.937
  356    HA   LEU  47           HA       LEU  47  -2.330 -11.629   9.870
  357   1HB   LEU  47          2HB       LEU  47  -1.551 -11.456  12.778
  358   2HB   LEU  47          1HB       LEU  47  -0.597 -12.132  11.472
  359    HG   LEU  47           HG       LEU  47  -1.379  -9.291  11.178
  360   1HD1  LEU  47          1HD1      LEU  47   1.002  -9.747  12.863
  361   2HD1  LEU  47          2HD1      LEU  47  -0.568  -9.923  13.648
  362   3HD1  LEU  47          3HD1      LEU  47  -0.145  -8.408  12.852
  363   1HD2  LEU  47          1HD2      LEU  47   1.223  -9.395  10.648
  364   2HD2  LEU  47          2HD2      LEU  47   0.003  -9.886   9.475
  365   3HD2  LEU  47          3HD2      LEU  47   0.844 -11.103  10.433
  366    H    GLY  48           H        GLY  48  -4.393 -12.879   9.695
  367   1HA   GLY  48          2HA       GLY  48  -5.121 -14.652  11.825
  368   2HA   GLY  48          1HA       GLY  48  -5.720 -14.706  10.175
  369    H    THR  49           H        THR  49  -5.217 -16.480   9.089
  370    HA   THR  49           HA       THR  49  -2.604 -17.728   9.513
  371    HB   THR  49           HB       THR  49  -4.181 -18.917  10.981
  372    HG1  THR  49           1HG      THR  49  -3.454 -20.445   8.707
  373   1HG2  THR  49          1HG2      THR  49  -5.847 -18.943   8.571
  374   2HG2  THR  49          2HG2      THR  49  -6.300 -19.023  10.274
  375   3HG2  THR  49          3HG2      THR  49  -5.753 -20.476   9.437
  376    H    GLY  50           H        GLY  50  -3.945 -16.146   7.362
  377   1HA   GLY  50          2HA       GLY  50  -2.911 -17.476   5.137
  378   2HA   GLY  50          1HA       GLY  50  -4.625 -17.847   5.211
  379    H    VAL  51           H        VAL  51  -3.136 -14.814   6.190
  380    HA   VAL  51           HA       VAL  51  -4.374 -13.503   3.862
  381    HB   VAL  51           HB       VAL  51  -4.812 -11.534   5.412
  382   1HG1  VAL  51          1HG1      VAL  51  -6.775 -12.492   4.785
  383   2HG1  VAL  51          2HG1      VAL  51  -6.822 -12.895   6.502
  384   3HG1  VAL  51          3HG1      VAL  51  -6.293 -14.100   5.328
  385   1HG2  VAL  51          1HG2      VAL  51  -5.208 -12.279   7.817
  386   2HG2  VAL  51          2HG2      VAL  51  -3.533 -12.032   7.321
  387   3HG2  VAL  51          3HG2      VAL  51  -4.187 -13.666   7.435
  388    H    HIS  52           H        HIS  52  -2.834 -12.560   2.685
  389    HA   HIS  52           HA       HIS  52  -0.323 -11.783   3.953
  390   1HB   HIS  52          2HB       HIS  52  -1.173 -12.494   1.214
  391   2HB   HIS  52          1HB       HIS  52   0.061 -11.240   1.322
  392    HD1  HIS  52           1HD      HIS  52   1.540 -12.482   3.827
  393    HD2  HIS  52           2HD      HIS  52   0.497 -14.512   0.354
  394    HE1  HIS  52           1HE      HIS  52   3.107 -14.445   3.701
  395    HE2  HIS  52           2HE      HIS  52   2.512 -15.612   1.548
  396    HA   PRO  53           HA       PRO  53  -1.542  -7.506   3.832
  397   1HB   PRO  53          2HB       PRO  53   0.709  -6.411   4.763
  398   2HB   PRO  53          1HB       PRO  53  -0.309  -7.424   5.794
  399   1HG   PRO  53          2HG       PRO  53   2.234  -8.110   4.379
  400   2HG   PRO  53          1HG       PRO  53   1.701  -8.561   6.009
  401   1HD   PRO  53          2HD       PRO  53   1.522 -10.191   3.779
  402   2HD   PRO  53          1HD       PRO  53   0.538 -10.369   5.245
  403    H    ILE  54           H        ILE  54  -1.603  -6.046   2.250
  404    HA   ILE  54           HA       ILE  54   0.749  -5.645   0.540
  405    HB   ILE  54           HB       ILE  54  -2.004  -5.770  -0.663
  406   1HG1  ILE  54          2HG1      ILE  54  -1.567  -7.973   0.317
  407   2HG1  ILE  54          1HG1      ILE  54  -1.502  -8.042  -1.441
  408   1HG2  ILE  54          1HG2      ILE  54  -0.723  -6.114  -2.740
  409   2HG2  ILE  54          2HG2      ILE  54   0.772  -5.958  -1.818
  410   3HG2  ILE  54          3HG2      ILE  54  -0.334  -4.589  -1.944
  411   1HD1  ILE  54          1HD1      ILE  54   0.605  -8.736  -1.433
  412   2HD1  ILE  54          2HD1      ILE  54   0.366  -9.051   0.286
  413   3HD1  ILE  54          3HD1      ILE  54   1.091  -7.532  -0.239
  414    H    VAL  55           H        VAL  55   0.836  -3.585  -0.477
  415    HA   VAL  55           HA       VAL  55  -1.107  -1.616   0.535
  416    HB   VAL  55           HB       VAL  55   1.857  -1.097   0.288
  417   1HG1  VAL  55          1HG1      VAL  55   0.398   0.861   0.019
  418   2HG1  VAL  55          2HG1      VAL  55   1.368   0.955   1.488
  419   3HG1  VAL  55          3HG1      VAL  55  -0.337   0.516   1.584
  420   1HG2  VAL  55          1HG2      VAL  55   0.925  -0.972   2.985
  421   2HG2  VAL  55          2HG2      VAL  55   2.186  -1.993   2.294
  422   3HG2  VAL  55          3HG2      VAL  55   0.512  -2.547   2.305
  423    H    VAL  56           H        VAL  56  -1.489   0.194  -0.803
  424    HA   VAL  56           HA       VAL  56  -0.386  -0.022  -3.527
  425    HB   VAL  56           HB       VAL  56  -3.214   0.828  -2.975
  426   1HG1  VAL  56          1HG1      VAL  56  -2.259  -0.338  -5.539
  427   2HG1  VAL  56          2HG1      VAL  56  -1.843   1.333  -5.156
  428   3HG1  VAL  56          3HG1      VAL  56  -3.534   0.843  -5.241
  429   1HG2  VAL  56          1HG2      VAL  56  -2.120  -1.916  -3.452
  430   2HG2  VAL  56          2HG2      VAL  56  -3.763  -1.492  -3.932
  431   3HG2  VAL  56          3HG2      VAL  56  -3.281  -1.376  -2.240
  432    H    VAL  57           H        VAL  57  -0.041   1.891  -4.641
  433    HA   VAL  57           HA       VAL  57  -0.524   4.391  -3.174
  434    HB   VAL  57           HB       VAL  57   1.741   5.149  -4.164
  435   1HG1  VAL  57          1HG1      VAL  57   2.941   4.075  -2.169
  436   2HG1  VAL  57          2HG1      VAL  57   1.381   3.341  -1.800
  437   3HG1  VAL  57          3HG1      VAL  57   1.543   5.097  -1.838
  438   1HG2  VAL  57          1HG2      VAL  57   3.394   3.233  -4.211
  439   2HG2  VAL  57          2HG2      VAL  57   2.290   3.340  -5.582
  440   3HG2  VAL  57          3HG2      VAL  57   2.002   2.156  -4.308
  441    H    GLN  58           H        GLN  58   0.006   6.326  -4.682
  442    HA   GLN  58           HA       GLN  58  -0.129   6.054  -7.470
  443   1HB   GLN  58          2HB       GLN  58  -2.573   5.482  -6.267
  444   2HB   GLN  58          1HB       GLN  58  -2.746   7.141  -6.820
  445   1HG   GLN  58          2HG       GLN  58  -1.833   4.868  -8.564
  446   2HG   GLN  58          1HG       GLN  58  -3.502   5.425  -8.448
  447   1HE2  GLN  58          1HE2      GLN  58  -4.134   7.015  -9.741
  448   2HE2  GLN  58          2HE2      GLN  58  -3.092   8.004 -10.699
  449    HA   PRO  59           HA       PRO  59   0.943  10.256  -5.944
  450   1HB   PRO  59          2HB       PRO  59   2.971  10.652  -7.693
  451   2HB   PRO  59          1HB       PRO  59   3.177   9.754  -6.184
  452   1HG   PRO  59          2HG       PRO  59   2.770   8.720  -8.964
  453   2HG   PRO  59          1HG       PRO  59   3.896   8.157  -7.715
  454   1HD   PRO  59          2HD       PRO  59   1.543   6.911  -8.240
  455   2HD   PRO  59          1HD       PRO  59   2.273   6.942  -6.622
  456    H    ASP  60           H        ASP  60  -1.324  10.267  -7.191
  457    HA   ASP  60           HA       ASP  60  -0.944  12.086  -9.463
  458   1HB   ASP  60          2HB       ASP  60  -1.642   9.732 -10.162
  459   2HB   ASP  60          1HB       ASP  60  -3.183  10.071  -9.381
  460    H    ALA  61           H        ALA  61  -3.666  10.768  -7.597
  461    HA   ALA  61           HA       ALA  61  -4.712  13.488  -7.308
  462   1HB   ALA  61          1HB       ALA  61  -6.182  11.710  -8.229
  463   2HB   ALA  61          2HB       ALA  61  -6.828  12.485  -6.782
  464   3HB   ALA  61          3HB       ALA  61  -6.091  10.886  -6.671
  465    H    TRP  62           H        TRP  62  -2.463  12.296  -5.706
  466    HA   TRP  62           HA       TRP  62  -3.388  11.789  -3.079
  467   1HB   TRP  62          2HB       TRP  62  -0.853  11.981  -4.436
  468   2HB   TRP  62          1HB       TRP  62  -0.778  12.838  -2.900
  469    HD1  TRP  62           HD       TRP  62  -1.977   9.350  -4.136
  470    HE1  TRP  62           1HE      TRP  62  -1.336   7.620  -2.341
  471    HE3  TRP  62           3HE      TRP  62   0.086  12.497  -0.675
  472    HZ2  TRP  62           2HZ      TRP  62  -0.119   7.594   0.206
  473    HZ3  TRP  62           3HZ      TRP  62   0.966  11.539   1.415
  474    HH2  TRP  62           HH       TRP  62   0.865   9.138   1.844
  475    H    THR  63           H        THR  63  -3.104  14.675  -4.877
  476    HA   THR  63           HA       THR  63  -3.173  16.894  -4.355
  477    HB   THR  63           HB       THR  63  -5.462  16.104  -3.785
  478    HG1  THR  63           1HG      THR  63  -5.303  18.251  -3.636
  479   1HG2  THR  63          1HG2      THR  63  -6.027  16.121  -1.318
  480   2HG2  THR  63          2HG2      THR  63  -4.305  15.866  -1.032
  481   3HG2  THR  63          3HG2      THR  63  -5.233  14.676  -1.946
  482    H    GLU  64           H        GLU  64  -3.402  18.337  -2.045
  483    HA   GLU  64           HA       GLU  64  -0.770  18.439  -1.113
  484   1HB   GLU  64          2HB       GLU  64  -3.349  19.675  -0.277
  485   2HB   GLU  64          1HB       GLU  64  -1.989  19.775   0.834
  486   1HG   GLU  64          2HG       GLU  64  -0.656  20.727  -1.088
  487   2HG   GLU  64          1HG       GLU  64  -2.184  20.865  -1.955
  488    H    ASP  65           H        ASP  65   0.299  17.472   0.504
  489    HA   ASP  65           HA       ASP  65  -1.130  16.180   2.671
  490   1HB   ASP  65          2HB       ASP  65  -0.559  14.641   0.476
  491   2HB   ASP  65          1HB       ASP  65   0.855  14.362   1.488
  492    H    ASN  66           H        ASN  66   0.732  14.861   3.977
  493    HA   ASN  66           HA       ASN  66   2.557  16.925   4.807
  494   1HB   ASN  66          2HB       ASN  66   3.249  15.256   6.528
  495   2HB   ASN  66          1HB       ASN  66   1.516  15.572   6.514
  496   1HD2  ASN  66          1HD2      ASN  66   0.116  13.956   6.013
  497   2HD2  ASN  66          2HD2      ASN  66   0.598  12.317   5.750
  498    H    GLY  67           H        GLY  67   2.868  13.663   3.426
  499   1HA   GLY  67          2HA       GLY  67   5.050  14.265   1.796
  500   2HA   GLY  67          1HA       GLY  67   5.694  13.659   3.315
  501    H    PHE  68           H        PHE  68   5.498  12.613   0.438
  502    HA   PHE  68           HA       PHE  68   4.127  10.078   0.981
  503   1HB   PHE  68          2HB       PHE  68   3.518  11.275  -1.096
  504   2HB   PHE  68          1HB       PHE  68   5.189  11.155  -1.640
  505    HD1  PHE  68           1HD      PHE  68   2.093   9.305  -1.001
  506    HD2  PHE  68           2HD      PHE  68   6.083   9.086  -2.462
  507    HE1  PHE  68           1HE      PHE  68   1.605   7.107  -1.992
  508    HE2  PHE  68           2HE      PHE  68   5.603   6.889  -3.459
  509    HZ   PHE  68           HZ       PHE  68   3.362   5.896  -3.221
  510    H    HIS  69           H        HIS  69   7.185  11.357   1.195
  511    HA   HIS  69           HA       HIS  69   8.637   9.065   0.210
  512   1HB   HIS  69          2HB       HIS  69   9.263  11.754   0.822
  513   2HB   HIS  69          1HB       HIS  69  10.235  10.760   1.900
  514    HD1  HIS  69           1HD      HIS  69   9.907  11.810  -1.627
  515    HD2  HIS  69           2HD      HIS  69  12.076   9.028   0.569
  516    HE1  HIS  69           1HE      HIS  69  11.748  11.037  -3.154
  517    HE2  HIS  69           2HE      HIS  69  13.098   9.417  -1.776
  518    H    ALA  70           H        ALA  70   6.999   7.907   1.841
  519    HA   ALA  70           HA       ALA  70   8.621   6.710   3.815
  520   1HB   ALA  70          1HB       ALA  70   6.378   8.219   5.090
  521   2HB   ALA  70          2HB       ALA  70   7.940   8.995   4.833
  522   3HB   ALA  70          3HB       ALA  70   7.831   7.541   5.823
  523    H    ILE  71           H        ILE  71   6.898   5.936   1.651
  524    HA   ILE  71           HA       ILE  71   4.437   4.905   2.627
  525    HB   ILE  71           HB       ILE  71   5.969   3.834   0.265
  526   1HG1  ILE  71          2HG1      ILE  71   5.860   6.261   0.044
  527   2HG1  ILE  71          1HG1      ILE  71   4.749   5.505  -1.093
  528   1HG2  ILE  71          1HG2      ILE  71   3.963   2.601   1.093
  529   2HG2  ILE  71          2HG2      ILE  71   3.827   3.183  -0.566
  530   3HG2  ILE  71          3HG2      ILE  71   3.001   4.036   0.737
  531   1HD1  ILE  71          1HD1      ILE  71   2.892   6.258   0.013
  532   2HD1  ILE  71          2HD1      ILE  71   4.023   7.579   0.311
  533   3HD1  ILE  71          3HD1      ILE  71   3.726   6.373   1.562
  534    H    GLY  72           H        GLY  72   7.352   3.131   1.576
  535   1HA   GLY  72          2HA       GLY  72   6.544   0.759   2.971
  536   2HA   GLY  72          1HA       GLY  72   8.072   1.011   2.143
  537    H    GLN  73           H        GLN  73   8.205   3.589   3.908
  538    HA   GLN  73           HA       GLN  73   9.810   2.365   5.955
  539   1HB   GLN  73          2HB       GLN  73   9.147   5.213   5.242
  540   2HB   GLN  73          1HB       GLN  73  10.058   4.816   6.693
  541   1HG   GLN  73          2HG       GLN  73  11.046   3.584   4.217
  542   2HG   GLN  73          1HG       GLN  73  11.161   5.342   4.289
  543   1HE2  GLN  73          1HE2      GLN  73  13.409   3.781   4.160
  544   2HE2  GLN  73          2HE2      GLN  73  14.264   3.868   5.659
  545    H    MET  74           H        MET  74   6.585   3.581   5.691
  546    HA   MET  74           HA       MET  74   6.250   3.709   8.587
  547   1HB   MET  74          2HB       MET  74   4.677   4.623   6.230
  548   2HB   MET  74          1HB       MET  74   3.793   4.248   7.703
  549   1HG   MET  74          2HG       MET  74   5.804   5.788   8.673
  550   2HG   MET  74          1HG       MET  74   5.558   6.499   7.079
  551   1HE   MET  74          1HE       MET  74   1.895   7.661   7.135
  552   2HE   MET  74          2HE       MET  74   2.898   6.517   6.244
  553   3HE   MET  74          3HE       MET  74   3.478   8.157   6.536
  554    H    CYS  75           H        CYS  75   5.509   1.663   5.876
  555    HA   CYS  75           HA       CYS  75   4.038  -0.145   7.681
  556   1HB   CYS  75          2HB       CYS  75   2.581   0.723   5.925
  557   2HB   CYS  75          1HB       CYS  75   3.721   0.198   4.692
  558    HG   CYS  75           HG       CYS  75   1.676  -1.563   6.106
  559    H    GLU  76           H        GLU  76   4.325  -2.427   7.321
  560    HA   GLU  76           HA       GLU  76   7.003  -3.044   6.278
  561   1HB   GLU  76          2HB       GLU  76   6.970  -4.994   7.736
  562   2HB   GLU  76          1HB       GLU  76   6.639  -3.538   8.663
  563   1HG   GLU  76          2HG       GLU  76   4.563  -4.195   9.208
  564   2HG   GLU  76          1HG       GLU  76   4.268  -4.933   7.634
  565    H    ALA  77           H        ALA  77   4.665  -2.783   4.589
  566    HA   ALA  77           HA       ALA  77   4.530  -5.542   3.564
  567   1HB   ALA  77          1HB       ALA  77   2.304  -5.525   3.531
  568   2HB   ALA  77          2HB       ALA  77   2.253  -3.928   2.785
  569   3HB   ALA  77          3HB       ALA  77   2.387  -4.080   4.538
  570    HA   PRO  78           HA       PRO  78   5.654  -3.902  -0.379
  571   1HB   PRO  78          2HB       PRO  78   4.289  -5.373  -2.138
  572   2HB   PRO  78          1HB       PRO  78   5.471  -6.115  -1.053
  573   1HG   PRO  78          2HG       PRO  78   2.486  -6.038  -0.834
  574   2HG   PRO  78          1HG       PRO  78   3.594  -7.390  -0.537
  575   1HD   PRO  78          2HD       PRO  78   2.526  -5.792   1.438
  576   2HD   PRO  78          1HD       PRO  78   4.039  -6.706   1.599
  577    H    VAL  79           H        VAL  79   5.216  -2.027  -1.351
  578    HA   VAL  79           HA       VAL  79   2.426  -1.169  -1.632
  579    HB   VAL  79           HB       VAL  79   4.897   0.502  -2.091
  580   1HG1  VAL  79          1HG1      VAL  79   3.520   2.211  -2.504
  581   2HG1  VAL  79          2HG1      VAL  79   2.447   1.787  -1.171
  582   3HG1  VAL  79          3HG1      VAL  79   2.273   0.985  -2.731
  583   1HG2  VAL  79          1HG2      VAL  79   3.277   0.649   0.418
  584   2HG2  VAL  79          2HG2      VAL  79   4.934   1.174   0.121
  585   3HG2  VAL  79          3HG2      VAL  79   4.567  -0.544   0.270
  586    H    VAL  80           H        VAL  80   1.455  -1.014  -3.599
  587    HA   VAL  80           HA       VAL  80   3.135  -0.901  -5.994
  588    HB   VAL  80           HB       VAL  80   1.840  -2.701  -7.096
  589   1HG1  VAL  80          1HG1      VAL  80   2.886  -4.595  -5.815
  590   2HG1  VAL  80          2HG1      VAL  80   3.397  -3.406  -4.620
  591   3HG1  VAL  80          3HG1      VAL  80   3.984  -3.298  -6.279
  592   1HG2  VAL  80          1HG2      VAL  80   0.538  -4.258  -5.701
  593   2HG2  VAL  80          2HG2      VAL  80  -0.167  -2.642  -5.738
  594   3HG2  VAL  80          3HG2      VAL  80   0.744  -3.175  -4.325
  595    H    THR  81           H        THR  81   2.245   0.258  -7.631
  596    HA   THR  81           HA       THR  81   0.163   2.020  -7.214
  597    HB   THR  81           HB       THR  81   0.272   2.556  -9.517
  598    HG1  THR  81           1HG      THR  81   0.345   1.069 -10.974
  599   1HG2  THR  81          1HG2      THR  81   2.558   2.471  -8.122
  600   2HG2  THR  81          2HG2      THR  81   2.443   3.056  -9.782
  601   3HG2  THR  81          3HG2      THR  81   2.976   1.405  -9.464
  602    H    ARG  82           H        ARG  82  -1.907   2.123  -8.548
  603    HA   ARG  82           HA       ARG  82  -3.562  -0.034  -7.813
  604   1HB   ARG  82          2HB       ARG  82  -5.245   1.137  -9.352
  605   2HB   ARG  82          1HB       ARG  82  -4.642   2.032  -7.964
  606   1HG   ARG  82          2HG       ARG  82  -3.707   3.605  -9.245
  607   2HG   ARG  82          1HG       ARG  82  -3.039   2.422 -10.365
  608   1HD   ARG  82          2HD       ARG  82  -5.887   2.500 -10.646
  609   2HD   ARG  82          1HD       ARG  82  -5.241   4.137 -10.756
  610    HE   ARG  82           HE       ARG  82  -4.878   1.991 -12.642
  611   1HH1  ARG  82          1HH1      ARG  82  -3.620   5.026 -11.463
  612   2HH1  ARG  82          2HH1      ARG  82  -2.790   5.397 -12.935
  613   1HH2  ARG  82          1HH2      ARG  82  -3.785   2.478 -14.579
  614   2HH2  ARG  82          2HH2      ARG  82  -2.884   3.952 -14.706
  615    H    GLU  83           H        GLU  83  -1.526   0.385 -10.521
  616    HA   GLU  83           HA       GLU  83  -2.839  -0.903 -12.577
  617   1HB   GLU  83          2HB       GLU  83   0.040  -0.732 -11.776
  618   2HB   GLU  83          1HB       GLU  83  -0.418  -1.800 -13.094
  619   1HG   GLU  83          2HG       GLU  83  -1.511   0.920 -13.257
  620   2HG   GLU  83          1HG       GLU  83   0.243   0.802 -13.384
  621    H    TRP  84           H        TRP  84  -1.183  -2.297  -9.798
  622    HA   TRP  84           HA       TRP  84  -1.311  -5.000 -10.584
  623   1HB   TRP  84          2HB       TRP  84   0.080  -4.196  -8.715
  624   2HB   TRP  84          1HB       TRP  84  -1.368  -3.809  -7.803
  625    HD1  TRP  84           HD       TRP  84   0.506  -6.895  -9.185
  626    HE1  TRP  84           1HE      TRP  84  -0.105  -8.917  -7.713
  627    HE3  TRP  84           3HE      TRP  84  -2.997  -4.690  -6.189
  628    HZ2  TRP  84           2HZ      TRP  84  -1.847  -9.500  -5.565
  629    HZ3  TRP  84           3HZ      TRP  84  -4.090  -6.045  -4.453
  630    HH2  TRP  84           HH       TRP  84  -3.527  -8.400  -4.147
  631    H    VAL  85           H        VAL  85  -3.335  -3.170  -8.351
  632    HA   VAL  85           HA       VAL  85  -5.299  -5.069  -7.880
  633    HB   VAL  85           HB       VAL  85  -5.634  -2.067  -7.990
  634   1HG1  VAL  85          1HG1      VAL  85  -7.476  -4.245  -7.298
  635   2HG1  VAL  85          2HG1      VAL  85  -7.811  -2.584  -7.787
  636   3HG1  VAL  85          3HG1      VAL  85  -7.387  -2.943  -6.113
  637   1HG2  VAL  85          1HG2      VAL  85  -3.866  -2.792  -6.460
  638   2HG2  VAL  85          2HG2      VAL  85  -5.002  -3.881  -5.663
  639   3HG2  VAL  85          3HG2      VAL  85  -5.249  -2.136  -5.583
  640    H    LEU  86           H        LEU  86  -5.018  -2.746 -10.518
  641    HA   LEU  86           HA       LEU  86  -7.593  -3.374 -11.620
  642   1HB   LEU  86          2HB       LEU  86  -6.096  -1.223 -11.871
  643   2HB   LEU  86          1HB       LEU  86  -5.419  -2.105 -13.227
  644    HG   LEU  86           HG       LEU  86  -7.730  -2.310 -14.166
  645   1HD1  LEU  86          1HD1      LEU  86  -8.337  -0.865 -11.661
  646   2HD1  LEU  86          2HD1      LEU  86  -9.314  -2.011 -12.581
  647   3HD1  LEU  86          3HD1      LEU  86  -9.191  -0.333 -13.111
  648   1HD2  LEU  86          1HD2      LEU  86  -6.819   0.525 -13.691
  649   2HD2  LEU  86          2HD2      LEU  86  -7.795  -0.068 -15.035
  650   3HD2  LEU  86          3HD2      LEU  86  -6.112  -0.571 -14.879
  651    H    ASP  87           H        ASP  87  -4.239  -4.131 -12.506
  652    HA   ASP  87           HA       ASP  87  -4.817  -5.661 -14.781
  653   1HB   ASP  87          2HB       ASP  87  -2.558  -4.806 -14.167
  654   2HB   ASP  87          1HB       ASP  87  -2.482  -6.014 -12.888
  655    H    SER  88           H        SER  88  -4.779  -6.468 -11.373
  656    HA   SER  88           HA       SER  88  -4.981  -9.302 -11.793
  657   1HB   SER  88          2HB       SER  88  -5.463  -7.625  -9.319
  658   2HB   SER  88          1HB       SER  88  -5.428  -9.389  -9.349
  659    HG   SER  88           HG       SER  88  -3.321  -7.566  -9.798
  660    H    VAL  89           H        VAL  89  -7.256  -6.764 -10.749
  661    HA   VAL  89           HA       VAL  89  -9.495  -8.522 -10.652
  662    HB   VAL  89           HB       VAL  89  -9.502  -5.509 -10.875
  663   1HG1  VAL  89          1HG1      VAL  89 -11.694  -6.008 -11.234
  664   2HG1  VAL  89          2HG1      VAL  89 -11.691  -6.055  -9.471
  665   3HG1  VAL  89          3HG1      VAL  89 -11.597  -7.554 -10.394
  666   1HG2  VAL  89          1HG2      VAL  89  -8.347  -6.952  -8.871
  667   2HG2  VAL  89          2HG2      VAL  89  -9.989  -6.744  -8.261
  668   3HG2  VAL  89          3HG2      VAL  89  -9.022  -5.334  -8.688
  669    H    ALA  90           H        ALA  90  -8.012  -6.624 -13.163
  670    HA   ALA  90           HA       ALA  90 -10.211  -6.501 -14.938
  671   1HB   ALA  90          1HB       ALA  90  -7.255  -6.429 -15.537
  672   2HB   ALA  90          2HB       ALA  90  -8.282  -5.040 -15.183
  673   3HB   ALA  90          3HB       ALA  90  -8.540  -5.975 -16.655
  674    H    LEU  91           H        LEU  91  -7.370  -8.654 -14.915
  675    HA   LEU  91           HA       LEU  91  -8.746 -10.460 -16.753
  676   1HB   LEU  91          2HB       LEU  91  -6.479  -9.903 -17.337
  677   2HB   LEU  91          1HB       LEU  91  -5.907 -10.368 -15.746
  678    HG   LEU  91           HG       LEU  91  -7.280 -12.492 -17.272
  679   1HD1  LEU  91          1HD1      LEU  91  -4.610 -11.383 -18.117
  680   2HD1  LEU  91          2HD1      LEU  91  -6.074 -11.504 -19.094
  681   3HD1  LEU  91          3HD1      LEU  91  -5.227 -12.968 -18.587
  682   1HD2  LEU  91          1HD2      LEU  91  -5.859 -12.415 -14.989
  683   2HD2  LEU  91          2HD2      LEU  91  -4.582 -12.827 -16.133
  684   3HD2  LEU  91          3HD2      LEU  91  -6.010 -13.853 -15.998
  685    H    TYR  92           H        TYR  92  -8.558 -10.055 -13.479
  686    HA   TYR  92           HA       TYR  92  -8.987 -11.363 -11.674
  687   1HB   TYR  92          2HB       TYR  92 -10.968 -11.937 -13.078
  688   2HB   TYR  92          1HB       TYR  92 -10.075 -13.315 -13.711
  689    HD1  TYR  92           1HD      TYR  92 -11.578 -14.999 -12.958
  690    HD2  TYR  92           2HD      TYR  92  -9.935 -12.227 -10.171
  691    HE1  TYR  92           1HE      TYR  92 -12.399 -16.384 -11.101
  692    HE2  TYR  92           2HE      TYR  92 -10.756 -13.606  -8.314
  693    HH   TYR  92           HH       TYR  92 -11.397 -16.463  -8.280
  694    H    GLN  93           H        GLN  93  -6.642 -11.570 -11.480
  695    HA   GLN  93           HA       GLN  93  -5.850 -14.210 -10.962
  696   1HB   GLN  93          2HB       GLN  93  -5.739 -14.182 -13.500
  697   2HB   GLN  93          1HB       GLN  93  -4.416 -13.035 -13.344
  698   1HG   GLN  93          2HG       GLN  93  -3.024 -14.742 -13.191
  699   2HG   GLN  93          1HG       GLN  93  -3.770 -15.164 -11.650
  700   1HE2  GLN  93          1HE2      GLN  93  -5.501 -16.687 -11.657
  701   2HE2  GLN  93          2HE2      GLN  93  -5.626 -17.864 -12.916
  702    H    CYS  94           H        CYS  94  -4.217 -14.183  -9.522
  703    HA   CYS  94           HA       CYS  94  -3.302 -11.781  -8.428
  704   1HB   CYS  94          2HB       CYS  94  -3.334 -14.225  -7.474
  705   2HB   CYS  94          1HB       CYS  94  -1.705 -14.298  -8.137
  706    HG   CYS  94           HG       CYS  94  -2.576 -12.672  -5.686
  707    H    GLN  95           H        GLN  95  -2.300 -10.386  -9.809
  708    HA   GLN  95           HA       GLN  95  -0.184 -11.267 -11.565
  709   1HB   GLN  95          2HB       GLN  95  -0.878  -8.405 -10.933
  710   2HB   GLN  95          1HB       GLN  95  -0.134  -9.047 -12.390
  711   1HG   GLN  95          2HG       GLN  95  -2.955  -9.637 -11.534
  712   2HG   GLN  95          1HG       GLN  95  -2.502  -8.359 -12.659
  713   1HE2  GLN  95          1HE2      GLN  95  -0.701  -9.437 -14.269
  714   2HE2  GLN  95          2HE2      GLN  95  -1.337 -10.804 -15.114
  715    H    GLU  96           H        GLU  96   1.954 -10.156 -11.545
  716    HA   GLU  96           HA       GLU  96   3.165 -10.442  -8.980
  717   1HB   GLU  96          2HB       GLU  96   5.218  -9.561 -10.212
  718   2HB   GLU  96          1HB       GLU  96   4.520 -11.060 -10.806
  719   1HG   GLU  96          2HG       GLU  96   3.326  -8.823 -12.145
  720   2HG   GLU  96          1HG       GLU  96   5.083  -8.734 -12.252
  721    H    LEU  97           H        LEU  97   3.981  -8.908  -7.602
  722    HA   LEU  97           HA       LEU  97   2.798  -6.270  -7.827
  723   1HB   LEU  97          2HB       LEU  97   4.078  -7.867  -5.671
  724   2HB   LEU  97          1HB       LEU  97   4.133  -6.120  -5.524
  725    HG   LEU  97           HG       LEU  97   1.511  -6.448  -6.062
  726   1HD1  LEU  97          1HD1      LEU  97   1.345  -8.763  -6.143
  727   2HD1  LEU  97          2HD1      LEU  97   0.853  -8.380  -4.494
  728   3HD1  LEU  97          3HD1      LEU  97   2.477  -8.989  -4.811
  729   1HD2  LEU  97          1HD2      LEU  97   1.219  -5.639  -3.979
  730   2HD2  LEU  97          2HD2      LEU  97   2.979  -5.515  -4.004
  731   3HD2  LEU  97          3HD2      LEU  97   2.203  -6.901  -3.236
  732    H    ASP  98           H        ASP  98   5.971  -7.757  -7.921
  733    HA   ASP  98           HA       ASP  98   7.588  -5.513  -7.644
  734   1HB   ASP  98          2HB       ASP  98   8.110  -8.107  -7.974
  735   2HB   ASP  98          1HB       ASP  98   8.388  -7.581  -9.631
  736    H    THR  99           H        THR  99   5.551  -6.441 -10.274
  737    HA   THR  99           HA       THR  99   6.892  -4.901 -12.282
  738    HB   THR  99           HB       THR  99   4.449  -5.219 -13.333
  739    HG1  THR  99           1HG      THR  99   3.303  -6.714 -12.376
  740   1HG2  THR  99          1HG2      THR  99   6.364  -6.212 -14.349
  741   2HG2  THR  99          2HG2      THR  99   5.135  -7.460 -14.136
  742   3HG2  THR  99          3HG2      THR  99   6.514  -7.382 -13.039
  743    H    TYR 100           H        TYR 100   4.804  -4.106  -9.711
  744    HA   TYR 100           HA       TYR 100   4.510  -1.404 -10.803
  745   1HB   TYR 100          2HB       TYR 100   2.225  -2.774  -9.388
  746   2HB   TYR 100          1HB       TYR 100   2.199  -1.247 -10.263
  747    HD1  TYR 100           1HD      TYR 100   1.615  -4.750 -10.465
  748    HD2  TYR 100           2HD      TYR 100   2.652  -1.348 -12.801
  749    HE1  TYR 100           1HE      TYR 100   0.902  -5.935 -12.499
  750    HE2  TYR 100           2HE      TYR 100   1.939  -2.522 -14.840
  751    HH   TYR 100           HH       TYR 100   0.033  -4.839 -15.058
  752    H    LEU 101           H        LEU 101   6.105  -2.853  -8.653
  753    HA   LEU 101           HA       LEU 101   5.152  -1.707  -6.186
  754   1HB   LEU 101          2HB       LEU 101   6.940  -3.755  -6.927
  755   2HB   LEU 101          1HB       LEU 101   7.894  -2.558  -6.078
  756    HG   LEU 101           HG       LEU 101   5.384  -3.243  -4.727
  757   1HD1  LEU 101          1HD1      LEU 101   6.072  -5.415  -3.961
  758   2HD1  LEU 101          2HD1      LEU 101   7.553  -5.324  -4.914
  759   3HD1  LEU 101          3HD1      LEU 101   5.989  -5.427  -5.722
  760   1HD2  LEU 101          1HD2      LEU 101   6.737  -3.147  -2.789
  761   2HD2  LEU 101          2HD2      LEU 101   7.297  -1.852  -3.846
  762   3HD2  LEU 101          3HD2      LEU 101   8.217  -3.351  -3.724
  763    H    ILE 102           H        ILE 102   6.590  -0.311  -4.852
  764    HA   ILE 102           HA       ILE 102   7.288   2.033  -6.292
  765    HB   ILE 102           HB       ILE 102   8.149   2.860  -4.103
  766   1HG1  ILE 102          2HG1      ILE 102   7.129   0.969  -2.317
  767   2HG1  ILE 102          1HG1      ILE 102   8.022   0.018  -3.499
  768   1HG2  ILE 102          1HG2      ILE 102   5.425   1.887  -4.629
  769   2HG2  ILE 102          2HG2      ILE 102   5.996   3.503  -4.216
  770   3HG2  ILE 102          3HG2      ILE 102   5.773   2.296  -2.950
  771   1HD1  ILE 102          1HD1      ILE 102  10.006   0.760  -2.777
  772   2HD1  ILE 102          2HD1      ILE 102   9.110   1.163  -1.312
  773   3HD1  ILE 102          3HD1      ILE 102   9.419   2.404  -2.526
  774    HA   PRO 103           HA       PRO 103  11.503   1.014  -7.264
  775   1HB   PRO 103          2HB       PRO 103  12.386   3.462  -7.969
  776   2HB   PRO 103          1HB       PRO 103  11.266   2.540  -8.978
  777   1HG   PRO 103          2HG       PRO 103  10.693   4.772  -7.066
  778   2HG   PRO 103          1HG       PRO 103  10.042   4.499  -8.693
  779   1HD   PRO 103          2HD       PRO 103   8.683   3.865  -6.419
  780   2HD   PRO 103          1HD       PRO 103   8.477   2.989  -7.948
  781    H    GLN 104           H        GLN 104  13.766   2.099  -6.829
  782    HA   GLN 104           HA       GLN 104  13.899   3.300  -4.172
  783   1HB   GLN 104          2HB       GLN 104  14.024   0.722  -4.073
  784   2HB   GLN 104          1HB       GLN 104  15.618   0.911  -4.790
  785   1HG   GLN 104          2HG       GLN 104  16.449   1.220  -2.768
  786   2HG   GLN 104          1HG       GLN 104  15.514   2.710  -2.640
  787   1HE2  GLN 104          1HE2      GLN 104  15.424   2.283  -0.371
  788   2HE2  GLN 104          2HE2      GLN 104  14.268   1.166   0.260
  789    H    ILE 105           H        ILE 105  16.113   1.811  -6.543
  790    HA   ILE 105           HA       ILE 105  17.355   4.399  -7.019
  791    HB   ILE 105           HB       ILE 105  18.607   3.525  -5.102
  792   1HG1  ILE 105          2HG1      ILE 105  20.777   3.101  -6.892
  793   2HG1  ILE 105          1HG1      ILE 105  19.698   4.271  -7.644
  794   1HG2  ILE 105          1HG2      ILE 105  18.134   1.096  -5.792
  795   2HG2  ILE 105          2HG2      ILE 105  19.693   1.467  -5.056
  796   3HG2  ILE 105          3HG2      ILE 105  19.571   1.253  -6.802
  797   1HD1  ILE 105          1HD1      ILE 105  19.910   5.095  -4.999
  798   2HD1  ILE 105          2HD1      ILE 105  20.680   5.820  -6.411
  799   3HD1  ILE 105          3HD1      ILE 105  21.539   4.607  -5.462
  800    HA   PRO 106           HA       PRO 106  16.972   2.450 -11.087
  801   1HB   PRO 106          2HB       PRO 106  18.628   4.845 -11.736
  802   2HB   PRO 106          1HB       PRO 106  17.179   4.227 -12.539
  803   1HG   PRO 106          2HG       PRO 106  17.040   6.356 -10.952
  804   2HG   PRO 106          1HG       PRO 106  15.751   5.139 -10.953
  805   1HD   PRO 106          2HD       PRO 106  17.909   5.615  -8.950
  806   2HD   PRO 106          1HD       PRO 106  16.236   5.079  -8.702
  807    H    HIS 107           H        HIS 107  18.354   0.683 -10.570
  808    HA   HIS 107           HA       HIS 107  20.763   0.605 -12.003
  809   1HB   HIS 107          2HB       HIS 107  21.409   1.990  -9.929
  810   2HB   HIS 107          1HB       HIS 107  21.269   0.479  -9.037
  811    HD1  HIS 107           1HD      HIS 107  22.645  -1.493 -10.841
  812    HD2  HIS 107           2HD      HIS 107  24.071   2.361 -10.225
  813    HE1  HIS 107           1HE      HIS 107  25.095  -1.586 -11.399
  814    HE2  HIS 107           2HE      HIS 107  25.954   0.737 -10.939
  815    H    SER 108           H        SER 108  20.883  -1.431 -12.655
  816    HA   SER 108           HA       SER 108  20.356  -3.595 -10.766
  817   1HB   SER 108          2HB       SER 108  18.999  -3.431 -13.467
  818   2HB   SER 108          1HB       SER 108  18.857  -4.753 -12.309
  819    HG   SER 108           HG       SER 108  17.391  -3.649 -11.304
  820    H    HIS 109           H        HIS 109  22.635  -3.890 -10.905
  821    HA   HIS 109           HA       HIS 109  23.404  -5.508 -13.206
  822   1HB   HIS 109          2HB       HIS 109  24.228  -2.857 -13.022
  823   2HB   HIS 109          1HB       HIS 109  25.603  -3.771 -12.409
  824    HD1  HIS 109           1HD      HIS 109  27.206  -4.374 -14.179
  825    HD2  HIS 109           2HD      HIS 109  23.328  -4.117 -15.647
  826    HE1  HIS 109           1HE      HIS 109  27.387  -4.849 -16.641
  827    HE2  HIS 109           2HE      HIS 109  25.018  -4.772 -17.493
  828    H    TYR 110           H        TYR 110  25.157  -4.050 -10.469
  829    HA   TYR 110           HA       TYR 110  26.480  -6.496  -9.852
  830   1HB   TYR 110          2HB       TYR 110  27.366  -4.161  -9.419
  831   2HB   TYR 110          1HB       TYR 110  26.249  -4.076  -8.060
  832    HD1  TYR 110           1HD      TYR 110  28.369  -6.908  -9.241
  833    HD2  TYR 110           2HD      TYR 110  27.581  -4.089  -6.153
  834    HE1  TYR 110           1HE      TYR 110  30.035  -8.016  -7.812
  835    HE2  TYR 110           2HE      TYR 110  29.246  -5.188  -4.716
  836    HH   TYR 110           HH       TYR 110  30.578  -8.239  -5.448
  Start of MODEL   13
    1   1H    GLY   1          1HT       GLY   1 -22.091 -18.104  -3.882
    2   2H    GLY   1          2HT       GLY   1 -23.464 -17.118  -3.939
    3   3H    GLY   1          3HT       GLY   1 -23.593 -18.717  -3.401
    4   1HA   GLY   1          1HA       GLY   1 -23.581 -16.874  -1.652
    5   2HA   GLY   1          2HA       GLY   1 -22.580 -18.294  -1.386
    6    H    SER   2           H        SER   2 -20.643 -17.811  -0.621
    7    HA   SER   2           HA       SER   2 -19.442 -15.229  -1.356
    8   1HB   SER   2          2HB       SER   2 -17.930 -15.945   0.716
    9   2HB   SER   2          1HB       SER   2 -19.487 -15.147   0.941
   10    HG   SER   2           HG       SER   2 -19.972 -16.847   2.068
   11    H    GLN   3           H        GLN   3 -18.432 -18.556  -0.552
   12    HA   GLN   3           HA       GLN   3 -15.920 -18.250  -1.902
   13   1HB   GLN   3          2HB       GLN   3 -16.775 -19.892   0.073
   14   2HB   GLN   3          1HB       GLN   3 -16.907 -20.975  -1.306
   15   1HG   GLN   3          2HG       GLN   3 -14.574 -20.648  -1.834
   16   2HG   GLN   3          1HG       GLN   3 -14.419 -19.465  -0.536
   17   1HE2  GLN   3          1HE2      GLN   3 -13.609 -22.462  -1.306
   18   2HE2  GLN   3          2HE2      GLN   3 -13.640 -23.224   0.244
   19    H    ASP   4           H        ASP   4 -15.754 -18.219  -4.038
   20    HA   ASP   4           HA       ASP   4 -17.237 -20.205  -5.597
   21   1HB   ASP   4          2HB       ASP   4 -18.128 -17.666  -5.564
   22   2HB   ASP   4          1HB       ASP   4 -16.932 -17.537  -6.850
   23    H    ARG   5           H        ARG   5 -14.945 -17.537  -6.092
   24    HA   ARG   5           HA       ARG   5 -12.758 -19.183  -6.735
   25   1HB   ARG   5          2HB       ARG   5 -14.520 -19.282  -8.766
   26   2HB   ARG   5          1HB       ARG   5 -13.620 -17.846  -9.236
   27   1HG   ARG   5          2HG       ARG   5 -11.743 -19.830  -8.487
   28   2HG   ARG   5          1HG       ARG   5 -12.920 -20.578  -9.566
   29   1HD   ARG   5          2HD       ARG   5 -12.167 -19.449 -11.346
   30   2HD   ARG   5          1HD       ARG   5 -12.063 -17.934 -10.451
   31    HE   ARG   5           HE       ARG   5  -9.980 -19.754  -9.743
   32   1HH1  ARG   5          1HH1      ARG   5 -10.969 -17.406 -12.128
   33   2HH1  ARG   5          2HH1      ARG   5  -9.349 -17.029 -12.609
   34   1HH2  ARG   5          1HH2      ARG   5  -7.849 -19.259 -10.375
   35   2HH2  ARG   5          2HH2      ARG   5  -7.577 -18.080 -11.615
   36    H    LYS   6           H        LYS   6 -11.915 -17.601  -5.281
   37    HA   LYS   6           HA       LYS   6 -11.590 -14.901  -6.376
   38   1HB   LYS   6          2HB       LYS   6 -10.562 -15.637  -3.673
   39   2HB   LYS   6          1HB       LYS   6 -11.260 -14.128  -4.234
   40   1HG   LYS   6          2HG       LYS   6 -12.917 -16.604  -3.896
   41   2HG   LYS   6          1HG       LYS   6 -12.604 -15.488  -2.566
   42   1HD   LYS   6          2HD       LYS   6 -13.483 -13.653  -4.065
   43   2HD   LYS   6          1HD       LYS   6 -14.026 -14.925  -5.159
   44   1HE   LYS   6          2HE       LYS   6 -15.920 -14.855  -3.960
   45   2HE   LYS   6          1HE       LYS   6 -15.013 -15.801  -2.781
   46   1HZ   LYS   6          1HZ       LYS   6 -15.855 -13.024  -2.676
   47   2HZ   LYS   6          2HZ       LYS   6 -14.303 -13.339  -2.081
   48   3HZ   LYS   6          3HZ       LYS   6 -15.639 -14.139  -1.422
   49    H    ILE   7           H        ILE   7  -9.663 -14.127  -7.047
   50    HA   ILE   7           HA       ILE   7  -7.529 -15.989  -7.482
   51    HB   ILE   7           HB       ILE   7  -6.342 -14.007  -8.453
   52   1HG1  ILE   7          2HG1      ILE   7  -8.634 -12.323  -8.755
   53   2HG1  ILE   7          1HG1      ILE   7  -8.370 -12.605  -7.038
   54   1HG2  ILE   7          1HG2      ILE   7  -8.864 -15.198  -9.374
   55   2HG2  ILE   7          2HG2      ILE   7  -7.292 -15.105 -10.169
   56   3HG2  ILE   7          3HG2      ILE   7  -8.381 -13.720 -10.203
   57   1HD1  ILE   7          1HD1      ILE   7  -7.089 -10.749  -7.384
   58   2HD1  ILE   7          2HD1      ILE   7  -6.642 -11.224  -9.023
   59   3HD1  ILE   7          3HD1      ILE   7  -5.894 -12.021  -7.638
   60    H    PHE   8           H        PHE   8  -8.226 -13.590  -5.086
   61    HA   PHE   8           HA       PHE   8  -5.455 -13.526  -4.175
   62   1HB   PHE   8          2HB       PHE   8  -7.931 -12.023  -3.326
   63   2HB   PHE   8          1HB       PHE   8  -6.417 -11.921  -2.447
   64    HD1  PHE   8           1HD      PHE   8  -4.737 -12.085  -5.120
   65    HD2  PHE   8           2HD      PHE   8  -7.956  -9.652  -3.763
   66    HE1  PHE   8           1HE      PHE   8  -3.998 -10.274  -6.611
   67    HE2  PHE   8           2HE      PHE   8  -7.222  -7.843  -5.252
   68    HZ   PHE   8           HZ       PHE   8  -5.242  -8.150  -6.677
   69    H    ARG   9           H        ARG   9  -8.670 -14.326  -2.887
   70    HA   ARG   9           HA       ARG   9  -9.293 -15.494  -1.008
   71   1HB   ARG   9          2HB       ARG   9  -8.766 -17.201  -2.779
   72   2HB   ARG   9          1HB       ARG   9  -7.191 -17.408  -2.023
   73   1HG   ARG   9          2HG       ARG   9  -9.396 -17.644  -0.137
   74   2HG   ARG   9          1HG       ARG   9  -9.463 -18.831  -1.441
   75   1HD   ARG   9          2HD       ARG   9  -6.834 -18.928  -0.783
   76   2HD   ARG   9          1HD       ARG   9  -7.558 -18.562   0.782
   77    HE   ARG   9           HE       ARG   9  -9.035 -20.632  -0.312
   78   1HH1  ARG   9          1HH1      ARG   9  -5.743 -20.090   0.712
   79   2HH1  ARG   9          2HH1      ARG   9  -5.470 -21.745   1.138
   80   1HH2  ARG   9          1HH2      ARG   9  -8.677 -22.811   0.247
   81   2HH2  ARG   9          2HH2      ARG   9  -7.135 -23.291   0.874
   82    H    GLY  10           H        GLY  10  -8.515 -14.111   0.629
   83   1HA   GLY  10          2HA       GLY  10  -7.501 -14.052   2.748
   84   2HA   GLY  10          1HA       GLY  10  -6.396 -15.315   2.227
   85    H    LEU  11           H        LEU  11  -7.174 -11.904   1.758
   86    HA   LEU  11           HA       LEU  11  -4.335 -11.271   1.739
   87   1HB   LEU  11          2HB       LEU  11  -5.924 -11.384  -0.640
   88   2HB   LEU  11          1HB       LEU  11  -5.444  -9.725  -0.350
   89    HG   LEU  11           HG       LEU  11  -3.264 -11.674  -0.076
   90   1HD1  LEU  11          1HD1      LEU  11  -4.588 -12.664  -1.920
   91   2HD1  LEU  11          2HD1      LEU  11  -3.000 -12.089  -2.426
   92   3HD1  LEU  11          3HD1      LEU  11  -4.441 -11.140  -2.794
   93   1HD2  LEU  11          1HD2      LEU  11  -3.488  -9.205  -1.777
   94   2HD2  LEU  11          2HD2      LEU  11  -2.023  -9.985  -1.181
   95   3HD2  LEU  11          3HD2      LEU  11  -3.105  -9.162  -0.056
   96    H    GLU  12           H        GLU  12  -3.941  -8.924   1.830
   97    HA   GLU  12           HA       GLU  12  -6.221  -7.366   2.792
   98   1HB   GLU  12          2HB       GLU  12  -3.690  -7.946   4.303
   99   2HB   GLU  12          1HB       GLU  12  -4.599  -6.473   4.605
  100   1HG   GLU  12          2HG       GLU  12  -6.532  -8.424   4.706
  101   2HG   GLU  12          1HG       GLU  12  -5.130  -9.202   5.443
  102    H    ILE  13           H        ILE  13  -6.297  -5.723   1.398
  103    HA   ILE  13           HA       ILE  13  -3.774  -4.344   0.751
  104    HB   ILE  13           HB       ILE  13  -6.147  -4.584  -1.097
  105   1HG1  ILE  13          2HG1      ILE  13  -3.790  -5.871  -2.097
  106   2HG1  ILE  13          1HG1      ILE  13  -4.149  -6.516  -0.499
  107   1HG2  ILE  13          1HG2      ILE  13  -3.353  -3.548  -1.561
  108   2HG2  ILE  13          2HG2      ILE  13  -4.812  -2.568  -1.415
  109   3HG2  ILE  13          3HG2      ILE  13  -4.625  -3.673  -2.776
  110   1HD1  ILE  13          1HD1      ILE  13  -5.675  -6.730  -3.023
  111   2HD1  ILE  13          2HD1      ILE  13  -6.589  -6.649  -1.516
  112   3HD1  ILE  13          3HD1      ILE  13  -5.396  -7.925  -1.756
  113    H    CYS  14           H        CYS  14  -3.743  -2.155   0.902
  114    HA   CYS  14           HA       CYS  14  -6.279  -0.813   1.562
  115   1HB   CYS  14          2HB       CYS  14  -5.085   0.589   3.174
  116   2HB   CYS  14          1HB       CYS  14  -4.961  -1.113   3.600
  117    HG   CYS  14           HG       CYS  14  -2.605  -0.193   3.881
  118    H    CYS  15           H        CYS  15  -6.570   1.255   0.805
  119    HA   CYS  15           HA       CYS  15  -4.758   2.054  -1.350
  120   1HB   CYS  15          2HB       CYS  15  -6.641   3.574  -2.004
  121   2HB   CYS  15          1HB       CYS  15  -7.055   1.864  -2.030
  122    HG   CYS  15           HG       CYS  15  -7.997   3.779   0.236
  123    H    TYR  16           H        TYR  16  -3.146   3.289  -0.590
  124    HA   TYR  16           HA       TYR  16  -3.702   5.300   1.452
  125   1HB   TYR  16          2HB       TYR  16  -1.553   3.636   1.059
  126   2HB   TYR  16          1HB       TYR  16  -0.968   5.156   0.390
  127    HD1  TYR  16           1HD      TYR  16  -2.407   3.613   3.442
  128    HD2  TYR  16           2HD      TYR  16  -0.272   6.907   1.802
  129    HE1  TYR  16           1HE      TYR  16  -1.910   4.413   5.714
  130    HE2  TYR  16           2HE      TYR  16   0.234   7.716   4.068
  131    HH   TYR  16           HH       TYR  16  -0.734   7.499   6.360
  132    H    GLY  17           H        GLY  17  -4.628   7.066   0.580
  133   1HA   GLY  17          2HA       GLY  17  -4.039   9.234  -0.369
  134   2HA   GLY  17          1HA       GLY  17  -3.168   8.373  -1.630
  135    HA   PRO  18           HA       PRO  18  -7.654   9.132  -2.906
  136   1HB   PRO  18          2HB       PRO  18  -7.598  11.529  -4.082
  137   2HB   PRO  18          1HB       PRO  18  -7.758  11.374  -2.328
  138   1HG   PRO  18          2HG       PRO  18  -5.345  12.044  -3.961
  139   2HG   PRO  18          1HG       PRO  18  -5.883  12.737  -2.420
  140   1HD   PRO  18          2HD       PRO  18  -3.938  10.782  -2.686
  141   2HD   PRO  18          1HD       PRO  18  -4.862  11.099  -1.205
  142    H    PHE  19           H        PHE  19  -4.613   8.961  -4.321
  143    HA   PHE  19           HA       PHE  19  -3.860   8.297  -6.355
  144   1HB   PHE  19          2HB       PHE  19  -6.767   7.556  -6.704
  145   2HB   PHE  19          1HB       PHE  19  -5.523   7.177  -7.890
  146    HD1  PHE  19           1HD      PHE  19  -5.991   6.876  -4.202
  147    HD2  PHE  19           2HD      PHE  19  -4.707   5.035  -7.817
  148    HE1  PHE  19           1HE      PHE  19  -5.447   4.824  -2.958
  149    HE2  PHE  19           2HE      PHE  19  -4.163   2.980  -6.580
  150    HZ   PHE  19           HZ       PHE  19  -4.534   2.872  -4.148
  151    H    THR  20           H        THR  20  -7.030   9.335  -7.523
  152    HA   THR  20           HA       THR  20  -5.815  11.734  -8.680
  153    HB   THR  20           HB       THR  20  -5.626  10.299 -10.529
  154    HG1  THR  20           1HG      THR  20  -6.595  11.738 -11.680
  155   1HG2  THR  20          1HG2      THR  20  -8.452   9.353 -10.356
  156   2HG2  THR  20          2HG2      THR  20  -7.164   8.522  -9.484
  157   3HG2  THR  20          3HG2      THR  20  -7.093   8.663 -11.240
  158    H    ASN  21           H        ASN  21  -8.880   9.914  -8.487
  159    HA   ASN  21           HA       ASN  21 -10.254  12.474  -8.015
  160   1HB   ASN  21          2HB       ASN  21 -10.803  10.472  -9.889
  161   2HB   ASN  21          1HB       ASN  21 -12.028  10.265  -8.642
  162   1HD2  ASN  21          1HD2      ASN  21 -10.911  12.183 -11.239
  163   2HD2  ASN  21          2HD2      ASN  21 -12.171  13.364 -11.209
  164    H    MET  22           H        MET  22 -11.136   9.093  -7.340
  165    HA   MET  22           HA       MET  22 -10.828   9.258  -4.546
  166   1HB   MET  22          2HB       MET  22 -12.704  10.869  -4.799
  167   2HB   MET  22          1HB       MET  22 -13.677   9.586  -5.504
  168   1HG   MET  22          2HG       MET  22 -13.062   8.350  -3.264
  169   2HG   MET  22          1HG       MET  22 -12.832  10.001  -2.689
  170   1HE   MET  22          1HE       MET  22 -14.776   7.781  -1.638
  171   2HE   MET  22          2HE       MET  22 -16.385   8.487  -1.483
  172   3HE   MET  22          3HE       MET  22 -14.985   9.332  -0.825
  173    HA   PRO  23           HA       PRO  23 -11.918   5.082  -6.328
  174   1HB   PRO  23          2HB       PRO  23  -9.533   4.070  -6.913
  175   2HB   PRO  23          1HB       PRO  23 -10.308   5.226  -8.004
  176   1HG   PRO  23          2HG       PRO  23  -8.100   5.659  -6.038
  177   2HG   PRO  23          1HG       PRO  23  -8.306   6.340  -7.661
  178   1HD   PRO  23          2HD       PRO  23  -8.949   7.619  -5.259
  179   2HD   PRO  23          1HD       PRO  23  -9.517   8.092  -6.871
  180    H    THR  24           H        THR  24 -11.066   6.227  -3.572
  181    HA   THR  24           HA       THR  24  -9.468   4.341  -2.257
  182    HB   THR  24           HB       THR  24 -11.313   5.326  -0.370
  183    HG1  THR  24           1HG      THR  24 -11.905   7.219  -1.036
  184   1HG2  THR  24          1HG2      THR  24  -9.188   5.417   0.400
  185   2HG2  THR  24          2HG2      THR  24  -9.370   7.095  -0.111
  186   3HG2  THR  24          3HG2      THR  24  -8.526   5.944  -1.147
  187    H    ASP  25           H        ASP  25 -13.012   4.551  -2.531
  188    HA   ASP  25           HA       ASP  25 -13.307   1.994  -1.185
  189   1HB   ASP  25          2HB       ASP  25 -15.308   3.955  -2.315
  190   2HB   ASP  25          1HB       ASP  25 -15.768   2.409  -1.610
  191    H    GLN  26           H        GLN  26 -13.292   3.316  -4.379
  192    HA   GLN  26           HA       GLN  26 -14.555   1.109  -5.669
  193   1HB   GLN  26          2HB       GLN  26 -13.944   3.658  -6.403
  194   2HB   GLN  26          1HB       GLN  26 -12.677   2.765  -7.230
  195   1HG   GLN  26          2HG       GLN  26 -14.769   1.268  -7.934
  196   2HG   GLN  26          1HG       GLN  26 -15.591   2.809  -7.692
  197   1HE2  GLN  26          1HE2      GLN  26 -12.433   1.878  -9.016
  198   2HE2  GLN  26          2HE2      GLN  26 -12.624   2.712 -10.517
  199    H    LEU  27           H        LEU  27 -11.262   1.982  -4.850
  200    HA   LEU  27           HA       LEU  27 -10.039  -0.078  -6.407
  201   1HB   LEU  27          2HB       LEU  27  -8.830   1.956  -5.738
  202   2HB   LEU  27          1HB       LEU  27  -8.965   1.483  -4.055
  203    HG   LEU  27           HG       LEU  27  -7.624  -0.573  -4.618
  204   1HD1  LEU  27          1HD1      LEU  27  -6.766  -0.957  -6.669
  205   2HD1  LEU  27          2HD1      LEU  27  -6.578   0.758  -7.034
  206   3HD1  LEU  27          3HD1      LEU  27  -8.160  -0.007  -7.186
  207   1HD2  LEU  27          1HD2      LEU  27  -5.526   1.061  -5.166
  208   2HD2  LEU  27          2HD2      LEU  27  -6.212   0.816  -3.560
  209   3HD2  LEU  27          3HD2      LEU  27  -6.700   2.210  -4.524
  210    H    GLU  28           H        GLU  28 -10.790   0.304  -2.948
  211    HA   GLU  28           HA       GLU  28  -9.818  -2.219  -2.162
  212   1HB   GLU  28          2HB       GLU  28 -11.944  -0.472  -0.915
  213   2HB   GLU  28          1HB       GLU  28 -11.287  -1.922  -0.170
  214   1HG   GLU  28          2HG       GLU  28  -8.998  -0.743  -0.516
  215   2HG   GLU  28          1HG       GLU  28  -9.983   0.710  -0.641
  216    H    TRP  29           H        TRP  29 -12.785  -1.224  -3.681
  217    HA   TRP  29           HA       TRP  29 -14.336  -3.502  -3.036
  218   1HB   TRP  29          2HB       TRP  29 -15.618  -1.745  -3.875
  219   2HB   TRP  29          1HB       TRP  29 -14.458  -1.371  -5.143
  220    HD1  TRP  29           HD       TRP  29 -16.885  -4.279  -4.302
  221    HE1  TRP  29           1HE      TRP  29 -17.909  -5.123  -6.508
  222    HE3  TRP  29           3HE      TRP  29 -14.378  -1.249  -7.564
  223    HZ2  TRP  29           2HZ      TRP  29 -17.679  -4.577  -9.269
  224    HZ3  TRP  29           3HZ      TRP  29 -14.836  -1.474  -9.971
  225    HH2  TRP  29           HH       TRP  29 -16.450  -3.105 -10.804
  226    H    MET  30           H        MET  30 -12.350  -2.678  -5.835
  227    HA   MET  30           HA       MET  30 -12.713  -4.958  -7.359
  228   1HB   MET  30          2HB       MET  30 -10.131  -3.414  -7.055
  229   2HB   MET  30          1HB       MET  30 -10.590  -4.427  -8.413
  230   1HG   MET  30          2HG       MET  30 -12.662  -2.722  -8.394
  231   2HG   MET  30          1HG       MET  30 -11.398  -1.682  -7.740
  232   1HE   MET  30          1HE       MET  30 -12.389  -0.392  -9.954
  233   2HE   MET  30          2HE       MET  30 -11.233  -0.309 -11.282
  234   3HE   MET  30          3HE       MET  30 -10.711   0.045  -9.634
  235    H    VAL  31           H        VAL  31 -10.170  -4.368  -4.916
  236    HA   VAL  31           HA       VAL  31  -8.973  -6.893  -5.083
  237    HB   VAL  31           HB       VAL  31  -8.063  -6.481  -2.844
  238   1HG1  VAL  31          1HG1      VAL  31  -6.556  -5.083  -3.713
  239   2HG1  VAL  31          2HG1      VAL  31  -7.740  -3.783  -3.860
  240   3HG1  VAL  31          3HG1      VAL  31  -7.600  -4.998  -5.133
  241   1HG2  VAL  31          1HG2      VAL  31  -9.851  -4.067  -2.818
  242   2HG2  VAL  31          2HG2      VAL  31  -8.605  -4.436  -1.629
  243   3HG2  VAL  31          3HG2      VAL  31 -10.009  -5.487  -1.786
  244    H    GLN  32           H        GLN  32 -11.560  -5.714  -2.963
  245    HA   GLN  32           HA       GLN  32 -11.937  -8.042  -1.463
  246   1HB   GLN  32          2HB       GLN  32 -13.000  -5.641  -1.274
  247   2HB   GLN  32          1HB       GLN  32 -14.277  -6.350  -2.252
  248   1HG   GLN  32          2HG       GLN  32 -14.906  -7.832  -0.594
  249   2HG   GLN  32          1HG       GLN  32 -13.355  -7.717   0.237
  250   1HE2  GLN  32          1HE2      GLN  32 -14.728  -7.414   2.127
  251   2HE2  GLN  32          2HE2      GLN  32 -15.303  -5.828   2.498
  252    H    LEU  33           H        LEU  33 -13.064  -7.115  -4.634
  253    HA   LEU  33           HA       LEU  33 -14.925  -9.235  -4.984
  254   1HB   LEU  33          2HB       LEU  33 -14.901  -7.096  -6.274
  255   2HB   LEU  33          1HB       LEU  33 -13.459  -7.656  -7.096
  256    HG   LEU  33           HG       LEU  33 -14.701  -9.503  -8.083
  257   1HD1  LEU  33          1HD1      LEU  33 -16.600  -8.841  -6.032
  258   2HD1  LEU  33          2HD1      LEU  33 -16.519 -10.267  -7.068
  259   3HD1  LEU  33          3HD1      LEU  33 -17.377  -8.827  -7.616
  260   1HD2  LEU  33          1HD2      LEU  33 -16.042  -6.826  -8.429
  261   2HD2  LEU  33          2HD2      LEU  33 -16.199  -8.192  -9.532
  262   3HD2  LEU  33          3HD2      LEU  33 -14.632  -7.418  -9.307
  263    H    CYS  34           H        CYS  34 -11.500  -9.011  -5.181
  264    HA   CYS  34           HA       CYS  34 -11.252 -11.430  -6.786
  265   1HB   CYS  34          2HB       CYS  34  -9.414  -9.262  -5.917
  266   2HB   CYS  34          1HB       CYS  34  -8.710 -10.852  -6.196
  267    HG   CYS  34           HG       CYS  34 -10.375  -9.684  -8.507
  268    H    GLY  35           H        GLY  35 -11.742 -10.763  -3.577
  269   1HA   GLY  35          2HA       GLY  35 -11.896 -12.750  -2.138
  270   2HA   GLY  35          1HA       GLY  35 -10.334 -13.235  -2.779
  271    H    ALA  36           H        ALA  36  -9.165 -10.600  -2.642
  272    HA   ALA  36           HA       ALA  36  -8.005 -10.690  -0.121
  273   1HB   ALA  36          1HB       ALA  36  -8.205  -8.434  -2.101
  274   2HB   ALA  36          2HB       ALA  36  -6.870  -9.564  -1.875
  275   3HB   ALA  36          3HB       ALA  36  -7.225  -8.359  -0.637
  276    H    SER  37           H        SER  37  -8.010  -8.812   1.457
  277    HA   SER  37           HA       SER  37 -10.794  -8.033   2.028
  278   1HB   SER  37          2HB       SER  37  -8.915  -9.434   3.634
  279   2HB   SER  37          1HB       SER  37  -9.133  -7.843   4.361
  280    HG   SER  37           HG       SER  37 -11.040  -8.436   4.987
  281    H    VAL  38           H        VAL  38 -11.245  -5.919   2.334
  282    HA   VAL  38           HA       VAL  38  -9.292  -3.992   1.572
  283    HB   VAL  38           HB       VAL  38 -10.984  -2.384   1.644
  284   1HG1  VAL  38          1HG1      VAL  38 -12.546  -4.913   1.189
  285   2HG1  VAL  38          2HG1      VAL  38 -11.368  -4.276   0.041
  286   3HG1  VAL  38          3HG1      VAL  38 -12.801  -3.334   0.448
  287   1HG2  VAL  38          1HG2      VAL  38 -12.124  -4.039   3.829
  288   2HG2  VAL  38          2HG2      VAL  38 -13.233  -3.080   2.849
  289   3HG2  VAL  38          3HG2      VAL  38 -11.918  -2.291   3.719
  290    H    VAL  39           H        VAL  39  -7.890  -2.912   2.784
  291    HA   VAL  39           HA       VAL  39  -8.275  -2.921   5.706
  292    HB   VAL  39           HB       VAL  39  -5.638  -2.677   4.259
  293   1HG1  VAL  39          1HG1      VAL  39  -5.898  -3.648   7.046
  294   2HG1  VAL  39          2HG1      VAL  39  -6.143  -1.926   6.753
  295   3HG1  VAL  39          3HG1      VAL  39  -4.622  -2.693   6.293
  296   1HG2  VAL  39          1HG2      VAL  39  -7.253  -4.977   4.496
  297   2HG2  VAL  39          2HG2      VAL  39  -5.922  -5.163   5.636
  298   3HG2  VAL  39          3HG2      VAL  39  -5.587  -4.870   3.930
  299    H    LYS  40           H        LYS  40  -8.483  -1.009   6.686
  300    HA   LYS  40           HA       LYS  40  -8.331   1.401   5.095
  301   1HB   LYS  40          2HB       LYS  40  -9.300   2.496   7.090
  302   2HB   LYS  40          1HB       LYS  40 -10.248   1.125   6.532
  303   1HG   LYS  40          2HG       LYS  40  -8.230   0.550   8.603
  304   2HG   LYS  40          1HG       LYS  40  -9.603   1.542   9.098
  305   1HD   LYS  40          2HD       LYS  40 -10.850  -0.420   7.694
  306   2HD   LYS  40          1HD       LYS  40  -9.486  -1.306   8.377
  307   1HE   LYS  40          2HE       LYS  40 -11.109   0.493  10.123
  308   2HE   LYS  40          1HE       LYS  40 -11.724  -1.106   9.707
  309   1HZ   LYS  40          1HZ       LYS  40  -9.264  -1.734  10.452
  310   2HZ   LYS  40          2HZ       LYS  40 -10.559  -1.669  11.537
  311   3HZ   LYS  40          3HZ       LYS  40  -9.491  -0.363  11.416
  312    H    GLU  41           H        GLU  41  -6.561  -0.069   7.749
  313    HA   GLU  41           HA       GLU  41  -4.670   2.189   7.621
  314   1HB   GLU  41          2HB       GLU  41  -4.997   0.465  10.059
  315   2HB   GLU  41          1HB       GLU  41  -4.259   2.054   9.930
  316   1HG   GLU  41          2HG       GLU  41  -6.959   2.287   9.108
  317   2HG   GLU  41          1HG       GLU  41  -6.926   1.381  10.619
  318    H    LEU  42           H        LEU  42  -2.442   1.698   7.985
  319    HA   LEU  42           HA       LEU  42  -1.601  -0.671   6.645
  320   1HB   LEU  42          2HB       LEU  42   0.153   1.180   8.249
  321   2HB   LEU  42          1HB       LEU  42   0.622   0.150   6.912
  322    HG   LEU  42           HG       LEU  42  -1.257   2.488   6.605
  323   1HD1  LEU  42          1HD1      LEU  42   1.381   2.720   7.292
  324   2HD1  LEU  42          2HD1      LEU  42   0.441   3.925   6.414
  325   3HD1  LEU  42          3HD1      LEU  42   1.441   2.773   5.530
  326   1HD2  LEU  42          1HD2      LEU  42  -0.039   2.080   4.216
  327   2HD2  LEU  42          2HD2      LEU  42  -1.605   1.410   4.668
  328   3HD2  LEU  42          3HD2      LEU  42  -0.148   0.431   4.830
  329    H    SER  43           H        SER  43  -1.864   0.311   9.989
  330    HA   SER  43           HA       SER  43  -0.330  -1.862  11.044
  331   1HB   SER  43          2HB       SER  43  -1.452   0.517  12.056
  332   2HB   SER  43          1HB       SER  43  -2.216  -0.796  12.951
  333    HG   SER  43           HG       SER  43   0.044  -1.594  13.191
  334    H    SER  44           H        SER  44  -3.572  -1.485   9.954
  335    HA   SER  44           HA       SER  44  -4.885  -3.409  11.509
  336   1HB   SER  44          2HB       SER  44  -5.394  -1.987   8.990
  337   2HB   SER  44          1HB       SER  44  -6.153  -3.576   9.078
  338    HG   SER  44           HG       SER  44  -6.399  -1.502  11.003
  339    H    PHE  45           H        PHE  45  -2.539  -3.764   9.021
  340    HA   PHE  45           HA       PHE  45  -3.188  -6.247   7.947
  341   1HB   PHE  45          2HB       PHE  45  -0.498  -4.967   8.446
  342   2HB   PHE  45          1HB       PHE  45  -0.704  -6.461   7.537
  343    HD1  PHE  45           1HD      PHE  45  -3.133  -5.879   5.992
  344    HD2  PHE  45           2HD      PHE  45   0.222  -3.415   6.882
  345    HE1  PHE  45           1HE      PHE  45  -3.551  -4.577   3.946
  346    HE2  PHE  45           2HE      PHE  45  -0.191  -2.110   4.838
  347    HZ   PHE  45           HZ       PHE  45  -2.078  -2.691   3.369
  348    H    THR  46           H        THR  46  -3.838  -7.848   9.278
  349    HA   THR  46           HA       THR  46  -1.946  -9.392  10.655
  350    HB   THR  46           HB       THR  46  -1.925  -7.693  12.351
  351    HG1  THR  46           1HG      THR  46  -3.651  -9.746  13.261
  352   1HG2  THR  46          1HG2      THR  46  -3.768  -6.365  12.253
  353   2HG2  THR  46          2HG2      THR  46  -4.205  -7.391  13.621
  354   3HG2  THR  46          3HG2      THR  46  -4.872  -7.720  12.022
  355    H    LEU  47           H        LEU  47  -2.797 -11.365  11.383
  356    HA   LEU  47           HA       LEU  47  -5.542 -11.909  11.674
  357   1HB   LEU  47          2HB       LEU  47  -4.871 -11.593   9.030
  358   2HB   LEU  47          1HB       LEU  47  -4.735 -13.328   9.242
  359    HG   LEU  47           HG       LEU  47  -6.940 -12.847   8.454
  360   1HD1  LEU  47          1HD1      LEU  47  -8.041 -14.195   9.886
  361   2HD1  LEU  47          2HD1      LEU  47  -7.620 -13.223  11.296
  362   3HD1  LEU  47          3HD1      LEU  47  -6.447 -14.355  10.622
  363   1HD2  LEU  47          1HD2      LEU  47  -6.891 -10.452   9.246
  364   2HD2  LEU  47          2HD2      LEU  47  -7.373 -11.056  10.831
  365   3HD2  LEU  47          3HD2      LEU  47  -8.428 -11.293   9.438
  366    H    GLY  48           H        GLY  48  -2.407 -13.193  10.690
  367   1HA   GLY  48          2HA       GLY  48  -1.374 -14.749  12.313
  368   2HA   GLY  48          1HA       GLY  48  -2.938 -15.542  12.404
  369    H    THR  49           H        THR  49  -0.657 -14.539   9.848
  370    HA   THR  49           HA       THR  49   0.098 -15.606   7.987
  371    HB   THR  49           HB       THR  49   0.901 -17.806   8.255
  372    HG1  THR  49           1HG      THR  49  -0.900 -18.229  10.395
  373   1HG2  THR  49          1HG2      THR  49   1.591 -16.044  10.088
  374   2HG2  THR  49          2HG2      THR  49   2.144 -17.717  10.149
  375   3HG2  THR  49          3HG2      THR  49   0.789 -17.198  11.152
  376    H    GLY  50           H        GLY  50  -2.774 -15.135   8.248
  377   1HA   GLY  50          2HA       GLY  50  -3.819 -17.371   6.627
  378   2HA   GLY  50          1HA       GLY  50  -4.810 -16.303   7.608
  379    H    VAL  51           H        VAL  51  -3.266 -13.931   6.700
  380    HA   VAL  51           HA       VAL  51  -4.193 -13.781   3.909
  381    HB   VAL  51           HB       VAL  51  -4.949 -11.459   4.328
  382   1HG1  VAL  51          1HG1      VAL  51  -6.983 -12.106   5.697
  383   2HG1  VAL  51          2HG1      VAL  51  -6.239 -13.696   5.867
  384   3HG1  VAL  51          3HG1      VAL  51  -6.656 -13.084   4.267
  385   1HG2  VAL  51          1HG2      VAL  51  -5.369 -10.815   6.716
  386   2HG2  VAL  51          2HG2      VAL  51  -3.670 -10.849   6.245
  387   3HG2  VAL  51          3HG2      VAL  51  -4.349 -12.172   7.192
  388    H    HIS  52           H        HIS  52  -3.026 -12.400   2.553
  389    HA   HIS  52           HA       HIS  52  -0.335 -11.796   3.498
  390   1HB   HIS  52          2HB       HIS  52  -1.367 -11.552   0.672
  391   2HB   HIS  52          1HB       HIS  52   0.307 -11.676   1.202
  392    HD1  HIS  52           1HD      HIS  52  -2.837 -13.781   1.017
  393    HD2  HIS  52           2HD      HIS  52   1.284 -14.224   1.304
  394    HE1  HIS  52           1HE      HIS  52  -2.406 -16.246   0.764
  395    HE2  HIS  52           2HE      HIS  52   0.101 -16.475   0.834
  396    HA   PRO  53           HA       PRO  53  -1.502  -7.489   3.801
  397   1HB   PRO  53          2HB       PRO  53   0.856  -6.525   4.649
  398   2HB   PRO  53          1HB       PRO  53  -0.184  -7.497   5.697
  399   1HG   PRO  53          2HG       PRO  53   2.243  -8.316   4.149
  400   2HG   PRO  53          1HG       PRO  53   1.776  -8.744   5.804
  401   1HD   PRO  53          2HD       PRO  53   1.390 -10.380   3.645
  402   2HD   PRO  53          1HD       PRO  53   0.382 -10.423   5.104
  403    H    ILE  54           H        ILE  54  -1.644  -6.023   2.241
  404    HA   ILE  54           HA       ILE  54   0.658  -5.482   0.512
  405    HB   ILE  54           HB       ILE  54  -2.068  -5.734  -0.722
  406   1HG1  ILE  54          2HG1      ILE  54  -1.514  -7.928   0.285
  407   2HG1  ILE  54          1HG1      ILE  54  -1.538  -7.979  -1.474
  408   1HG2  ILE  54          1HG2      ILE  54  -0.144  -6.380  -2.580
  409   2HG2  ILE  54          2HG2      ILE  54   0.631  -5.126  -1.612
  410   3HG2  ILE  54          3HG2      ILE  54  -0.919  -4.808  -2.389
  411   1HD1  ILE  54          1HD1      ILE  54   1.094  -7.413  -0.370
  412   2HD1  ILE  54          2HD1      ILE  54   0.597  -8.578  -1.597
  413   3HD1  ILE  54          3HD1      ILE  54   0.434  -8.976   0.114
  414    H    VAL  55           H        VAL  55   0.547  -3.431  -0.556
  415    HA   VAL  55           HA       VAL  55  -1.554  -1.604   0.373
  416    HB   VAL  55           HB       VAL  55   1.384  -0.902   0.495
  417   1HG1  VAL  55          1HG1      VAL  55  -0.781   0.757   0.251
  418   2HG1  VAL  55          2HG1      VAL  55   0.779   1.206   0.937
  419   3HG1  VAL  55          3HG1      VAL  55  -0.538   0.704   1.997
  420   1HG2  VAL  55          1HG2      VAL  55  -0.408  -1.287   2.873
  421   2HG2  VAL  55          2HG2      VAL  55   1.353  -1.183   2.819
  422   3HG2  VAL  55          3HG2      VAL  55   0.535  -2.615   2.196
  423    H    VAL  56           H        VAL  56  -2.106  -0.025  -1.101
  424    HA   VAL  56           HA       VAL  56  -0.642  -0.123  -3.652
  425    HB   VAL  56           HB       VAL  56  -3.071   1.049  -4.257
  426   1HG1  VAL  56          1HG1      VAL  56  -1.771  -1.560  -4.700
  427   2HG1  VAL  56          2HG1      VAL  56  -2.383  -0.380  -5.859
  428   3HG1  VAL  56          3HG1      VAL  56  -3.499  -1.476  -5.044
  429   1HG2  VAL  56          1HG2      VAL  56  -4.171   0.498  -2.247
  430   2HG2  VAL  56          2HG2      VAL  56  -3.485  -1.125  -2.221
  431   3HG2  VAL  56          3HG2      VAL  56  -4.706  -0.703  -3.421
  432    H    VAL  57           H        VAL  57  -0.493   1.841  -4.892
  433    HA   VAL  57           HA       VAL  57  -0.916   4.329  -3.414
  434    HB   VAL  57           HB       VAL  57   1.426   5.054  -4.163
  435   1HG1  VAL  57          1HG1      VAL  57   1.162   2.979  -1.991
  436   2HG1  VAL  57          2HG1      VAL  57   0.786   4.693  -1.830
  437   3HG1  VAL  57          3HG1      VAL  57   2.447   4.179  -2.128
  438   1HG2  VAL  57          1HG2      VAL  57   2.069   3.333  -5.634
  439   2HG2  VAL  57          2HG2      VAL  57   1.636   2.073  -4.478
  440   3HG2  VAL  57          3HG2      VAL  57   3.043   3.095  -4.183
  441    H    GLN  58           H        GLN  58   0.014   6.207  -4.926
  442    HA   GLN  58           HA       GLN  58   0.095   6.006  -7.673
  443   1HB   GLN  58          2HB       GLN  58  -2.479   5.391  -6.822
  444   2HB   GLN  58          1HB       GLN  58  -2.598   7.068  -7.331
  445   1HG   GLN  58          2HG       GLN  58  -1.125   5.807  -9.331
  446   2HG   GLN  58          1HG       GLN  58  -2.410   4.674  -8.915
  447   1HE2  GLN  58          1HE2      GLN  58  -1.592   7.499 -10.578
  448   2HE2  GLN  58          2HE2      GLN  58  -3.181   7.964 -11.073
  449    HA   PRO  59           HA       PRO  59   0.941  10.099  -5.464
  450   1HB   PRO  59          2HB       PRO  59   3.195   9.853  -7.401
  451   2HB   PRO  59          1HB       PRO  59   3.205  10.422  -5.728
  452   1HG   PRO  59          2HG       PRO  59   4.133   8.004  -6.341
  453   2HG   PRO  59          1HG       PRO  59   3.199   8.272  -4.857
  454   1HD   PRO  59          2HD       PRO  59   2.362   6.995  -7.420
  455   2HD   PRO  59          1HD       PRO  59   1.894   6.599  -5.754
  456    H    ASP  60           H        ASP  60  -0.589  11.394  -6.348
  457    HA   ASP  60           HA       ASP  60   0.005  12.783  -8.758
  458   1HB   ASP  60          2HB       ASP  60  -1.208  10.450  -9.314
  459   2HB   ASP  60          1HB       ASP  60  -2.630  11.445  -9.017
  460    H    ALA  61           H        ALA  61  -2.519  11.906  -6.447
  461    HA   ALA  61           HA       ALA  61  -3.293  14.749  -6.336
  462   1HB   ALA  61          1HB       ALA  61  -5.048  13.382  -7.364
  463   2HB   ALA  61          2HB       ALA  61  -5.569  14.063  -5.822
  464   3HB   ALA  61          3HB       ALA  61  -5.096  12.367  -5.924
  465    H    TRP  62           H        TRP  62  -1.286  13.297  -4.751
  466    HA   TRP  62           HA       TRP  62  -2.322  12.734  -2.173
  467   1HB   TRP  62          2HB       TRP  62   0.078  12.322  -3.400
  468   2HB   TRP  62          1HB       TRP  62   0.475  13.654  -2.319
  469    HD1  TRP  62           HD       TRP  62  -1.863  10.658  -1.568
  470    HE1  TRP  62           1HE      TRP  62  -0.952   9.442   0.509
  471    HE3  TRP  62           3HE      TRP  62   2.410  13.371  -0.846
  472    HZ2  TRP  62           2HZ      TRP  62   1.284   9.609   2.226
  473    HZ3  TRP  62           3HZ      TRP  62   3.880  12.777   1.035
  474    HH2  TRP  62           HH       TRP  62   3.327  10.935   2.538
  475    H    THR  63           H        THR  63  -0.652  15.575  -3.510
  476    HA   THR  63           HA       THR  63  -2.164  17.440  -2.072
  477    HB   THR  63           HB       THR  63   0.163  18.070  -0.737
  478    HG1  THR  63           1HG      THR  63   0.879  15.889  -1.316
  479   1HG2  THR  63          1HG2      THR  63  -1.139  16.687   1.180
  480   2HG2  THR  63          2HG2      THR  63  -2.438  16.952   0.017
  481   3HG2  THR  63          3HG2      THR  63  -1.550  18.326   0.675
  482    H    GLU  64           H        GLU  64   1.349  17.446  -2.476
  483    HA   GLU  64           HA       GLU  64   1.249  18.898  -4.946
  484   1HB   GLU  64          2HB       GLU  64   1.157  20.376  -2.510
  485   2HB   GLU  64          1HB       GLU  64   2.732  20.640  -3.244
  486   1HG   GLU  64          2HG       GLU  64   1.889  21.915  -4.862
  487   2HG   GLU  64          1HG       GLU  64   0.545  20.813  -5.154
  488    H    ASP  65           H        ASP  65   2.476  16.498  -3.882
  489    HA   ASP  65           HA       ASP  65   4.438  15.358  -4.012
  490   1HB   ASP  65          2HB       ASP  65   5.376  17.803  -5.528
  491   2HB   ASP  65          1HB       ASP  65   6.185  16.239  -5.502
  492    H    ASN  66           H        ASN  66   4.442  15.810  -1.641
  493    HA   ASN  66           HA       ASN  66   6.448  17.744  -0.776
  494   1HB   ASN  66          2HB       ASN  66   4.637  15.943   0.850
  495   2HB   ASN  66          1HB       ASN  66   5.695  17.191   1.501
  496   1HD2  ASN  66          1HD2      ASN  66   5.333  19.307  -0.039
  497   2HD2  ASN  66          2HD2      ASN  66   3.685  19.828  -0.030
  498    H    GLY  67           H        GLY  67   5.736  14.354   0.101
  499   1HA   GLY  67          2HA       GLY  67   8.401  13.492  -0.496
  500   2HA   GLY  67          1HA       GLY  67   8.149  13.699   1.231
  501    H    PHE  68           H        PHE  68   7.374  11.813  -1.580
  502    HA   PHE  68           HA       PHE  68   5.664  10.019  -0.050
  503   1HB   PHE  68          2HB       PHE  68   5.359  10.820  -2.550
  504   2HB   PHE  68          1HB       PHE  68   6.445   9.474  -2.882
  505    HD1  PHE  68           1HD      PHE  68   3.347  10.227  -0.948
  506    HD2  PHE  68           2HD      PHE  68   5.524   7.409  -3.278
  507    HE1  PHE  68           1HE      PHE  68   1.444   8.672  -0.838
  508    HE2  PHE  68           2HE      PHE  68   3.624   5.849  -3.173
  509    HZ   PHE  68           HZ       PHE  68   1.581   6.480  -1.951
  510    H    HIS  69           H        HIS  69   8.844  10.379  -0.139
  511    HA   HIS  69           HA       HIS  69   9.612   7.627  -0.647
  512   1HB   HIS  69          2HB       HIS  69  11.045  10.185  -0.142
  513   2HB   HIS  69          1HB       HIS  69  11.870   8.695   0.303
  514    HD1  HIS  69           1HD      HIS  69  10.796   6.993  -2.130
  515    HD2  HIS  69           2HD      HIS  69  12.560  10.747  -2.373
  516    HE1  HIS  69           1HE      HIS  69  11.702   7.161  -4.470
  517    HE2  HIS  69           2HE      HIS  69  12.842   9.405  -4.565
  518    H    ALA  70           H        ALA  70   7.799   7.586   1.338
  519    HA   ALA  70           HA       ALA  70   9.357   6.577   3.557
  520   1HB   ALA  70          1HB       ALA  70   8.246   7.888   5.262
  521   2HB   ALA  70          2HB       ALA  70   7.317   8.745   4.034
  522   3HB   ALA  70          3HB       ALA  70   9.066   8.955   4.122
  523    H    ILE  71           H        ILE  71   7.365   5.700   1.453
  524    HA   ILE  71           HA       ILE  71   4.959   4.990   2.788
  525    HB   ILE  71           HB       ILE  71   6.093   3.519   0.420
  526   1HG1  ILE  71          2HG1      ILE  71   6.287   5.848  -0.164
  527   2HG1  ILE  71          1HG1      ILE  71   4.876   5.199  -0.990
  528   1HG2  ILE  71          1HG2      ILE  71   4.059   2.647   1.539
  529   2HG2  ILE  71          2HG2      ILE  71   3.789   3.122  -0.139
  530   3HG2  ILE  71          3HG2      ILE  71   3.249   4.170   1.172
  531   1HD1  ILE  71          1HD1      ILE  71   4.740   7.511   0.152
  532   2HD1  ILE  71          2HD1      ILE  71   4.566   6.577   1.639
  533   3HD1  ILE  71          3HD1      ILE  71   3.400   6.377   0.332
  534    H    GLY  72           H        GLY  72   8.078   3.444   2.359
  535   1HA   GLY  72          2HA       GLY  72   7.188   0.934   3.498
  536   2HA   GLY  72          1HA       GLY  72   8.830   1.343   3.021
  537    H    GLN  73           H        GLN  73   8.492   3.904   4.663
  538    HA   GLN  73           HA       GLN  73   9.603   2.827   7.079
  539   1HB   GLN  73          2HB       GLN  73  10.355   4.962   5.977
  540   2HB   GLN  73          1HB       GLN  73   8.847   5.694   6.507
  541   1HG   GLN  73          2HG       GLN  73   9.839   4.600   8.820
  542   2HG   GLN  73          1HG       GLN  73  11.290   5.160   7.988
  543   1HE2  GLN  73          1HE2      GLN  73   9.982   6.144  10.422
  544   2HE2  GLN  73          2HE2      GLN  73   9.654   7.816  10.136
  545    H    MET  74           H        MET  74   6.489   3.921   6.028
  546    HA   MET  74           HA       MET  74   5.483   4.098   8.762
  547   1HB   MET  74          2HB       MET  74   4.351   4.782   6.066
  548   2HB   MET  74          1HB       MET  74   3.300   4.634   7.467
  549   1HG   MET  74          2HG       MET  74   3.839   6.657   8.173
  550   2HG   MET  74          1HG       MET  74   5.560   6.284   8.098
  551   1HE   MET  74          1HE       MET  74   3.058   8.023   4.647
  552   2HE   MET  74          2HE       MET  74   2.582   8.194   6.336
  553   3HE   MET  74          3HE       MET  74   2.628   6.597   5.591
  554    H    CYS  75           H        CYS  75   5.404   2.003   5.979
  555    HA   CYS  75           HA       CYS  75   3.858   0.059   7.551
  556   1HB   CYS  75          2HB       CYS  75   2.357   1.034   5.879
  557   2HB   CYS  75          1HB       CYS  75   3.500   0.633   4.602
  558    HG   CYS  75           HG       CYS  75   1.540  -1.151   4.796
  559    H    GLU  76           H        GLU  76   4.292  -2.156   7.065
  560    HA   GLU  76           HA       GLU  76   7.017  -2.555   6.103
  561   1HB   GLU  76          2HB       GLU  76   6.085  -3.477   8.322
  562   2HB   GLU  76          1HB       GLU  76   5.267  -4.672   7.326
  563   1HG   GLU  76          2HG       GLU  76   7.377  -5.472   6.478
  564   2HG   GLU  76          1HG       GLU  76   8.241  -4.208   7.354
  565    H    ALA  77           H        ALA  77   3.717  -3.534   5.405
  566    HA   ALA  77           HA       ALA  77   4.178  -5.558   3.560
  567   1HB   ALA  77          1HB       ALA  77   1.949  -3.802   2.853
  568   2HB   ALA  77          2HB       ALA  77   1.963  -4.300   4.545
  569   3HB   ALA  77          3HB       ALA  77   1.958  -5.516   3.268
  570    HA   PRO  78           HA       PRO  78   5.613  -3.618  -0.134
  571   1HB   PRO  78          2HB       PRO  78   4.249  -4.813  -2.117
  572   2HB   PRO  78          1HB       PRO  78   5.404  -5.698  -1.114
  573   1HG   PRO  78          2HG       PRO  78   2.420  -5.615  -0.935
  574   2HG   PRO  78          1HG       PRO  78   3.511  -7.006  -0.793
  575   1HD   PRO  78          2HD       PRO  78   2.423  -5.705   1.354
  576   2HD   PRO  78          1HD       PRO  78   3.970  -6.573   1.411
  577    H    VAL  79           H        VAL  79   5.151  -2.218  -1.933
  578    HA   VAL  79           HA       VAL  79   2.503  -0.931  -1.822
  579    HB   VAL  79           HB       VAL  79   5.072   0.571  -2.310
  580   1HG1  VAL  79          1HG1      VAL  79   3.815   2.432  -2.486
  581   2HG1  VAL  79          2HG1      VAL  79   2.669   1.903  -1.255
  582   3HG1  VAL  79          3HG1      VAL  79   2.541   1.288  -2.904
  583   1HG2  VAL  79          1HG2      VAL  79   3.536   0.409   0.281
  584   2HG2  VAL  79          2HG2      VAL  79   4.993   1.352  -0.028
  585   3HG2  VAL  79          3HG2      VAL  79   5.065  -0.410  -0.038
  586    H    VAL  80           H        VAL  80   1.496  -0.997  -3.743
  587    HA   VAL  80           HA       VAL  80   3.096  -0.759  -6.188
  588    HB   VAL  80           HB       VAL  80   1.880  -2.582  -7.282
  589   1HG1  VAL  80          1HG1      VAL  80   3.972  -3.232  -6.438
  590   2HG1  VAL  80          2HG1      VAL  80   2.854  -4.484  -5.899
  591   3HG1  VAL  80          3HG1      VAL  80   3.393  -3.239  -4.772
  592   1HG2  VAL  80          1HG2      VAL  80   0.688  -3.073  -4.552
  593   2HG2  VAL  80          2HG2      VAL  80   0.530  -4.147  -5.943
  594   3HG2  VAL  80          3HG2      VAL  80  -0.176  -2.531  -5.992
  595    H    THR  81           H        THR  81   2.090   0.320  -7.840
  596    HA   THR  81           HA       THR  81  -0.017   2.047  -7.296
  597    HB   THR  81           HB       THR  81   0.040   2.675  -9.564
  598    HG1  THR  81           1HG      THR  81   0.915   0.034 -10.057
  599   1HG2  THR  81          1HG2      THR  81   2.273   2.973 -10.111
  600   2HG2  THR  81          2HG2      THR  81   2.758   1.448  -9.370
  601   3HG2  THR  81          3HG2      THR  81   2.290   2.812  -8.355
  602    H    ARG  82           H        ARG  82  -2.157   2.126  -8.401
  603    HA   ARG  82           HA       ARG  82  -3.729  -0.067  -7.725
  604   1HB   ARG  82          2HB       ARG  82  -5.396   1.051  -9.430
  605   2HB   ARG  82          1HB       ARG  82  -5.015   1.820  -7.899
  606   1HG   ARG  82          2HG       ARG  82  -4.224   3.615  -8.926
  607   2HG   ARG  82          1HG       ARG  82  -3.149   2.645  -9.927
  608   1HD   ARG  82          2HD       ARG  82  -5.492   2.121 -11.132
  609   2HD   ARG  82          1HD       ARG  82  -5.825   3.740 -10.519
  610    HE   ARG  82           HE       ARG  82  -3.322   3.738 -11.794
  611   1HH1  ARG  82          1HH1      ARG  82  -6.717   3.474 -12.558
  612   2HH1  ARG  82          2HH1      ARG  82  -6.540   4.142 -14.145
  613   1HH2  ARG  82          1HH2      ARG  82  -3.088   4.618 -13.880
  614   2HH2  ARG  82          2HH2      ARG  82  -4.479   4.792 -14.896
  615    H    GLU  83           H        GLU  83  -1.809   0.424 -10.536
  616    HA   GLU  83           HA       GLU  83  -3.088  -0.953 -12.525
  617   1HB   GLU  83          2HB       GLU  83  -0.228  -0.629 -11.770
  618   2HB   GLU  83          1HB       GLU  83  -0.613  -1.852 -12.972
  619   1HG   GLU  83          2HG       GLU  83  -0.965  -0.335 -14.559
  620   2HG   GLU  83          1HG       GLU  83  -1.933   0.682 -13.493
  621    H    TRP  84           H        TRP  84  -1.331  -2.306  -9.774
  622    HA   TRP  84           HA       TRP  84  -1.404  -5.009 -10.505
  623   1HB   TRP  84          2HB       TRP  84  -0.089  -4.149  -8.610
  624   2HB   TRP  84          1HB       TRP  84  -1.570  -3.790  -7.740
  625    HD1  TRP  84           HD       TRP  84   0.337  -6.873  -9.110
  626    HE1  TRP  84           1HE      TRP  84  -0.222  -8.883  -7.601
  627    HE3  TRP  84           3HE      TRP  84  -3.101  -4.655  -6.045
  628    HZ2  TRP  84           2HZ      TRP  84  -1.901  -9.452  -5.402
  629    HZ3  TRP  84           3HZ      TRP  84  -4.138  -6.002  -4.264
  630    HH2  TRP  84           HH       TRP  84  -3.551  -8.348  -3.951
  631    H    VAL  85           H        VAL  85  -3.545  -3.231  -8.337
  632    HA   VAL  85           HA       VAL  85  -5.450  -5.207  -7.914
  633    HB   VAL  85           HB       VAL  85  -5.955  -2.232  -8.022
  634   1HG1  VAL  85          1HG1      VAL  85  -7.569  -3.201  -6.077
  635   2HG1  VAL  85          2HG1      VAL  85  -7.582  -4.545  -7.219
  636   3HG1  VAL  85          3HG1      VAL  85  -8.074  -2.935  -7.745
  637   1HG2  VAL  85          1HG2      VAL  85  -4.968  -3.991  -5.783
  638   2HG2  VAL  85          2HG2      VAL  85  -5.564  -2.346  -5.559
  639   3HG2  VAL  85          3HG2      VAL  85  -4.125  -2.637  -6.535
  640    H    LEU  86           H        LEU  86  -5.289  -2.755 -10.455
  641    HA   LEU  86           HA       LEU  86  -7.792  -3.437 -11.626
  642   1HB   LEU  86          2HB       LEU  86  -5.798  -1.466 -12.001
  643   2HB   LEU  86          1HB       LEU  86  -6.000  -2.277 -13.543
  644    HG   LEU  86           HG       LEU  86  -8.523  -1.861 -13.206
  645   1HD1  LEU  86          1HD1      LEU  86  -7.727   0.485 -11.581
  646   2HD1  LEU  86          2HD1      LEU  86  -7.879  -1.066 -10.754
  647   3HD1  LEU  86          3HD1      LEU  86  -9.254  -0.397 -11.632
  648   1HD2  LEU  86          1HD2      LEU  86  -6.659   0.461 -13.686
  649   2HD2  LEU  86          2HD2      LEU  86  -8.342   0.354 -14.202
  650   3HD2  LEU  86          3HD2      LEU  86  -7.139  -0.740 -14.886
  651    H    ASP  87           H        ASP  87  -4.446  -4.036 -12.711
  652    HA   ASP  87           HA       ASP  87  -5.067  -5.665 -14.881
  653   1HB   ASP  87          2HB       ASP  87  -2.825  -4.722 -14.459
  654   2HB   ASP  87          1HB       ASP  87  -2.627  -5.820 -13.097
  655    H    SER  88           H        SER  88  -4.909  -6.389 -11.472
  656    HA   SER  88           HA       SER  88  -4.940  -9.239 -11.804
  657   1HB   SER  88          2HB       SER  88  -5.314  -7.412  -9.437
  658   2HB   SER  88          1HB       SER  88  -5.534  -9.157  -9.305
  659    HG   SER  88           HG       SER  88  -3.186  -7.995 -10.373
  660    H    VAL  89           H        VAL  89  -7.353  -6.824 -10.778
  661    HA   VAL  89           HA       VAL  89  -9.481  -8.711 -10.623
  662    HB   VAL  89           HB       VAL  89  -9.660  -5.706 -10.878
  663   1HG1  VAL  89          1HG1      VAL  89 -11.795  -6.585 -11.331
  664   2HG1  VAL  89          2HG1      VAL  89 -11.836  -6.127  -9.628
  665   3HG1  VAL  89          3HG1      VAL  89 -11.642  -7.820 -10.081
  666   1HG2  VAL  89          1HG2      VAL  89 -10.119  -6.791  -8.238
  667   2HG2  VAL  89          2HG2      VAL  89  -9.025  -5.509  -8.752
  668   3HG2  VAL  89          3HG2      VAL  89  -8.506  -7.192  -8.826
  669    H    ALA  90           H        ALA  90  -8.165  -6.741 -13.179
  670    HA   ALA  90           HA       ALA  90 -10.396  -6.801 -14.919
  671   1HB   ALA  90          1HB       ALA  90  -8.494  -5.228 -15.133
  672   2HB   ALA  90          2HB       ALA  90  -8.872  -6.071 -16.636
  673   3HB   ALA  90          3HB       ALA  90  -7.483  -6.570 -15.669
  674    H    LEU  91           H        LEU  91  -7.370  -8.687 -15.012
  675    HA   LEU  91           HA       LEU  91  -8.593 -10.601 -16.826
  676   1HB   LEU  91          2HB       LEU  91  -6.324  -9.901 -17.284
  677   2HB   LEU  91          1HB       LEU  91  -5.811 -10.387 -15.680
  678    HG   LEU  91           HG       LEU  91  -6.276 -12.742 -16.255
  679   1HD1  LEU  91          1HD1      LEU  91  -7.321 -11.469 -18.707
  680   2HD1  LEU  91          2HD1      LEU  91  -7.844 -12.932 -17.873
  681   3HD1  LEU  91          3HD1      LEU  91  -6.420 -12.971 -18.913
  682   1HD2  LEU  91          1HD2      LEU  91  -4.384 -11.161 -17.967
  683   2HD2  LEU  91          2HD2      LEU  91  -4.457 -12.922 -18.032
  684   3HD2  LEU  91          3HD2      LEU  91  -4.034 -12.112 -16.523
  685    H    TYR  92           H        TYR  92  -8.320 -10.202 -13.494
  686    HA   TYR  92           HA       TYR  92  -8.834 -11.522 -11.720
  687   1HB   TYR  92          2HB       TYR  92 -10.271 -12.663 -13.932
  688   2HB   TYR  92          1HB       TYR  92  -9.719 -13.952 -12.870
  689    HD1  TYR  92           1HD      TYR  92 -12.581 -12.663 -13.517
  690    HD2  TYR  92           2HD      TYR  92  -9.870 -12.491 -10.240
  691    HE1  TYR  92           1HE      TYR  92 -14.456 -12.202 -11.995
  692    HE2  TYR  92           2HE      TYR  92 -11.737 -12.030  -8.712
  693    HH   TYR  92           HH       TYR  92 -13.966 -11.241  -8.708
  694    H    GLN  93           H        GLN  93  -6.536 -11.631 -11.354
  695    HA   GLN  93           HA       GLN  93  -5.610 -14.232 -10.881
  696   1HB   GLN  93          2HB       GLN  93  -5.300 -13.639 -13.524
  697   2HB   GLN  93          1HB       GLN  93  -3.757 -13.101 -12.874
  698   1HG   GLN  93          2HG       GLN  93  -4.730 -15.773 -12.047
  699   2HG   GLN  93          1HG       GLN  93  -4.172 -15.581 -13.709
  700   1HE2  GLN  93          1HE2      GLN  93  -2.207 -16.397 -13.831
  701   2HE2  GLN  93          2HE2      GLN  93  -0.911 -16.095 -12.730
  702    H    CYS  94           H        CYS  94  -4.191 -14.111  -9.259
  703    HA   CYS  94           HA       CYS  94  -3.394 -11.630  -8.189
  704   1HB   CYS  94          2HB       CYS  94  -3.700 -13.722  -6.869
  705   2HB   CYS  94          1HB       CYS  94  -2.225 -14.356  -7.592
  706    HG   CYS  94           HG       CYS  94  -1.234 -11.991  -6.367
  707    H    GLN  95           H        GLN  95  -2.314 -10.535  -9.885
  708    HA   GLN  95           HA       GLN  95   0.009 -11.562 -11.153
  709   1HB   GLN  95          2HB       GLN  95  -0.736  -8.655 -10.810
  710   2HB   GLN  95          1HB       GLN  95   0.304  -9.347 -12.047
  711   1HG   GLN  95          2HG       GLN  95  -2.637  -9.908 -11.752
  712   2HG   GLN  95          1HG       GLN  95  -1.928  -8.756 -12.884
  713   1HE2  GLN  95          1HE2      GLN  95  -0.953  -9.486 -14.723
  714   2HE2  GLN  95          2HE2      GLN  95  -1.002 -11.134 -15.238
  715    H    GLU  96           H        GLU  96   2.130 -10.239 -11.011
  716    HA   GLU  96           HA       GLU  96   3.082 -10.498  -8.311
  717   1HB   GLU  96          2HB       GLU  96   4.647  -9.328 -10.602
  718   2HB   GLU  96          1HB       GLU  96   5.252 -10.180  -9.189
  719   1HG   GLU  96          2HG       GLU  96   3.668 -11.407 -11.436
  720   2HG   GLU  96          1HG       GLU  96   5.410 -11.538 -11.206
  721    H    LEU  97           H        LEU  97   4.238  -8.811  -7.165
  722    HA   LEU  97           HA       LEU  97   2.911  -6.226  -7.498
  723   1HB   LEU  97          2HB       LEU  97   4.223  -7.644  -5.229
  724   2HB   LEU  97          1HB       LEU  97   4.193  -5.890  -5.203
  725    HG   LEU  97           HG       LEU  97   1.583  -6.493  -5.788
  726   1HD1  LEU  97          1HD1      LEU  97   2.137  -8.903  -5.378
  727   2HD1  LEU  97          2HD1      LEU  97   0.840  -8.251  -4.376
  728   3HD1  LEU  97          3HD1      LEU  97   2.453  -8.473  -3.697
  729   1HD2  LEU  97          1HD2      LEU  97   2.908  -5.076  -3.916
  730   2HD2  LEU  97          2HD2      LEU  97   2.238  -6.371  -2.921
  731   3HD2  LEU  97          3HD2      LEU  97   1.167  -5.357  -3.889
  732    H    ASP  98           H        ASP  98   6.009  -7.735  -7.787
  733    HA   ASP  98           HA       ASP  98   7.635  -5.434  -7.574
  734   1HB   ASP  98          2HB       ASP  98   8.079  -8.143  -7.883
  735   2HB   ASP  98          1HB       ASP  98   8.630  -7.477  -9.418
  736    H    THR  99           H        THR  99   5.559  -6.586 -10.065
  737    HA   THR  99           HA       THR  99   6.850  -5.219 -12.229
  738    HB   THR  99           HB       THR  99   4.021  -6.270 -12.085
  739    HG1  THR  99           1HG      THR  99   6.414  -7.558 -12.889
  740   1HG2  THR  99          1HG2      THR  99   5.766  -5.970 -14.508
  741   2HG2  THR  99          2HG2      THR  99   4.577  -4.765 -14.011
  742   3HG2  THR  99          3HG2      THR  99   4.055  -6.394 -14.443
  743    H    TYR 100           H        TYR 100   4.727  -4.273  -9.716
  744    HA   TYR 100           HA       TYR 100   4.427  -1.648 -10.985
  745   1HB   TYR 100          2HB       TYR 100   2.124  -2.804  -9.443
  746   2HB   TYR 100          1HB       TYR 100   2.126  -1.485 -10.606
  747    HD1  TYR 100           1HD      TYR 100   2.229  -5.148 -10.224
  748    HD2  TYR 100           2HD      TYR 100   1.881  -1.902 -12.952
  749    HE1  TYR 100           1HE      TYR 100   1.524  -6.712 -11.985
  750    HE2  TYR 100           2HE      TYR 100   1.174  -3.457 -14.720
  751    HH   TYR 100           HH       TYR 100   0.286  -6.684 -14.086
  752    H    LEU 101           H        LEU 101   6.069  -2.871  -8.781
  753    HA   LEU 101           HA       LEU 101   5.068  -1.630  -6.377
  754   1HB   LEU 101          2HB       LEU 101   6.877  -3.684  -6.973
  755   2HB   LEU 101          1HB       LEU 101   7.842  -2.415  -6.251
  756    HG   LEU 101           HG       LEU 101   5.356  -3.052  -4.806
  757   1HD1  LEU 101          1HD1      LEU 101   6.599  -5.241  -5.748
  758   2HD1  LEU 101          2HD1      LEU 101   5.782  -5.176  -4.186
  759   3HD1  LEU 101          3HD1      LEU 101   7.531  -4.968  -4.276
  760   1HD2  LEU 101          1HD2      LEU 101   6.749  -1.537  -3.729
  761   2HD2  LEU 101          2HD2      LEU 101   8.211  -2.425  -4.159
  762   3HD2  LEU 101          3HD2      LEU 101   7.122  -3.064  -2.928
  763    H    ILE 102           H        ILE 102   5.058   0.554  -6.478
  764    HA   ILE 102           HA       ILE 102   5.814   2.700  -6.561
  765    HB   ILE 102           HB       ILE 102   8.551   1.520  -6.095
  766   1HG1  ILE 102          2HG1      ILE 102   6.631   2.410  -3.948
  767   2HG1  ILE 102          1HG1      ILE 102   6.676   0.742  -4.515
  768   1HG2  ILE 102          1HG2      ILE 102   8.846   3.778  -6.536
  769   2HG2  ILE 102          2HG2      ILE 102   8.726   3.734  -4.778
  770   3HG2  ILE 102          3HG2      ILE 102   7.337   4.233  -5.744
  771   1HD1  ILE 102          1HD1      ILE 102   8.092   1.620  -2.436
  772   2HD1  ILE 102          2HD1      ILE 102   9.256   1.935  -3.724
  773   3HD1  ILE 102          3HD1      ILE 102   8.630   0.304  -3.479
  774    HA   PRO 103           HA       PRO 103   7.132   2.619 -10.909
  775   1HB   PRO 103          2HB       PRO 103   5.882   4.896 -11.634
  776   2HB   PRO 103          1HB       PRO 103   5.017   3.366 -11.445
  777   1HG   PRO 103          2HG       PRO 103   5.221   5.672  -9.548
  778   2HG   PRO 103          1HG       PRO 103   3.800   4.704  -9.984
  779   1HD   PRO 103          2HD       PRO 103   5.231   4.313  -7.698
  780   2HD   PRO 103          1HD       PRO 103   4.353   3.014  -8.530
  781    H    GLN 104           H        GLN 104   7.893   4.679 -12.308
  782    HA   GLN 104           HA       GLN 104   9.483   6.523 -10.721
  783   1HB   GLN 104          2HB       GLN 104  10.704   4.522 -12.625
  784   2HB   GLN 104          1HB       GLN 104  11.553   5.942 -12.029
  785   1HG   GLN 104          2HG       GLN 104  11.435   5.138  -9.773
  786   2HG   GLN 104          1HG       GLN 104  10.416   3.786 -10.266
  787   1HE2  GLN 104          1HE2      GLN 104  11.592   2.025  -9.963
  788   2HE2  GLN 104          2HE2      GLN 104  13.198   1.771 -10.547
  789    H    ILE 105           H        ILE 105   7.234   6.747 -12.547
  790    HA   ILE 105           HA       ILE 105   8.464   8.205 -14.786
  791    HB   ILE 105           HB       ILE 105   5.577   7.369 -14.563
  792   1HG1  ILE 105          2HG1      ILE 105   7.710   5.971 -16.178
  793   2HG1  ILE 105          1HG1      ILE 105   7.255   5.448 -14.559
  794   1HG2  ILE 105          1HG2      ILE 105   7.264   8.641 -16.659
  795   2HG2  ILE 105          2HG2      ILE 105   5.608   9.000 -16.170
  796   3HG2  ILE 105          3HG2      ILE 105   5.948   7.576 -17.155
  797   1HD1  ILE 105          1HD1      ILE 105   5.143   4.775 -15.239
  798   2HD1  ILE 105          2HD1      ILE 105   6.182   4.294 -16.581
  799   3HD1  ILE 105          3HD1      ILE 105   5.199   5.752 -16.707
  800    HA   PRO 106           HA       PRO 106   7.102  11.834 -12.504
  801   1HB   PRO 106          2HB       PRO 106   8.207  13.679 -14.132
  802   2HB   PRO 106          1HB       PRO 106   9.172  12.721 -13.003
  803   1HG   PRO 106          2HG       PRO 106   8.759  12.338 -15.943
  804   2HG   PRO 106          1HG       PRO 106  10.254  12.212 -14.998
  805   1HD   PRO 106          2HD       PRO 106   8.795  10.048 -15.779
  806   2HD   PRO 106          1HD       PRO 106   9.782  10.073 -14.304
  807    H    HIS 107           H        HIS 107   4.993  10.788 -13.648
  808    HA   HIS 107           HA       HIS 107   3.975  12.755 -15.586
  809   1HB   HIS 107          2HB       HIS 107   3.929  10.000 -15.709
  810   2HB   HIS 107          1HB       HIS 107   2.316  10.385 -15.118
  811    HD1  HIS 107           1HD      HIS 107   2.937   9.221 -17.978
  812    HD2  HIS 107           2HD      HIS 107   2.252  13.221 -17.085
  813    HE1  HIS 107           1HE      HIS 107   2.154  10.266 -20.128
  814    HE2  HIS 107           2HE      HIS 107   1.830  12.705 -19.584
  815    H    SER 108           H        SER 108   2.764  14.300 -14.730
  816    HA   SER 108           HA       SER 108   1.360  13.810 -12.214
  817   1HB   SER 108          2HB       SER 108   0.941  16.357 -12.420
  818   2HB   SER 108          1HB       SER 108   2.581  15.810 -12.071
  819    HG   SER 108           HG       SER 108   3.193  16.291 -14.096
  820    H    HIS 109           H        HIS 109   0.532  15.763 -15.075
  821    HA   HIS 109           HA       HIS 109  -2.233  14.815 -14.822
  822   1HB   HIS 109          2HB       HIS 109  -2.783  16.769 -16.279
  823   2HB   HIS 109          1HB       HIS 109  -2.040  17.217 -14.747
  824    HD1  HIS 109           1HD      HIS 109  -1.469  17.258 -18.426
  825    HD2  HIS 109           2HD      HIS 109   0.548  18.316 -14.951
  826    HE1  HIS 109           1HE      HIS 109   0.481  18.656 -19.180
  827    HE2  HIS 109           2HE      HIS 109   1.636  19.358 -17.053
  828    H    TYR 110           H        TYR 110  -2.906  13.297 -16.171
  829    HA   TYR 110           HA       TYR 110  -1.419  12.816 -18.644
  830   1HB   TYR 110          2HB       TYR 110  -1.802  10.909 -17.121
  831   2HB   TYR 110          1HB       TYR 110  -3.540  11.128 -17.299
  832    HD1  TYR 110           1HD      TYR 110  -4.695  10.319 -19.227
  833    HD2  TYR 110           2HD      TYR 110  -0.449  10.125 -19.043
  834    HE1  TYR 110           1HE      TYR 110  -4.683   8.837 -21.190
  835    HE2  TYR 110           2HE      TYR 110  -0.425   8.645 -21.006
  836    HH   TYR 110           HH       TYR 110  -1.995   8.207 -23.002
  Start of MODEL   14
    1   1H    GLY   1          1HT       GLY   1 -20.188 -24.365   1.660
    2   2H    GLY   1          2HT       GLY   1 -19.562 -25.935   1.624
    3   3H    GLY   1          3HT       GLY   1 -19.562 -24.993   0.219
    4   1HA   GLY   1          1HA       GLY   1 -18.196 -23.401   1.880
    5   2HA   GLY   1          2HA       GLY   1 -17.723 -24.993   2.455
    6    H    SER   2           H        SER   2 -16.066 -23.006   1.161
    7    HA   SER   2           HA       SER   2 -14.417 -22.878  -0.400
    8   1HB   SER   2          2HB       SER   2 -14.978 -25.797  -0.221
    9   2HB   SER   2          1HB       SER   2 -13.994 -25.242  -1.575
   10    HG   SER   2           HG       SER   2 -12.614 -24.237  -0.034
   11    H    GLN   3           H        GLN   3 -17.114 -22.262  -1.180
   12    HA   GLN   3           HA       GLN   3 -17.164 -23.115  -3.990
   13   1HB   GLN   3          2HB       GLN   3 -19.191 -23.002  -2.121
   14   2HB   GLN   3          1HB       GLN   3 -19.437 -21.530  -3.050
   15   1HG   GLN   3          2HG       GLN   3 -20.601 -22.822  -4.436
   16   2HG   GLN   3          1HG       GLN   3 -19.030 -23.371  -5.017
   17   1HE2  GLN   3          1HE2      GLN   3 -20.903 -24.043  -2.080
   18   2HE2  GLN   3          2HE2      GLN   3 -20.903 -25.760  -2.265
   19    H    ASP   4           H        ASP   4 -15.508 -21.700  -4.683
   20    HA   ASP   4           HA       ASP   4 -16.386 -19.232  -5.677
   21   1HB   ASP   4          2HB       ASP   4 -14.883 -17.726  -4.341
   22   2HB   ASP   4          1HB       ASP   4 -16.253 -18.369  -3.441
   23    H    ARG   5           H        ARG   5 -14.280 -17.834  -6.283
   24    HA   ARG   5           HA       ARG   5 -12.001 -19.515  -6.904
   25   1HB   ARG   5          2HB       ARG   5 -13.733 -19.851  -8.737
   26   2HB   ARG   5          1HB       ARG   5 -13.465 -18.169  -9.172
   27   1HG   ARG   5          2HG       ARG   5 -10.957 -18.904  -9.268
   28   2HG   ARG   5          1HG       ARG   5 -11.653 -20.514  -9.459
   29   1HD   ARG   5          2HD       ARG   5 -12.353 -20.094 -11.549
   30   2HD   ARG   5          1HD       ARG   5 -12.892 -18.465 -11.144
   31    HE   ARG   5           HE       ARG   5 -10.354 -19.228 -12.259
   32   1HH1  ARG   5          1HH1      ARG   5 -12.059 -16.798 -10.424
   33   2HH1  ARG   5          2HH1      ARG   5 -10.954 -15.532 -10.837
   34   1HH2  ARG   5          1HH2      ARG   5  -8.899 -17.563 -12.805
   35   2HH2  ARG   5          2HH2      ARG   5  -9.160 -15.965 -12.189
   36    H    LYS   6           H        LYS   6 -11.814 -17.522  -5.214
   37    HA   LYS   6           HA       LYS   6 -11.202 -15.014  -6.508
   38   1HB   LYS   6          2HB       LYS   6 -10.468 -15.724  -3.678
   39   2HB   LYS   6          1HB       LYS   6 -10.828 -14.146  -4.353
   40   1HG   LYS   6          2HG       LYS   6 -12.997 -16.155  -4.421
   41   2HG   LYS   6          1HG       LYS   6 -12.551 -15.489  -2.849
   42   1HD   LYS   6          2HD       LYS   6 -12.650 -13.231  -4.325
   43   2HD   LYS   6          1HD       LYS   6 -13.869 -14.203  -5.152
   44   1HE   LYS   6          2HE       LYS   6 -13.901 -14.037  -2.172
   45   2HE   LYS   6          1HE       LYS   6 -14.522 -12.683  -3.118
   46   1HZ   LYS   6          1HZ       LYS   6 -15.440 -15.490  -3.420
   47   2HZ   LYS   6          2HZ       LYS   6 -16.101 -14.122  -4.163
   48   3HZ   LYS   6          3HZ       LYS   6 -16.235 -14.322  -2.489
   49    H    ILE   7           H        ILE   7  -9.221 -14.205  -7.003
   50    HA   ILE   7           HA       ILE   7  -7.051 -16.088  -7.218
   51    HB   ILE   7           HB       ILE   7  -5.825 -14.137  -8.228
   52   1HG1  ILE   7          2HG1      ILE   7  -8.177 -12.564  -8.770
   53   2HG1  ILE   7          1HG1      ILE   7  -7.930 -12.686  -7.031
   54   1HG2  ILE   7          1HG2      ILE   7  -6.658 -15.449  -9.880
   55   2HG2  ILE   7          2HG2      ILE   7  -7.646 -14.018 -10.173
   56   3HG2  ILE   7          3HG2      ILE   7  -8.307 -15.374  -9.260
   57   1HD1  ILE   7          1HD1      ILE   7  -5.492 -12.034  -7.579
   58   2HD1  ILE   7          2HD1      ILE   7  -6.745 -10.793  -7.590
   59   3HD1  ILE   7          3HD1      ILE   7  -6.167 -11.475  -9.109
   60    H    PHE   8           H        PHE   8  -7.993 -13.662  -4.982
   61    HA   PHE   8           HA       PHE   8  -5.301 -13.387  -3.884
   62   1HB   PHE   8          2HB       PHE   8  -7.928 -12.032  -3.266
   63   2HB   PHE   8          1HB       PHE   8  -6.477 -11.779  -2.311
   64    HD1  PHE   8           1HD      PHE   8  -7.925  -9.576  -3.636
   65    HD2  PHE   8           2HD      PHE   8  -4.793 -12.075  -5.073
   66    HE1  PHE   8           1HE      PHE   8  -7.221  -7.801  -5.184
   67    HE2  PHE   8           2HE      PHE   8  -4.087 -10.304  -6.622
   68    HZ   PHE   8           HZ       PHE   8  -5.301  -8.164  -6.680
   69    H    ARG   9           H        ARG   9  -8.537 -14.440  -2.858
   70    HA   ARG   9           HA       ARG   9  -9.226 -15.589  -0.987
   71   1HB   ARG   9          2HB       ARG   9  -8.524 -17.327  -2.589
   72   2HB   ARG   9          1HB       ARG   9  -6.911 -17.310  -1.888
   73   1HG   ARG   9          2HG       ARG   9  -7.813 -19.107  -0.814
   74   2HG   ARG   9          1HG       ARG   9  -8.211 -17.824   0.331
   75   1HD   ARG   9          2HD       ARG   9 -10.387 -17.680  -1.185
   76   2HD   ARG   9          1HD       ARG   9  -9.973 -19.366  -1.495
   77    HE   ARG   9           HE       ARG   9 -11.099 -18.301   0.885
   78   1HH1  ARG   9          1HH1      ARG   9  -8.896 -20.742  -0.284
   79   2HH1  ARG   9          2HH1      ARG   9  -9.144 -21.792   1.070
   80   1HH2  ARG   9          1HH2      ARG   9 -11.426 -19.681   2.667
   81   2HH2  ARG   9          2HH2      ARG   9 -10.580 -21.190   2.746
   82    H    GLY  10           H        GLY  10  -8.700 -14.104   0.661
   83   1HA   GLY  10          2HA       GLY  10  -7.864 -13.809   2.819
   84   2HA   GLY  10          1HA       GLY  10  -6.737 -15.124   2.530
   85    H    LEU  11           H        LEU  11  -7.396 -11.812   1.475
   86    HA   LEU  11           HA       LEU  11  -4.527 -11.241   1.685
   87   1HB   LEU  11          2HB       LEU  11  -5.630 -11.685  -0.714
   88   2HB   LEU  11          1HB       LEU  11  -6.013  -9.984  -0.550
   89    HG   LEU  11           HG       LEU  11  -3.205 -10.865  -0.079
   90   1HD1  LEU  11          1HD1      LEU  11  -2.684 -11.241  -2.244
   91   2HD1  LEU  11          2HD1      LEU  11  -3.927 -10.145  -2.849
   92   3HD1  LEU  11          3HD1      LEU  11  -4.366 -11.768  -2.315
   93   1HD2  LEU  11          1HD2      LEU  11  -3.033  -8.657   0.111
   94   2HD2  LEU  11          2HD2      LEU  11  -4.676  -8.414  -0.474
   95   3HD2  LEU  11          3HD2      LEU  11  -3.346  -8.553  -1.621
   96    H    GLU  12           H        GLU  12  -4.054  -8.913   1.800
   97    HA   GLU  12           HA       GLU  12  -6.323  -7.260   2.647
   98   1HB   GLU  12          2HB       GLU  12  -4.038  -8.144   4.301
   99   2HB   GLU  12          1HB       GLU  12  -4.441  -6.436   4.414
  100   1HG   GLU  12          2HG       GLU  12  -6.893  -7.636   4.620
  101   2HG   GLU  12          1HG       GLU  12  -5.835  -8.766   5.465
  102    H    ILE  13           H        ILE  13  -6.304  -5.602   1.275
  103    HA   ILE  13           HA       ILE  13  -3.709  -4.352   0.646
  104    HB   ILE  13           HB       ILE  13  -6.114  -4.440  -1.175
  105   1HG1  ILE  13          2HG1      ILE  13  -3.759  -5.789  -2.167
  106   2HG1  ILE  13          1HG1      ILE  13  -4.263  -6.483  -0.629
  107   1HG2  ILE  13          1HG2      ILE  13  -3.347  -3.313  -1.455
  108   2HG2  ILE  13          2HG2      ILE  13  -4.896  -2.501  -1.681
  109   3HG2  ILE  13          3HG2      ILE  13  -4.348  -3.698  -2.855
  110   1HD1  ILE  13          1HD1      ILE  13  -6.619  -6.490  -1.733
  111   2HD1  ILE  13          2HD1      ILE  13  -5.448  -7.749  -2.125
  112   3HD1  ILE  13          3HD1      ILE  13  -5.699  -6.402  -3.233
  113    H    CYS  14           H        CYS  14  -3.512  -2.354   1.375
  114    HA   CYS  14           HA       CYS  14  -5.944  -0.816   1.966
  115   1HB   CYS  14          2HB       CYS  14  -4.682   0.382   3.616
  116   2HB   CYS  14          1HB       CYS  14  -4.387  -1.336   3.855
  117    HG   CYS  14           HG       CYS  14  -2.051  -0.879   2.555
  118    H    CYS  15           H        CYS  15  -6.344   1.053   0.950
  119    HA   CYS  15           HA       CYS  15  -4.431   1.929  -1.078
  120   1HB   CYS  15          2HB       CYS  15  -7.236   2.964  -0.679
  121   2HB   CYS  15          1HB       CYS  15  -6.240   3.066  -2.127
  122    HG   CYS  15           HG       CYS  15  -6.770   0.663  -2.686
  123    H    TYR  16           H        TYR  16  -2.935   3.221  -0.164
  124    HA   TYR  16           HA       TYR  16  -3.768   5.269   1.741
  125   1HB   TYR  16          2HB       TYR  16  -1.568   3.675   1.690
  126   2HB   TYR  16          1HB       TYR  16  -0.932   5.127   0.927
  127    HD1  TYR  16           1HD      TYR  16   0.280   6.400   2.413
  128    HD2  TYR  16           2HD      TYR  16  -3.266   4.490   3.784
  129    HE1  TYR  16           1HE      TYR  16   0.589   7.428   4.625
  130    HE2  TYR  16           2HE      TYR  16  -2.968   5.514   6.000
  131    HH   TYR  16           HH       TYR  16  -0.638   6.458   7.292
  132    H    GLY  17           H        GLY  17  -4.653   6.986   0.726
  133   1HA   GLY  17          2HA       GLY  17  -3.920   9.143  -0.203
  134   2HA   GLY  17          1HA       GLY  17  -3.055   8.227  -1.424
  135    HA   PRO  18           HA       PRO  18  -7.727   9.157  -2.465
  136   1HB   PRO  18          2HB       PRO  18  -6.771  11.630  -3.761
  137   2HB   PRO  18          1HB       PRO  18  -8.186  11.373  -2.738
  138   1HG   PRO  18          2HG       PRO  18  -6.039  12.718  -1.858
  139   2HG   PRO  18          1HG       PRO  18  -6.996  11.680  -0.786
  140   1HD   PRO  18          2HD       PRO  18  -4.356  11.140  -2.084
  141   2HD   PRO  18          1HD       PRO  18  -4.919  10.725  -0.452
  142    H    PHE  19           H        PHE  19  -4.639   9.138  -3.956
  143    HA   PHE  19           HA       PHE  19  -3.894   8.338  -5.942
  144   1HB   PHE  19          2HB       PHE  19  -6.722   7.338  -6.027
  145   2HB   PHE  19          1HB       PHE  19  -5.668   7.146  -7.420
  146    HD1  PHE  19           1HD      PHE  19  -5.667   4.751  -7.367
  147    HD2  PHE  19           2HD      PHE  19  -4.432   6.993  -3.964
  148    HE1  PHE  19           1HE      PHE  19  -4.729   2.712  -6.361
  149    HE2  PHE  19           2HE      PHE  19  -3.494   4.956  -2.958
  150    HZ   PHE  19           HZ       PHE  19  -3.642   2.812  -4.156
  151    H    THR  20           H        THR  20  -7.162   9.238  -6.974
  152    HA   THR  20           HA       THR  20  -6.009  11.487  -8.469
  153    HB   THR  20           HB       THR  20  -6.188   9.888 -10.176
  154    HG1  THR  20           1HG      THR  20  -7.306  11.878 -10.629
  155   1HG2  THR  20          1HG2      THR  20  -7.534   8.127 -10.234
  156   2HG2  THR  20          2HG2      THR  20  -8.971   9.113  -9.964
  157   3HG2  THR  20          3HG2      THR  20  -8.006   8.566  -8.593
  158    H    ASN  21           H        ASN  21  -9.135   9.935  -7.704
  159    HA   ASN  21           HA       ASN  21 -10.157  12.604  -6.995
  160   1HB   ASN  21          2HB       ASN  21 -11.551  10.411  -8.535
  161   2HB   ASN  21          1HB       ASN  21 -12.409  11.765  -7.805
  162   1HD2  ASN  21          1HD2      ASN  21 -12.024  13.868  -8.594
  163   2HD2  ASN  21          2HD2      ASN  21 -11.391  14.123 -10.182
  164    H    MET  22           H        MET  22 -11.680   9.408  -6.819
  165    HA   MET  22           HA       MET  22 -11.288   9.206  -3.977
  166   1HB   MET  22          2HB       MET  22 -13.230  10.851  -4.377
  167   2HB   MET  22          1HB       MET  22 -14.143   9.441  -4.893
  168   1HG   MET  22          2HG       MET  22 -13.195   8.542  -2.549
  169   2HG   MET  22          1HG       MET  22 -13.284  10.267  -2.201
  170   1HE   MET  22          1HE       MET  22 -16.735  10.779  -1.177
  171   2HE   MET  22          2HE       MET  22 -15.126  11.430  -1.487
  172   3HE   MET  22          3HE       MET  22 -15.341  10.135  -0.310
  173    HA   PRO  23           HA       PRO  23 -12.377   5.266  -6.298
  174   1HB   PRO  23          2HB       PRO  23 -10.006   4.324  -7.047
  175   2HB   PRO  23          1HB       PRO  23 -10.810   5.588  -7.989
  176   1HG   PRO  23          2HG       PRO  23  -8.579   5.831  -6.011
  177   2HG   PRO  23          1HG       PRO  23  -8.780   6.639  -7.575
  178   1HD   PRO  23          2HD       PRO  23  -9.392   7.768  -5.120
  179   2HD   PRO  23          1HD       PRO  23 -10.055   8.296  -6.678
  180    H    THR  24           H        THR  24 -11.041   6.180  -3.495
  181    HA   THR  24           HA       THR  24  -9.600   4.025  -2.503
  182    HB   THR  24           HB       THR  24 -11.197   5.015  -0.382
  183    HG1  THR  24           1HG      THR  24 -11.411   7.096  -0.754
  184   1HG2  THR  24          1HG2      THR  24  -8.688   4.523  -0.507
  185   2HG2  THR  24          2HG2      THR  24  -9.229   5.883   0.475
  186   3HG2  THR  24          3HG2      THR  24  -8.542   6.169  -1.124
  187    H    ASP  25           H        ASP  25 -13.082   4.463  -2.788
  188    HA   ASP  25           HA       ASP  25 -13.600   1.969  -1.388
  189   1HB   ASP  25          2HB       ASP  25 -15.133   4.330  -2.080
  190   2HB   ASP  25          1HB       ASP  25 -15.994   2.862  -2.535
  191    H    GLN  26           H        GLN  26 -13.353   3.202  -4.606
  192    HA   GLN  26           HA       GLN  26 -14.676   0.990  -5.866
  193   1HB   GLN  26          2HB       GLN  26 -14.040   3.524  -6.650
  194   2HB   GLN  26          1HB       GLN  26 -12.786   2.597  -7.459
  195   1HG   GLN  26          2HG       GLN  26 -14.673   1.123  -8.329
  196   2HG   GLN  26          1HG       GLN  26 -15.757   2.400  -7.777
  197   1HE2  GLN  26          1HE2      GLN  26 -16.029   4.164  -9.005
  198   2HE2  GLN  26          2HE2      GLN  26 -15.190   4.475 -10.482
  199    H    LEU  27           H        LEU  27 -11.420   1.831  -4.945
  200    HA   LEU  27           HA       LEU  27 -10.146  -0.224  -6.475
  201   1HB   LEU  27          2HB       LEU  27  -9.232   2.008  -5.295
  202   2HB   LEU  27          1HB       LEU  27  -8.850   0.857  -4.031
  203    HG   LEU  27           HG       LEU  27  -6.883   0.954  -5.248
  204   1HD1  LEU  27          1HD1      LEU  27  -6.738  -1.142  -6.587
  205   2HD1  LEU  27          2HD1      LEU  27  -8.484  -1.319  -6.404
  206   3HD1  LEU  27          3HD1      LEU  27  -7.440  -1.351  -4.982
  207   1HD2  LEU  27          1HD2      LEU  27  -7.286   2.264  -7.087
  208   2HD2  LEU  27          2HD2      LEU  27  -8.670   1.301  -7.607
  209   3HD2  LEU  27          3HD2      LEU  27  -7.032   0.691  -7.843
  210    H    GLU  28           H        GLU  28 -11.092   0.157  -3.067
  211    HA   GLU  28           HA       GLU  28 -10.101  -2.335  -2.214
  212   1HB   GLU  28          2HB       GLU  28 -11.759  -2.055  -0.323
  213   2HB   GLU  28          1HB       GLU  28 -10.588  -0.763  -0.528
  214   1HG   GLU  28          2HG       GLU  28 -12.279   0.661  -0.517
  215   2HG   GLU  28          1HG       GLU  28 -12.772  -0.006  -2.072
  216    H    TRP  29           H        TRP  29 -13.008  -1.426  -3.893
  217    HA   TRP  29           HA       TRP  29 -14.511  -3.770  -3.334
  218   1HB   TRP  29          2HB       TRP  29 -15.790  -2.000  -4.191
  219   2HB   TRP  29          1HB       TRP  29 -14.620  -1.641  -5.455
  220    HD1  TRP  29           HD       TRP  29 -16.997  -4.581  -4.579
  221    HE1  TRP  29           1HE      TRP  29 -17.997  -5.475  -6.777
  222    HE3  TRP  29           3HE      TRP  29 -14.546  -1.540  -7.872
  223    HZ2  TRP  29           2HZ      TRP  29 -17.769  -4.959  -9.544
  224    HZ3  TRP  29           3HZ      TRP  29 -14.990  -1.805 -10.277
  225    HH2  TRP  29           HH       TRP  29 -16.567  -3.480 -11.094
  226    H    MET  30           H        MET  30 -12.516  -2.815  -6.098
  227    HA   MET  30           HA       MET  30 -12.720  -5.133  -7.603
  228   1HB   MET  30          2HB       MET  30 -10.328  -3.305  -7.315
  229   2HB   MET  30          1HB       MET  30 -10.550  -4.485  -8.598
  230   1HG   MET  30          2HG       MET  30 -12.676  -3.256  -9.183
  231   2HG   MET  30          1HG       MET  30 -12.129  -1.987  -8.089
  232   1HE   MET  30          1HE       MET  30 -11.168   0.237 -10.440
  233   2HE   MET  30          2HE       MET  30  -9.804  -0.041  -9.357
  234   3HE   MET  30          3HE       MET  30 -11.453  -0.204  -8.756
  235    H    VAL  31           H        VAL  31 -10.271  -4.336  -5.120
  236    HA   VAL  31           HA       VAL  31  -8.895  -6.785  -5.266
  237    HB   VAL  31           HB       VAL  31  -8.064  -6.272  -2.997
  238   1HG1  VAL  31          1HG1      VAL  31  -7.886  -3.625  -4.255
  239   2HG1  VAL  31          2HG1      VAL  31  -7.479  -4.983  -5.307
  240   3HG1  VAL  31          3HG1      VAL  31  -6.608  -4.750  -3.791
  241   1HG2  VAL  31          1HG2      VAL  31 -10.003  -3.986  -3.147
  242   2HG2  VAL  31          2HG2      VAL  31  -8.727  -4.138  -1.941
  243   3HG2  VAL  31          3HG2      VAL  31 -10.032  -5.323  -1.999
  244    H    GLN  32           H        GLN  32 -11.569  -5.704  -3.226
  245    HA   GLN  32           HA       GLN  32 -11.868  -7.979  -1.641
  246   1HB   GLN  32          2HB       GLN  32 -13.469  -5.640  -2.354
  247   2HB   GLN  32          1HB       GLN  32 -14.456  -7.057  -2.040
  248   1HG   GLN  32          2HG       GLN  32 -13.664  -7.255   0.160
  249   2HG   GLN  32          1HG       GLN  32 -12.322  -6.151  -0.139
  250   1HE2  GLN  32          1HE2      GLN  32 -13.704  -5.598   2.009
  251   2HE2  GLN  32          2HE2      GLN  32 -14.766  -4.254   1.780
  252    H    LEU  33           H        LEU  33 -12.934  -7.257  -4.888
  253    HA   LEU  33           HA       LEU  33 -14.651  -9.500  -5.210
  254   1HB   LEU  33          2HB       LEU  33 -14.719  -7.417  -6.582
  255   2HB   LEU  33          1HB       LEU  33 -13.212  -7.910  -7.333
  256    HG   LEU  33           HG       LEU  33 -14.279  -9.844  -8.320
  257   1HD1  LEU  33          1HD1      LEU  33 -15.907 -10.684  -6.983
  258   2HD1  LEU  33          2HD1      LEU  33 -16.928  -9.732  -8.062
  259   3HD1  LEU  33          3HD1      LEU  33 -16.473  -9.091  -6.483
  260   1HD2  LEU  33          1HD2      LEU  33 -15.378  -7.129  -8.743
  261   2HD2  LEU  33          2HD2      LEU  33 -16.229  -8.469  -9.510
  262   3HD2  LEU  33          3HD2      LEU  33 -14.522  -8.195  -9.857
  263    H    CYS  34           H        CYS  34 -11.235  -9.080  -5.315
  264    HA   CYS  34           HA       CYS  34 -10.810 -11.539  -6.824
  265   1HB   CYS  34          2HB       CYS  34  -9.025  -9.332  -5.859
  266   2HB   CYS  34          1HB       CYS  34  -8.336 -10.879  -6.335
  267    HG   CYS  34           HG       CYS  34  -9.915  -9.064  -8.310
  268    H    GLY  35           H        GLY  35 -11.430 -10.794  -3.652
  269   1HA   GLY  35          2HA       GLY  35 -11.535 -12.592  -2.058
  270   2HA   GLY  35          1HA       GLY  35 -10.079 -13.257  -2.776
  271    H    ALA  36           H        ALA  36 -10.016  -9.870  -2.327
  272    HA   ALA  36           HA       ALA  36  -8.181 -10.232  -0.069
  273   1HB   ALA  36          1HB       ALA  36  -8.497  -7.994  -2.056
  274   2HB   ALA  36          2HB       ALA  36  -7.141  -9.109  -1.886
  275   3HB   ALA  36          3HB       ALA  36  -7.448  -7.899  -0.641
  276    H    SER  37           H        SER  37  -8.122  -8.208   1.407
  277    HA   SER  37           HA       SER  37 -10.876  -7.388   2.045
  278   1HB   SER  37          2HB       SER  37  -9.183  -9.032   3.610
  279   2HB   SER  37          1HB       SER  37  -9.260  -7.469   4.421
  280    HG   SER  37           HG       SER  37 -11.421  -7.671   4.634
  281    H    VAL  38           H        VAL  38 -11.171  -5.266   2.390
  282    HA   VAL  38           HA       VAL  38  -9.039  -3.453   1.851
  283    HB   VAL  38           HB       VAL  38 -11.385  -3.003   1.211
  284   1HG1  VAL  38          1HG1      VAL  38 -13.055  -2.411   2.759
  285   2HG1  VAL  38          2HG1      VAL  38 -11.901  -2.319   4.090
  286   3HG1  VAL  38          3HG1      VAL  38 -12.322  -3.884   3.395
  287   1HG2  VAL  38          1HG2      VAL  38  -9.771  -1.181   1.342
  288   2HG2  VAL  38          2HG2      VAL  38 -10.170  -0.939   3.043
  289   3HG2  VAL  38          3HG2      VAL  38 -11.382  -0.630   1.801
  290    H    VAL  39           H        VAL  39  -7.597  -2.658   3.223
  291    HA   VAL  39           HA       VAL  39  -8.017  -3.013   6.092
  292    HB   VAL  39           HB       VAL  39  -5.504  -1.820   5.049
  293   1HG1  VAL  39          1HG1      VAL  39  -5.983  -2.319   7.463
  294   2HG1  VAL  39          2HG1      VAL  39  -4.493  -3.011   6.821
  295   3HG1  VAL  39          3HG1      VAL  39  -5.916  -4.030   7.039
  296   1HG2  VAL  39          1HG2      VAL  39  -6.524  -4.463   4.238
  297   2HG2  VAL  39          2HG2      VAL  39  -4.864  -4.431   4.832
  298   3HG2  VAL  39          3HG2      VAL  39  -5.331  -3.420   3.465
  299    H    LYS  40           H        LYS  40  -8.539  -1.395   7.417
  300    HA   LYS  40           HA       LYS  40  -9.257   1.145   6.498
  301   1HB   LYS  40          2HB       LYS  40  -8.698   0.070   9.253
  302   2HB   LYS  40          1HB       LYS  40  -9.179   1.742   8.994
  303   1HG   LYS  40          2HG       LYS  40 -11.311   1.185   8.393
  304   2HG   LYS  40          1HG       LYS  40 -10.844  -0.408   7.796
  305   1HD   LYS  40          2HD       LYS  40 -10.257  -0.341  10.565
  306   2HD   LYS  40          1HD       LYS  40 -11.881   0.317  10.357
  307   1HE   LYS  40          2HE       LYS  40 -10.835  -2.377   9.538
  308   2HE   LYS  40          1HE       LYS  40 -12.165  -2.006  10.633
  309   1HZ   LYS  40          1HZ       LYS  40 -13.038  -0.854   8.408
  310   2HZ   LYS  40          2HZ       LYS  40 -13.379  -2.461   8.809
  311   3HZ   LYS  40          3HZ       LYS  40 -12.126  -2.107   7.729
  312    H    GLU  41           H        GLU  41  -6.297   0.003   8.033
  313    HA   GLU  41           HA       GLU  41  -4.855   2.273   6.955
  314   1HB   GLU  41          2HB       GLU  41  -5.389   1.909   9.862
  315   2HB   GLU  41          1HB       GLU  41  -3.790   2.466   9.388
  316   1HG   GLU  41          2HG       GLU  41  -5.848   3.935   8.005
  317   2HG   GLU  41          1HG       GLU  41  -6.079   4.005   9.751
  318    H    LEU  42           H        LEU  42  -2.444   2.056   7.973
  319    HA   LEU  42           HA       LEU  42  -1.493  -0.438   6.962
  320   1HB   LEU  42          2HB       LEU  42   0.125   1.555   8.531
  321   2HB   LEU  42          1HB       LEU  42   0.690   0.417   7.323
  322    HG   LEU  42           HG       LEU  42  -1.066   2.805   6.750
  323   1HD1  LEU  42          1HD1      LEU  42   0.868   3.910   7.064
  324   2HD1  LEU  42          2HD1      LEU  42   1.257   3.280   5.464
  325   3HD1  LEU  42          3HD1      LEU  42   1.851   2.455   6.905
  326   1HD2  LEU  42          1HD2      LEU  42  -0.126   0.513   5.155
  327   2HD2  LEU  42          2HD2      LEU  42   0.028   2.096   4.394
  328   3HD2  LEU  42          3HD2      LEU  42  -1.548   1.535   4.951
  329    H    SER  43           H        SER  43  -1.868   0.969  10.172
  330    HA   SER  43           HA       SER  43  -0.546  -1.148  11.548
  331   1HB   SER  43          2HB       SER  43  -1.548   1.382  12.217
  332   2HB   SER  43          1HB       SER  43  -2.482   0.246  13.189
  333    HG   SER  43           HG       SER  43   0.350   0.270  13.021
  334    H    SER  44           H        SER  44  -3.510  -1.035   9.981
  335    HA   SER  44           HA       SER  44  -4.833  -2.885  11.802
  336   1HB   SER  44          2HB       SER  44  -5.685  -1.265   9.442
  337   2HB   SER  44          1HB       SER  44  -6.609  -2.712   9.844
  338    HG   SER  44           HG       SER  44  -7.388  -0.796  10.883
  339    H    PHE  45           H        PHE  45  -2.410  -3.492   9.994
  340    HA   PHE  45           HA       PHE  45  -3.437  -5.479   8.170
  341   1HB   PHE  45          2HB       PHE  45  -0.737  -4.429   8.892
  342   2HB   PHE  45          1HB       PHE  45  -0.836  -6.020   8.144
  343    HD1  PHE  45           1HD      PHE  45  -0.017  -2.897   7.346
  344    HD2  PHE  45           2HD      PHE  45  -2.885  -5.814   6.175
  345    HE1  PHE  45           1HE      PHE  45  -0.188  -1.836   5.133
  346    HE2  PHE  45           2HE      PHE  45  -3.060  -4.758   3.957
  347    HZ   PHE  45           HZ       PHE  45  -1.710  -2.766   3.438
  348    H    THR  46           H        THR  46  -4.480  -7.053   9.324
  349    HA   THR  46           HA       THR  46  -3.233  -8.290  11.618
  350    HB   THR  46           HB       THR  46  -5.330  -9.902  11.102
  351    HG1  THR  46           1HG      THR  46  -6.226  -7.403  10.142
  352   1HG2  THR  46          1HG2      THR  46  -6.617  -8.692  12.652
  353   2HG2  THR  46          2HG2      THR  46  -5.801  -7.178  12.266
  354   3HG2  THR  46          3HG2      THR  46  -4.935  -8.453  13.124
  355    H    LEU  47           H        LEU  47  -3.345 -10.807  11.636
  356    HA   LEU  47           HA       LEU  47  -2.452 -11.936   9.089
  357   1HB   LEU  47          2HB       LEU  47  -0.562 -13.072  10.306
  358   2HB   LEU  47          1HB       LEU  47  -0.374 -11.348  10.046
  359    HG   LEU  47           HG       LEU  47  -1.544 -12.216  12.637
  360   1HD1  LEU  47          1HD1      LEU  47   0.293 -13.784  12.362
  361   2HD1  LEU  47          2HD1      LEU  47   0.679 -12.580  13.592
  362   3HD1  LEU  47          3HD1      LEU  47   1.388 -12.455  11.981
  363   1HD2  LEU  47          1HD2      LEU  47  -0.439 -10.275  13.457
  364   2HD2  LEU  47          2HD2      LEU  47  -1.210  -9.831  11.935
  365   3HD2  LEU  47          3HD2      LEU  47   0.528 -10.129  11.990
  366    H    GLY  48           H        GLY  48  -2.437 -14.289   9.072
  367   1HA   GLY  48          2HA       GLY  48  -3.704 -15.666  11.287
  368   2HA   GLY  48          1HA       GLY  48  -4.694 -15.528   9.843
  369    H    THR  49           H        THR  49  -4.555 -17.131   8.423
  370    HA   THR  49           HA       THR  49  -2.126 -18.801   8.448
  371    HB   THR  49           HB       THR  49  -3.933 -20.536   7.509
  372    HG1  THR  49           1HG      THR  49  -5.421 -18.969   9.338
  373   1HG2  THR  49          1HG2      THR  49  -2.775 -21.314   9.324
  374   2HG2  THR  49          2HG2      THR  49  -4.396 -21.141   9.996
  375   3HG2  THR  49          3HG2      THR  49  -3.173 -19.912  10.317
  376    H    GLY  50           H        GLY  50  -4.797 -17.550   6.487
  377   1HA   GLY  50          2HA       GLY  50  -3.100 -17.959   4.102
  378   2HA   GLY  50          1HA       GLY  50  -4.847 -18.138   4.069
  379    H    VAL  51           H        VAL  51  -3.340 -15.596   5.910
  380    HA   VAL  51           HA       VAL  51  -4.623 -13.629   4.175
  381    HB   VAL  51           HB       VAL  51  -3.240 -13.164   6.820
  382   1HG1  VAL  51          1HG1      VAL  51  -3.484 -11.180   5.387
  383   2HG1  VAL  51          2HG1      VAL  51  -4.467 -11.071   6.848
  384   3HG1  VAL  51          3HG1      VAL  51  -5.222 -11.469   5.304
  385   1HG2  VAL  51          1HG2      VAL  51  -6.173 -13.074   6.719
  386   2HG2  VAL  51          2HG2      VAL  51  -5.097 -13.735   7.951
  387   3HG2  VAL  51          3HG2      VAL  51  -5.474 -14.678   6.509
  388    H    HIS  52           H        HIS  52  -3.523 -11.879   3.256
  389    HA   HIS  52           HA       HIS  52  -0.593 -11.963   3.342
  390   1HB   HIS  52          2HB       HIS  52  -2.179 -12.774   1.128
  391   2HB   HIS  52          1HB       HIS  52  -1.406 -11.254   0.693
  392    HD1  HIS  52           1HD      HIS  52   0.310 -13.722   2.930
  393    HD2  HIS  52           2HD      HIS  52   0.409 -12.477  -1.033
  394    HE1  HIS  52           1HE      HIS  52   2.386 -14.753   1.954
  395    HE2  HIS  52           2HE      HIS  52   2.382 -14.051  -0.466
  396    HA   PRO  53           HA       PRO  53  -1.542  -7.603   3.865
  397   1HB   PRO  53          2HB       PRO  53   0.875  -6.820   4.713
  398   2HB   PRO  53          1HB       PRO  53  -0.199  -7.775   5.743
  399   1HG   PRO  53          2HG       PRO  53   2.156  -8.661   4.124
  400   2HG   PRO  53          1HG       PRO  53   1.684  -9.136   5.766
  401   1HD   PRO  53          2HD       PRO  53   1.175 -10.635   3.516
  402   2HD   PRO  53          1HD       PRO  53   0.222 -10.725   5.010
  403    H    ILE  54           H        ILE  54  -1.615  -6.122   2.311
  404    HA   ILE  54           HA       ILE  54   0.716  -5.644   0.618
  405    HB   ILE  54           HB       ILE  54  -1.996  -5.947  -0.651
  406   1HG1  ILE  54          2HG1      ILE  54  -1.221  -8.108   0.387
  407   2HG1  ILE  54          1HG1      ILE  54  -1.445  -8.166  -1.357
  408   1HG2  ILE  54          1HG2      ILE  54  -0.152  -6.442  -2.569
  409   2HG2  ILE  54          2HG2      ILE  54   0.721  -5.296  -1.552
  410   3HG2  ILE  54          3HG2      ILE  54  -0.843  -4.854  -2.237
  411   1HD1  ILE  54          1HD1      ILE  54   0.770  -8.435  -1.769
  412   2HD1  ILE  54          2HD1      ILE  54   0.666  -9.206  -0.186
  413   3HD1  ILE  54          3HD1      ILE  54   1.264  -7.551  -0.324
  414    H    VAL  55           H        VAL  55   0.615  -3.595  -0.515
  415    HA   VAL  55           HA       VAL  55  -1.453  -1.744   0.440
  416    HB   VAL  55           HB       VAL  55   1.472  -1.005   0.463
  417   1HG1  VAL  55          1HG1      VAL  55  -1.048   0.406   0.911
  418   2HG1  VAL  55          2HG1      VAL  55   0.551   1.034   0.512
  419   3HG1  VAL  55          3HG1      VAL  55   0.146   0.653   2.185
  420   1HG2  VAL  55          1HG2      VAL  55   1.557  -1.347   2.797
  421   2HG2  VAL  55          2HG2      VAL  55   0.854  -2.818   2.123
  422   3HG2  VAL  55          3HG2      VAL  55  -0.182  -1.620   2.899
  423    H    VAL  56           H        VAL  56  -1.937  -0.056  -0.957
  424    HA   VAL  56           HA       VAL  56  -0.467  -0.029  -3.508
  425    HB   VAL  56           HB       VAL  56  -3.450   0.303  -3.273
  426   1HG1  VAL  56          1HG1      VAL  56  -2.596   1.455  -5.182
  427   2HG1  VAL  56          2HG1      VAL  56  -3.354  -0.034  -5.744
  428   3HG1  VAL  56          3HG1      VAL  56  -1.598   0.073  -5.633
  429   1HG2  VAL  56          1HG2      VAL  56  -3.766  -1.903  -3.990
  430   2HG2  VAL  56          2HG2      VAL  56  -2.530  -2.016  -2.736
  431   3HG2  VAL  56          3HG2      VAL  56  -2.070  -2.090  -4.437
  432    H    VAL  57           H        VAL  57  -0.684   1.970  -4.736
  433    HA   VAL  57           HA       VAL  57  -1.641   4.322  -3.336
  434    HB   VAL  57           HB       VAL  57   1.160   4.593  -4.280
  435   1HG1  VAL  57          1HG1      VAL  57   0.549   5.664  -1.674
  436   2HG1  VAL  57          2HG1      VAL  57  -0.689   6.125  -2.843
  437   3HG1  VAL  57          3HG1      VAL  57   1.003   6.508  -3.155
  438   1HG2  VAL  57          1HG2      VAL  57   1.225   2.478  -3.011
  439   2HG2  VAL  57          2HG2      VAL  57   0.530   3.312  -1.621
  440   3HG2  VAL  57          3HG2      VAL  57   2.125   3.771  -2.218
  441    H    GLN  58           H        GLN  58  -0.492   6.291  -4.854
  442    HA   GLN  58           HA       GLN  58  -0.292   5.835  -7.598
  443   1HB   GLN  58          2HB       GLN  58  -2.838   5.344  -6.925
  444   2HB   GLN  58          1HB       GLN  58  -2.947   7.085  -7.134
  445   1HG   GLN  58          2HG       GLN  58  -1.558   5.662  -9.290
  446   2HG   GLN  58          1HG       GLN  58  -3.269   5.275  -9.111
  447   1HE2  GLN  58          1HE2      GLN  58  -4.805   6.870  -9.466
  448   2HE2  GLN  58          2HE2      GLN  58  -4.429   8.351 -10.272
  449    HA   PRO  59           HA       PRO  59   1.024   9.957  -5.753
  450   1HB   PRO  59          2HB       PRO  59   3.042   9.410  -7.883
  451   2HB   PRO  59          1HB       PRO  59   3.269  10.079  -6.263
  452   1HG   PRO  59          2HG       PRO  59   3.923   7.554  -6.788
  453   2HG   PRO  59          1HG       PRO  59   3.170   7.996  -5.245
  454   1HD   PRO  59          2HD       PRO  59   1.984   6.627  -7.612
  455   2HD   PRO  59          1HD       PRO  59   1.637   6.405  -5.886
  456    H    ASP  60           H        ASP  60  -0.492  11.321  -6.549
  457    HA   ASP  60           HA       ASP  60  -0.028  12.679  -8.967
  458   1HB   ASP  60          2HB       ASP  60  -1.287  10.309  -9.469
  459   2HB   ASP  60          1HB       ASP  60  -2.660  11.396  -9.277
  460    H    ALA  61           H        ALA  61  -2.432  11.740  -6.568
  461    HA   ALA  61           HA       ALA  61  -3.271  14.561  -6.414
  462   1HB   ALA  61          1HB       ALA  61  -5.528  13.783  -5.808
  463   2HB   ALA  61          2HB       ALA  61  -5.012  12.119  -6.085
  464   3HB   ALA  61          3HB       ALA  61  -5.052  13.264  -7.426
  465    H    TRP  62           H        TRP  62  -1.205  13.150  -4.907
  466    HA   TRP  62           HA       TRP  62  -2.363  12.869  -2.243
  467   1HB   TRP  62          2HB       TRP  62  -0.429  11.433  -3.447
  468   2HB   TRP  62          1HB       TRP  62   0.568  12.637  -2.638
  469    HD1  TRP  62           HD       TRP  62  -1.908   9.802  -1.864
  470    HE1  TRP  62           1HE      TRP  62  -1.555   9.059   0.575
  471    HE3  TRP  62           3HE      TRP  62   1.427  13.390  -0.396
  472    HZ2  TRP  62           2HZ      TRP  62  -0.062   9.886   2.824
  473    HZ3  TRP  62           3HZ      TRP  62   2.269  13.342   1.915
  474    HH2  TRP  62           HH       TRP  62   1.538  11.626   3.492
  475    H    THR  63           H        THR  63  -0.311  15.007  -4.100
  476    HA   THR  63           HA       THR  63   0.504  17.091  -3.695
  477    HB   THR  63           HB       THR  63  -1.229  17.337  -1.262
  478    HG1  THR  63           1HG      THR  63  -3.007  17.677  -2.587
  479   1HG2  THR  63          1HG2      THR  63  -1.632  19.454  -3.030
  480   2HG2  THR  63          2HG2      THR  63   0.105  19.143  -3.046
  481   3HG2  THR  63          3HG2      THR  63  -0.719  19.470  -1.522
  482    H    GLU  64           H        GLU  64   1.966  18.260  -2.348
  483    HA   GLU  64           HA       GLU  64   3.426  16.528  -0.544
  484   1HB   GLU  64          2HB       GLU  64   4.276  18.327  -2.344
  485   2HB   GLU  64          1HB       GLU  64   4.240  19.359  -0.921
  486   1HG   GLU  64          2HG       GLU  64   5.968  18.291   0.073
  487   2HG   GLU  64          1HG       GLU  64   5.551  16.727  -0.628
  488    H    ASP  65           H        ASP  65   3.183  16.503   1.586
  489    HA   ASP  65           HA       ASP  65   2.617  18.914   3.065
  490   1HB   ASP  65          2HB       ASP  65   0.585  16.718   2.777
  491   2HB   ASP  65          1HB       ASP  65   0.639  17.707   4.233
  492    H    ASN  66           H        ASN  66   2.300  15.389   3.537
  493    HA   ASN  66           HA       ASN  66   3.863  15.626   5.996
  494   1HB   ASN  66          2HB       ASN  66   2.455  13.173   4.933
  495   2HB   ASN  66          1HB       ASN  66   3.041  13.446   6.571
  496   1HD2  ASN  66          1HD2      ASN  66   1.303  13.508   7.811
  497   2HD2  ASN  66          2HD2      ASN  66  -0.097  14.482   7.538
  498    H    GLY  67           H        GLY  67   4.013  14.290   2.777
  499   1HA   GLY  67          2HA       GLY  67   6.188  13.974   1.766
  500   2HA   GLY  67          1HA       GLY  67   6.785  13.449   3.334
  501    H    PHE  68           H        PHE  68   6.087  12.357   0.369
  502    HA   PHE  68           HA       PHE  68   4.901   9.825   1.213
  503   1HB   PHE  68          2HB       PHE  68   4.106  11.085  -0.845
  504   2HB   PHE  68          1HB       PHE  68   5.633  10.635  -1.599
  505    HD1  PHE  68           1HD      PHE  68   5.993   8.453  -2.442
  506    HD2  PHE  68           2HD      PHE  68   2.490   9.328  -0.190
  507    HE1  PHE  68           1HE      PHE  68   5.027   6.292  -3.112
  508    HE2  PHE  68           2HE      PHE  68   1.517   7.170  -0.855
  509    HZ   PHE  68           HZ       PHE  68   2.787   5.647  -2.317
  510    H    HIS  69           H        HIS  69   7.893  10.966   1.338
  511    HA   HIS  69           HA       HIS  69   9.249   8.717   0.080
  512   1HB   HIS  69          2HB       HIS  69  10.360  11.108   1.565
  513   2HB   HIS  69          1HB       HIS  69  11.321   9.893   0.730
  514    HD1  HIS  69           1HD      HIS  69   8.476  12.258  -0.194
  515    HD2  HIS  69           2HD      HIS  69  11.999  10.699  -1.752
  516    HE1  HIS  69           1HE      HIS  69   8.752  13.342  -2.447
  517    HE2  HIS  69           2HE      HIS  69  10.935  12.447  -3.333
  518    H    ALA  70           H        ALA  70   7.711   7.665   1.960
  519    HA   ALA  70           HA       ALA  70   9.531   6.378   3.693
  520   1HB   ALA  70          1HB       ALA  70   8.403   7.188   5.845
  521   2HB   ALA  70          2HB       ALA  70   7.847   8.558   4.883
  522   3HB   ALA  70          3HB       ALA  70   9.575   8.259   5.078
  523    H    ILE  71           H        ILE  71   7.446   5.716   1.813
  524    HA   ILE  71           HA       ILE  71   5.110   4.835   3.165
  525    HB   ILE  71           HB       ILE  71   6.224   3.708   0.597
  526   1HG1  ILE  71          2HG1      ILE  71   6.108   6.145   0.427
  527   2HG1  ILE  71          1HG1      ILE  71   4.852   5.401  -0.555
  528   1HG2  ILE  71          1HG2      ILE  71   4.266   2.619   1.891
  529   2HG2  ILE  71          2HG2      ILE  71   4.098   2.897   0.158
  530   3HG2  ILE  71          3HG2      ILE  71   3.332   3.994   1.305
  531   1HD1  ILE  71          1HD1      ILE  71   4.215   6.270   2.221
  532   2HD1  ILE  71          2HD1      ILE  71   3.164   6.134   0.812
  533   3HD1  ILE  71          3HD1      ILE  71   4.316   7.464   0.929
  534    H    GLY  72           H        GLY  72   7.820   2.943   1.805
  535   1HA   GLY  72          2HA       GLY  72   7.077   0.520   3.038
  536   2HA   GLY  72          1HA       GLY  72   8.669   0.893   2.394
  537    H    GLN  73           H        GLN  73   8.723   3.291   4.278
  538    HA   GLN  73           HA       GLN  73   9.944   1.866   6.479
  539   1HB   GLN  73          2HB       GLN  73   9.721   4.811   5.846
  540   2HB   GLN  73          1HB       GLN  73  10.567   4.170   7.247
  541   1HG   GLN  73          2HG       GLN  73  12.386   4.067   5.994
  542   2HG   GLN  73          1HG       GLN  73  11.613   2.762   5.096
  543   1HE2  GLN  73          1HE2      GLN  73  11.271   3.053   3.004
  544   2HE2  GLN  73          2HE2      GLN  73  11.362   4.563   2.167
  545    H    MET  74           H        MET  74   6.901   3.247   5.804
  546    HA   MET  74           HA       MET  74   6.263   3.688   8.617
  547   1HB   MET  74          2HB       MET  74   5.537   5.139   6.530
  548   2HB   MET  74          1HB       MET  74   4.239   3.956   6.439
  549   1HG   MET  74          2HG       MET  74   3.160   4.848   8.164
  550   2HG   MET  74          1HG       MET  74   4.630   4.975   9.127
  551   1HE   MET  74          1HE       MET  74   1.926   6.373   7.542
  552   2HE   MET  74          2HE       MET  74   2.536   7.420   6.262
  553   3HE   MET  74          3HE       MET  74   2.107   8.103   7.830
  554    H    CYS  75           H        CYS  75   5.729   1.394   6.060
  555    HA   CYS  75           HA       CYS  75   4.212  -0.276   7.942
  556   1HB   CYS  75          2HB       CYS  75   2.647   0.726   6.310
  557   2HB   CYS  75          1HB       CYS  75   3.586   0.023   4.997
  558    HG   CYS  75           HG       CYS  75   1.929  -1.787   5.249
  559    H    GLU  76           H        GLU  76   4.353  -2.568   7.526
  560    HA   GLU  76           HA       GLU  76   6.915  -3.277   6.290
  561   1HB   GLU  76          2HB       GLU  76   6.822  -5.308   7.622
  562   2HB   GLU  76          1HB       GLU  76   6.586  -3.903   8.652
  563   1HG   GLU  76          2HG       GLU  76   4.088  -4.348   8.389
  564   2HG   GLU  76          1HG       GLU  76   4.563  -5.920   7.749
  565    H    ALA  77           H        ALA  77   4.490  -2.789   4.735
  566    HA   ALA  77           HA       ALA  77   4.193  -5.463   3.528
  567   1HB   ALA  77          1HB       ALA  77   2.123  -3.345   4.003
  568   2HB   ALA  77          2HB       ALA  77   2.082  -5.054   4.435
  569   3HB   ALA  77          3HB       ALA  77   1.918  -4.568   2.749
  570    HA   PRO  78           HA       PRO  78   5.606  -3.801  -0.294
  571   1HB   PRO  78          2HB       PRO  78   3.915  -4.991  -2.092
  572   2HB   PRO  78          1HB       PRO  78   5.279  -5.812  -1.326
  573   1HG   PRO  78          2HG       PRO  78   2.374  -5.894  -0.617
  574   2HG   PRO  78          1HG       PRO  78   3.556  -7.215  -0.654
  575   1HD   PRO  78          2HD       PRO  78   2.792  -6.044   1.649
  576   2HD   PRO  78          1HD       PRO  78   4.444  -6.645   1.403
  577    H    VAL  79           H        VAL  79   5.207  -2.204  -1.803
  578    HA   VAL  79           HA       VAL  79   2.557  -0.918  -1.663
  579    HB   VAL  79           HB       VAL  79   5.201   0.488  -2.059
  580   1HG1  VAL  79          1HG1      VAL  79   4.044   2.491  -2.051
  581   2HG1  VAL  79          2HG1      VAL  79   2.622   1.785  -1.281
  582   3HG1  VAL  79          3HG1      VAL  79   2.972   1.437  -2.973
  583   1HG2  VAL  79          1HG2      VAL  79   3.499   0.562   0.419
  584   2HG2  VAL  79          2HG2      VAL  79   5.133   1.187   0.196
  585   3HG2  VAL  79          3HG2      VAL  79   4.850  -0.554   0.221
  586    H    VAL  80           H        VAL  80   1.528  -0.647  -3.564
  587    HA   VAL  80           HA       VAL  80   3.102  -0.484  -6.029
  588    HB   VAL  80           HB       VAL  80   1.625  -2.114  -7.167
  589   1HG1  VAL  80          1HG1      VAL  80   3.721  -2.973  -6.549
  590   2HG1  VAL  80          2HG1      VAL  80   2.552  -4.169  -5.986
  591   3HG1  VAL  80          3HG1      VAL  80   3.281  -3.043  -4.842
  592   1HG2  VAL  80          1HG2      VAL  80   0.735  -3.225  -4.562
  593   2HG2  VAL  80          2HG2      VAL  80  -0.038  -3.291  -6.145
  594   3HG2  VAL  80          3HG2      VAL  80  -0.113  -1.811  -5.188
  595    H    THR  81           H        THR  81   1.433  -0.198  -7.942
  596    HA   THR  81           HA       THR  81  -0.311   1.999  -7.136
  597    HB   THR  81           HB       THR  81  -0.295   2.694  -9.410
  598    HG1  THR  81           1HG      THR  81   0.961   0.255 -10.109
  599   1HG2  THR  81          1HG2      THR  81   2.462   1.563  -9.228
  600   2HG2  THR  81          2HG2      THR  81   1.935   2.840  -8.131
  601   3HG2  THR  81          3HG2      THR  81   1.925   3.115  -9.873
  602    H    ARG  82           H        ARG  82  -2.399   2.129  -8.582
  603    HA   ARG  82           HA       ARG  82  -3.985  -0.108  -7.862
  604   1HB   ARG  82          2HB       ARG  82  -5.668   1.116  -9.505
  605   2HB   ARG  82          1HB       ARG  82  -5.325   1.730  -7.898
  606   1HG   ARG  82          2HG       ARG  82  -5.354   3.471  -9.653
  607   2HG   ARG  82          1HG       ARG  82  -3.820   3.375  -8.787
  608   1HD   ARG  82          2HD       ARG  82  -2.829   2.135 -10.608
  609   2HD   ARG  82          1HD       ARG  82  -4.375   2.084 -11.451
  610    HE   ARG  82           HE       ARG  82  -3.675   4.761 -10.975
  611   1HH1  ARG  82          1HH1      ARG  82  -2.690   2.037 -12.921
  612   2HH1  ARG  82          2HH1      ARG  82  -2.065   3.019 -14.203
  613   1HH2  ARG  82          1HH2      ARG  82  -2.854   6.055 -12.660
  614   2HH2  ARG  82          2HH2      ARG  82  -2.158   5.301 -14.055
  615    H    GLU  83           H        GLU  83  -1.937   0.369 -10.501
  616    HA   GLU  83           HA       GLU  83  -3.294  -0.869 -12.599
  617   1HB   GLU  83          2HB       GLU  83  -0.540  -0.193 -11.961
  618   2HB   GLU  83          1HB       GLU  83  -0.642  -1.709 -12.844
  619   1HG   GLU  83          2HG       GLU  83  -1.161  -0.690 -14.753
  620   2HG   GLU  83          1HG       GLU  83  -2.324   0.379 -13.973
  621    H    TRP  84           H        TRP  84  -1.456  -2.240  -9.919
  622    HA   TRP  84           HA       TRP  84  -1.414  -4.921 -10.690
  623   1HB   TRP  84          2HB       TRP  84  -0.165  -4.074  -8.767
  624   2HB   TRP  84          1HB       TRP  84  -1.662  -3.717  -7.924
  625    HD1  TRP  84           HD       TRP  84   0.281  -6.807  -9.234
  626    HE1  TRP  84           1HE      TRP  84  -0.279  -8.796  -7.697
  627    HE3  TRP  84           3HE      TRP  84  -3.190  -4.560  -6.232
  628    HZ2  TRP  84           2HZ      TRP  84  -1.973  -9.339  -5.500
  629    HZ3  TRP  84           3HZ      TRP  84  -4.236  -5.882  -4.439
  630    HH2  TRP  84           HH       TRP  84  -3.640  -8.219  -4.080
  631    H    VAL  85           H        VAL  85  -3.670  -3.286  -8.530
  632    HA   VAL  85           HA       VAL  85  -5.498  -5.353  -8.193
  633    HB   VAL  85           HB       VAL  85  -6.071  -2.386  -8.205
  634   1HG1  VAL  85          1HG1      VAL  85  -8.193  -3.184  -8.150
  635   2HG1  VAL  85          2HG1      VAL  85  -7.813  -3.369  -6.439
  636   3HG1  VAL  85          3HG1      VAL  85  -7.704  -4.758  -7.521
  637   1HG2  VAL  85          1HG2      VAL  85  -5.135  -4.260  -6.047
  638   2HG2  VAL  85          2HG2      VAL  85  -5.864  -2.692  -5.703
  639   3HG2  VAL  85          3HG2      VAL  85  -4.361  -2.782  -6.621
  640    H    LEU  86           H        LEU  86  -5.491  -2.747 -10.597
  641    HA   LEU  86           HA       LEU  86  -7.900  -3.498 -11.860
  642   1HB   LEU  86          2HB       LEU  86  -5.852  -1.532 -12.223
  643   2HB   LEU  86          1HB       LEU  86  -6.191  -2.284 -13.771
  644    HG   LEU  86           HG       LEU  86  -8.713  -1.805 -12.909
  645   1HD1  LEU  86          1HD1      LEU  86  -6.906   0.073 -11.492
  646   2HD1  LEU  86          2HD1      LEU  86  -8.465  -0.590 -11.002
  647   3HD1  LEU  86          3HD1      LEU  86  -8.395   0.721 -12.179
  648   1HD2  LEU  86          1HD2      LEU  86  -6.792  -0.193 -14.540
  649   2HD2  LEU  86          2HD2      LEU  86  -8.433   0.388 -14.265
  650   3HD2  LEU  86          3HD2      LEU  86  -8.170  -1.161 -15.065
  651    H    ASP  87           H        ASP  87  -4.526  -4.021 -12.894
  652    HA   ASP  87           HA       ASP  87  -5.103  -5.650 -15.087
  653   1HB   ASP  87          2HB       ASP  87  -2.892  -4.633 -14.676
  654   2HB   ASP  87          1HB       ASP  87  -2.651  -5.720 -13.312
  655    H    SER  88           H        SER  88  -4.877  -6.374 -11.679
  656    HA   SER  88           HA       SER  88  -4.833  -9.224 -12.015
  657   1HB   SER  88          2HB       SER  88  -5.209  -7.404  -9.643
  658   2HB   SER  88          1HB       SER  88  -5.400  -9.152  -9.504
  659    HG   SER  88           HG       SER  88  -3.311  -9.025  -9.171
  660    H    VAL  89           H        VAL  89  -7.296  -6.857 -11.005
  661    HA   VAL  89           HA       VAL  89  -9.374  -8.794 -10.783
  662    HB   VAL  89           HB       VAL  89  -9.626  -5.801 -11.109
  663   1HG1  VAL  89          1HG1      VAL  89 -11.808  -6.130  -9.987
  664   2HG1  VAL  89          2HG1      VAL  89 -11.568  -7.874 -10.096
  665   3HG1  VAL  89          3HG1      VAL  89 -11.718  -6.911 -11.566
  666   1HG2  VAL  89          1HG2      VAL  89 -10.072  -6.797  -8.444
  667   2HG2  VAL  89          2HG2      VAL  89  -8.958  -5.551  -9.002
  668   3HG2  VAL  89          3HG2      VAL  89  -8.463  -7.242  -9.012
  669    H    ALA  90           H        ALA  90  -8.124  -6.863 -13.399
  670    HA   ALA  90           HA       ALA  90 -10.358  -7.002 -15.122
  671   1HB   ALA  90          1HB       ALA  90  -7.439  -6.737 -15.835
  672   2HB   ALA  90          2HB       ALA  90  -8.529  -5.407 -15.443
  673   3HB   ALA  90          3HB       ALA  90  -8.805  -6.376 -16.892
  674    H    LEU  91           H        LEU  91  -7.314  -8.855 -15.208
  675    HA   LEU  91           HA       LEU  91  -8.543 -10.842 -16.936
  676   1HB   LEU  91          2HB       LEU  91  -6.300 -10.145 -17.470
  677   2HB   LEU  91          1HB       LEU  91  -5.747 -10.531 -15.852
  678    HG   LEU  91           HG       LEU  91  -6.199 -12.929 -16.302
  679   1HD1  LEU  91          1HD1      LEU  91  -7.177 -11.786 -18.858
  680   2HD1  LEU  91          2HD1      LEU  91  -7.772 -13.162 -17.928
  681   3HD1  LEU  91          3HD1      LEU  91  -6.322 -13.328 -18.918
  682   1HD2  LEU  91          1HD2      LEU  91  -3.962 -12.290 -16.568
  683   2HD2  LEU  91          2HD2      LEU  91  -4.301 -11.401 -18.054
  684   3HD2  LEU  91          3HD2      LEU  91  -4.354 -13.164 -18.049
  685    H    TYR  92           H        TYR  92  -8.170 -10.337 -13.617
  686    HA   TYR  92           HA       TYR  92  -8.645 -11.601 -11.793
  687   1HB   TYR  92          2HB       TYR  92 -10.235 -12.686 -13.844
  688   2HB   TYR  92          1HB       TYR  92  -9.508 -14.066 -13.027
  689    HD1  TYR  92           1HD      TYR  92  -9.365 -13.018 -10.240
  690    HD2  TYR  92           2HD      TYR  92 -12.464 -12.767 -13.146
  691    HE1  TYR  92           1HE      TYR  92 -11.029 -12.828  -8.442
  692    HE2  TYR  92           2HE      TYR  92 -14.136 -12.576 -11.354
  693    HH   TYR  92           HH       TYR  92 -13.340 -11.909  -8.159
  694    H    GLN  93           H        GLN  93  -6.387 -11.716 -11.384
  695    HA   GLN  93           HA       GLN  93  -5.420 -14.308 -10.931
  696   1HB   GLN  93          2HB       GLN  93  -5.096 -14.312 -13.379
  697   2HB   GLN  93          1HB       GLN  93  -4.081 -12.884 -13.238
  698   1HG   GLN  93          2HG       GLN  93  -2.597 -14.267 -11.718
  699   2HG   GLN  93          1HG       GLN  93  -3.519 -15.665 -12.267
  700   1HE2  GLN  93          1HE2      GLN  93  -0.945 -15.794 -12.748
  701   2HE2  GLN  93          2HE2      GLN  93  -0.574 -15.489 -14.407
  702    H    CYS  94           H        CYS  94  -3.903 -14.228  -9.375
  703    HA   CYS  94           HA       CYS  94  -3.219 -11.759  -8.194
  704   1HB   CYS  94          2HB       CYS  94  -3.352 -14.142  -7.152
  705   2HB   CYS  94          1HB       CYS  94  -1.677 -14.283  -7.675
  706    HG   CYS  94           HG       CYS  94  -1.665 -13.411  -5.244
  707    H    GLN  95           H        GLN  95  -2.303 -10.652 -10.057
  708    HA   GLN  95           HA       GLN  95   0.061 -11.473 -11.340
  709   1HB   GLN  95          2HB       GLN  95  -1.473  -8.947 -11.101
  710   2HB   GLN  95          1HB       GLN  95   0.212  -8.795 -11.578
  711   1HG   GLN  95          2HG       GLN  95  -1.239  -8.899 -13.515
  712   2HG   GLN  95          1HG       GLN  95  -0.167 -10.298 -13.453
  713   1HE2  GLN  95          1HE2      GLN  95  -3.321  -9.259 -13.806
  714   2HE2  GLN  95          2HE2      GLN  95  -4.125 -10.774 -13.603
  715    H    GLU  96           H        GLU  96   2.140 -10.156 -11.213
  716    HA   GLU  96           HA       GLU  96   3.092 -10.294  -8.489
  717   1HB   GLU  96          2HB       GLU  96   5.303  -9.872  -9.466
  718   2HB   GLU  96          1HB       GLU  96   4.474 -11.182 -10.296
  719   1HG   GLU  96          2HG       GLU  96   3.727  -9.033 -11.785
  720   2HG   GLU  96          1HG       GLU  96   5.357  -8.579 -11.290
  721    H    LEU  97           H        LEU  97   3.833  -8.621  -7.238
  722    HA   LEU  97           HA       LEU  97   2.739  -6.023  -7.824
  723   1HB   LEU  97          2HB       LEU  97   4.186  -7.239  -5.500
  724   2HB   LEU  97          1HB       LEU  97   3.969  -5.501  -5.589
  725    HG   LEU  97           HG       LEU  97   1.432  -6.249  -6.000
  726   1HD1  LEU  97          1HD1      LEU  97   2.459  -8.686  -5.613
  727   2HD1  LEU  97          2HD1      LEU  97   0.817  -8.247  -5.141
  728   3HD1  LEU  97          3HD1      LEU  97   2.109  -8.253  -3.939
  729   1HD2  LEU  97          1HD2      LEU  97   2.260  -6.342  -3.164
  730   2HD2  LEU  97          2HD2      LEU  97   1.038  -5.351  -3.960
  731   3HD2  LEU  97          3HD2      LEU  97   2.742  -4.919  -4.087
  732    H    ASP  98           H        ASP  98   5.861  -7.556  -7.945
  733    HA   ASP  98           HA       ASP  98   7.572  -5.379  -7.872
  734   1HB   ASP  98          2HB       ASP  98   7.671  -8.099  -9.034
  735   2HB   ASP  98          1HB       ASP  98   8.812  -6.938  -9.705
  736    H    THR  99           H        THR  99   5.454  -6.452 -10.428
  737    HA   THR  99           HA       THR  99   6.635  -4.822 -12.467
  738    HB   THR  99           HB       THR  99   4.548  -5.383 -13.739
  739    HG1  THR  99           1HG      THR  99   3.929  -7.028 -11.523
  740   1HG2  THR  99          1HG2      THR  99   4.906  -7.979 -13.479
  741   2HG2  THR  99          2HG2      THR  99   6.337  -7.447 -12.596
  742   3HG2  THR  99          3HG2      THR  99   6.097  -6.950 -14.271
  743    H    TYR 100           H        TYR 100   4.599  -4.165  -9.836
  744    HA   TYR 100           HA       TYR 100   4.035  -1.511 -10.934
  745   1HB   TYR 100          2HB       TYR 100   1.928  -3.009  -9.385
  746   2HB   TYR 100          1HB       TYR 100   1.749  -1.531 -10.324
  747    HD1  TYR 100           1HD      TYR 100   1.198  -4.989 -10.317
  748    HD2  TYR 100           2HD      TYR 100   2.324  -1.803 -12.900
  749    HE1  TYR 100           1HE      TYR 100   0.484  -6.319 -12.259
  750    HE2  TYR 100           2HE      TYR 100   1.612  -3.122 -14.849
  751    HH   TYR 100           HH       TYR 100  -0.278  -5.275 -15.024
  752    H    LEU 101           H        LEU 101   5.946  -2.607  -8.971
  753    HA   LEU 101           HA       LEU 101   4.998  -1.500  -6.443
  754   1HB   LEU 101          2HB       LEU 101   6.769  -3.576  -7.165
  755   2HB   LEU 101          1HB       LEU 101   7.742  -2.349  -6.381
  756    HG   LEU 101           HG       LEU 101   5.242  -3.065  -4.985
  757   1HD1  LEU 101          1HD1      LEU 101   6.197  -5.104  -4.032
  758   2HD1  LEU 101          2HD1      LEU 101   7.560  -4.985  -5.146
  759   3HD1  LEU 101          3HD1      LEU 101   5.934  -5.261  -5.769
  760   1HD2  LEU 101          1HD2      LEU 101   6.814  -3.003  -3.049
  761   2HD2  LEU 101          2HD2      LEU 101   6.737  -1.502  -3.971
  762   3HD2  LEU 101          3HD2      LEU 101   8.106  -2.594  -4.179
  763    H    ILE 102           H        ILE 102   5.116   0.653  -6.339
  764    HA   ILE 102           HA       ILE 102   5.950   2.769  -6.347
  765    HB   ILE 102           HB       ILE 102   8.680   1.490  -6.434
  766   1HG1  ILE 102          2HG1      ILE 102   7.109   2.201  -3.955
  767   2HG1  ILE 102          1HG1      ILE 102   7.124   0.578  -4.640
  768   1HG2  ILE 102          1HG2      ILE 102   7.900   4.043  -5.068
  769   2HG2  ILE 102          2HG2      ILE 102   8.355   4.006  -6.772
  770   3HG2  ILE 102          3HG2      ILE 102   9.505   3.485  -5.540
  771   1HD1  ILE 102          1HD1      ILE 102   8.736   1.158  -2.717
  772   2HD1  ILE 102          2HD1      ILE 102   9.687   1.953  -3.971
  773   3HD1  ILE 102          3HD1      ILE 102   9.337   0.229  -4.090
  774    HA   PRO 103           HA       PRO 103   6.367   3.085 -10.839
  775   1HB   PRO 103          2HB       PRO 103   5.689   5.744 -10.930
  776   2HB   PRO 103          1HB       PRO 103   4.523   4.418 -10.934
  777   1HG   PRO 103          2HG       PRO 103   5.395   6.171  -8.685
  778   2HG   PRO 103          1HG       PRO 103   3.788   5.521  -9.047
  779   1HD   PRO 103          2HD       PRO 103   5.403   4.488  -7.127
  780   2HD   PRO 103          1HD       PRO 103   4.240   3.505  -8.038
  781    H    GLN 104           H        GLN 104   7.133   6.240  -9.452
  782    HA   GLN 104           HA       GLN 104   9.633   6.287 -10.897
  783   1HB   GLN 104          2HB       GLN 104   7.805   8.219 -10.045
  784   2HB   GLN 104          1HB       GLN 104   9.237   8.505  -9.066
  785   1HG   GLN 104          2HG       GLN 104  10.083   8.085 -11.736
  786   2HG   GLN 104          1HG       GLN 104   8.748   9.235 -11.761
  787   1HE2  GLN 104          1HE2      GLN 104  11.686   9.507 -12.219
  788   2HE2  GLN 104          2HE2      GLN 104  12.180  10.787 -11.169
  789    H    ILE 105           H        ILE 105  11.438   5.465 -10.093
  790    HA   ILE 105           HA       ILE 105  11.736   5.251  -7.183
  791    HB   ILE 105           HB       ILE 105  11.977   3.168  -8.473
  792   1HG1  ILE 105          2HG1      ILE 105  14.563   2.872  -7.694
  793   2HG1  ILE 105          1HG1      ILE 105  14.114   4.308  -6.780
  794   1HG2  ILE 105          1HG2      ILE 105  14.386   4.494  -9.709
  795   2HG2  ILE 105          2HG2      ILE 105  12.866   4.150 -10.534
  796   3HG2  ILE 105          3HG2      ILE 105  13.872   2.824  -9.953
  797   1HD1  ILE 105          1HD1      ILE 105  13.451   2.795  -5.264
  798   2HD1  ILE 105          2HD1      ILE 105  13.257   1.519  -6.465
  799   3HD1  ILE 105          3HD1      ILE 105  11.997   2.735  -6.260
  800    HA   PRO 106           HA       PRO 106  14.690   8.590  -7.388
  801   1HB   PRO 106          2HB       PRO 106  15.626   8.420  -4.853
  802   2HB   PRO 106          1HB       PRO 106  14.039   9.096  -5.239
  803   1HG   PRO 106          2HG       PRO 106  14.743   6.358  -4.254
  804   2HG   PRO 106          1HG       PRO 106  13.421   7.425  -3.743
  805   1HD   PRO 106          2HD       PRO 106  13.056   5.360  -5.463
  806   2HD   PRO 106          1HD       PRO 106  12.098   6.853  -5.539
  807    H    HIS 107           H        HIS 107  16.963   8.916  -7.366
  808    HA   HIS 107           HA       HIS 107  18.572   6.455  -7.215
  809   1HB   HIS 107          2HB       HIS 107  17.969   7.537  -9.577
  810   2HB   HIS 107          1HB       HIS 107  19.342   8.562  -9.174
  811    HD1  HIS 107           1HD      HIS 107  20.804   7.543 -11.032
  812    HD2  HIS 107           2HD      HIS 107  19.466   4.778  -8.234
  813    HE1  HIS 107           1HE      HIS 107  22.150   5.460 -11.448
  814    HE2  HIS 107           2HE      HIS 107  21.385   3.830  -9.686
  815    H    SER 108           H        SER 108  20.970   6.977  -7.110
  816    HA   SER 108           HA       SER 108  21.455   9.453  -5.600
  817   1HB   SER 108          2HB       SER 108  22.952   8.140  -4.076
  818   2HB   SER 108          1HB       SER 108  21.245   7.718  -3.933
  819    HG   SER 108           HG       SER 108  23.147   6.300  -5.494
  820    H    HIS 109           H        HIS 109  21.999   8.827  -8.363
  821    HA   HIS 109           HA       HIS 109  24.890   8.444  -8.459
  822   1HB   HIS 109          2HB       HIS 109  23.066   7.452 -10.097
  823   2HB   HIS 109          1HB       HIS 109  23.255   9.008 -10.897
  824    HD1  HIS 109           1HD      HIS 109  24.497   8.281 -12.955
  825    HD2  HIS 109           2HD      HIS 109  26.259   6.903  -9.452
  826    HE1  HIS 109           1HE      HIS 109  26.692   7.274 -13.657
  827    HE2  HIS 109           2HE      HIS 109  27.702   6.372 -11.532
  828    H    TYR 110           H        TYR 110  26.270   9.939  -9.581
  829    HA   TYR 110           HA       TYR 110  25.594  12.684  -8.981
  830   1HB   TYR 110          2HB       TYR 110  28.093  11.348 -10.022
  831   2HB   TYR 110          1HB       TYR 110  27.953  13.095  -9.847
  832    HD1  TYR 110           1HD      TYR 110  28.386  14.118  -7.787
  833    HD2  TYR 110           2HD      TYR 110  27.742   9.915  -7.931
  834    HE1  TYR 110           1HE      TYR 110  29.057  13.940  -5.427
  835    HE2  TYR 110           2HE      TYR 110  28.411   9.725  -5.573
  836    HH   TYR 110           HH       TYR 110  28.574  11.095  -3.588
  Start of MODEL   15
    1   1H    GLY   1          1HT       GLY   1 -19.202 -11.102  -9.672
    2   2H    GLY   1          2HT       GLY   1 -18.052 -11.198  -8.436
    3   3H    GLY   1          3HT       GLY   1 -18.161  -9.800  -9.381
    4   1HA   GLY   1          1HA       GLY   1 -19.314  -9.049  -7.604
    5   2HA   GLY   1          2HA       GLY   1 -20.624  -9.814  -8.492
    6    H    SER   2           H        SER   2 -20.027 -12.499  -8.005
    7    HA   SER   2           HA       SER   2 -20.648 -12.650  -5.137
    8   1HB   SER   2          2HB       SER   2 -21.636 -14.867  -5.681
    9   2HB   SER   2          1HB       SER   2 -22.395 -13.548  -6.571
   10    HG   SER   2           HG       SER   2 -21.436 -14.207  -8.403
   11    H    GLN   3           H        GLN   3 -19.696 -14.267  -3.835
   12    HA   GLN   3           HA       GLN   3 -16.947 -14.784  -4.471
   13   1HB   GLN   3          2HB       GLN   3 -18.496 -15.916  -2.143
   14   2HB   GLN   3          1HB       GLN   3 -16.761 -15.654  -2.260
   15   1HG   GLN   3          2HG       GLN   3 -17.085 -13.260  -2.228
   16   2HG   GLN   3          1HG       GLN   3 -18.834 -13.473  -2.223
   17   1HE2  GLN   3          1HE2      GLN   3 -16.197 -15.008  -0.415
   18   2HE2  GLN   3          2HE2      GLN   3 -16.836 -14.656   1.152
   19    H    ASP   4           H        ASP   4 -16.537 -16.286  -5.975
   20    HA   ASP   4           HA       ASP   4 -17.467 -19.004  -5.471
   21   1HB   ASP   4          2HB       ASP   4 -18.349 -17.340  -7.696
   22   2HB   ASP   4          1HB       ASP   4 -17.616 -18.849  -8.235
   23    H    ARG   5           H        ARG   5 -15.430 -16.888  -7.439
   24    HA   ARG   5           HA       ARG   5 -13.264 -18.833  -7.198
   25   1HB   ARG   5          2HB       ARG   5 -14.519 -19.123  -9.405
   26   2HB   ARG   5          1HB       ARG   5 -13.879 -17.549  -9.854
   27   1HG   ARG   5          2HG       ARG   5 -11.581 -18.570  -9.289
   28   2HG   ARG   5          1HG       ARG   5 -12.418 -20.118  -9.408
   29   1HD   ARG   5          2HD       ARG   5 -13.263 -19.240 -11.677
   30   2HD   ARG   5          1HD       ARG   5 -11.974 -18.046 -11.530
   31    HE   ARG   5           HE       ARG   5 -11.690 -20.841 -12.130
   32   1HH1  ARG   5          1HH1      ARG   5 -10.097 -18.022 -10.828
   33   2HH1  ARG   5          2HH1      ARG   5  -8.504 -18.612 -11.164
   34   1HH2  ARG   5          1HH2      ARG   5  -9.596 -21.619 -12.572
   35   2HH2  ARG   5          2HH2      ARG   5  -8.219 -20.655 -12.154
   36    H    LYS   6           H        LYS   6 -12.401 -17.314  -5.710
   37    HA   LYS   6           HA       LYS   6 -11.720 -14.663  -6.671
   38   1HB   LYS   6          2HB       LYS   6 -10.730 -15.801  -4.077
   39   2HB   LYS   6          1HB       LYS   6 -11.117 -14.140  -4.479
   40   1HG   LYS   6          2HG       LYS   6 -13.320 -16.134  -4.478
   41   2HG   LYS   6          1HG       LYS   6 -12.680 -15.567  -2.935
   42   1HD   LYS   6          2HD       LYS   6 -12.973 -13.206  -3.967
   43   2HD   LYS   6          1HD       LYS   6 -14.058 -14.020  -5.096
   44   1HE   LYS   6          2HE       LYS   6 -15.624 -13.617  -3.541
   45   2HE   LYS   6          1HE       LYS   6 -14.923 -15.010  -2.719
   46   1HZ   LYS   6          1HZ       LYS   6 -13.970 -13.721  -1.151
   47   2HZ   LYS   6          2HZ       LYS   6 -15.221 -12.657  -1.558
   48   3HZ   LYS   6          3HZ       LYS   6 -13.676 -12.429  -2.205
   49    H    ILE   7           H        ILE   7  -9.538 -13.855  -6.721
   50    HA   ILE   7           HA       ILE   7  -7.631 -15.934  -7.533
   51    HB   ILE   7           HB       ILE   7  -6.355 -14.031  -8.546
   52   1HG1  ILE   7          2HG1      ILE   7  -8.592 -12.230  -8.761
   53   2HG1  ILE   7          1HG1      ILE   7  -8.200 -12.490  -7.066
   54   1HG2  ILE   7          1HG2      ILE   7  -8.959 -15.079  -9.400
   55   2HG2  ILE   7          2HG2      ILE   7  -7.409 -15.059 -10.241
   56   3HG2  ILE   7          3HG2      ILE   7  -8.430 -13.621 -10.240
   57   1HD1  ILE   7          1HD1      ILE   7  -6.807 -10.766  -7.473
   58   2HD1  ILE   7          2HD1      ILE   7  -6.654 -11.148  -9.188
   59   3HD1  ILE   7          3HD1      ILE   7  -5.742 -12.072  -7.994
   60    H    PHE   8           H        PHE   8  -8.187 -13.575  -5.087
   61    HA   PHE   8           HA       PHE   8  -5.394 -13.586  -4.236
   62   1HB   PHE   8          2HB       PHE   8  -7.820 -12.076  -3.256
   63   2HB   PHE   8          1HB       PHE   8  -6.257 -11.998  -2.466
   64    HD1  PHE   8           1HD      PHE   8  -4.680 -12.095  -5.165
   65    HD2  PHE   8           2HD      PHE   8  -7.912  -9.732  -3.722
   66    HE1  PHE   8           1HE      PHE   8  -4.014 -10.265  -6.668
   67    HE2  PHE   8           2HE      PHE   8  -7.252  -7.903  -5.222
   68    HZ   PHE   8           HZ       PHE   8  -5.303  -8.166  -6.697
   69    H    ARG   9           H        ARG   9  -8.600 -14.442  -2.973
   70    HA   ARG   9           HA       ARG   9  -9.237 -15.681  -1.153
   71   1HB   ARG   9          2HB       ARG   9  -8.638 -17.357  -2.889
   72   2HB   ARG   9          1HB       ARG   9  -7.031 -17.467  -2.187
   73   1HG   ARG   9          2HG       ARG   9  -9.138 -17.861  -0.225
   74   2HG   ARG   9          1HG       ARG   9  -9.201 -19.030  -1.544
   75   1HD   ARG   9          2HD       ARG   9  -6.486 -18.728  -0.769
   76   2HD   ARG   9          1HD       ARG   9  -7.446 -18.959   0.693
   77    HE   ARG   9           HE       ARG   9  -6.788 -20.935  -1.205
   78   1HH1  ARG   9          1HH1      ARG   9  -9.462 -19.857   0.762
   79   2HH1  ARG   9          2HH1      ARG   9 -10.186 -21.427   0.860
   80   1HH2  ARG   9          1HH2      ARG   9  -7.740 -23.001  -1.077
   81   2HH2  ARG   9          2HH2      ARG   9  -9.208 -23.212  -0.183
   82    H    GLY  10           H        GLY  10  -8.603 -14.326   0.551
   83   1HA   GLY  10          2HA       GLY  10  -7.660 -14.186   2.680
   84   2HA   GLY  10          1HA       GLY  10  -6.550 -15.475   2.243
   85    H    LEU  11           H        LEU  11  -7.250 -12.071   1.591
   86    HA   LEU  11           HA       LEU  11  -4.390 -11.498   1.718
   87   1HB   LEU  11          2HB       LEU  11  -5.848 -11.630  -0.703
   88   2HB   LEU  11          1HB       LEU  11  -5.522  -9.937  -0.397
   89    HG   LEU  11           HG       LEU  11  -3.223 -11.771  -0.090
   90   1HD1  LEU  11          1HD1      LEU  11  -4.378 -12.678  -2.075
   91   2HD1  LEU  11          2HD1      LEU  11  -2.817 -11.949  -2.456
   92   3HD1  LEU  11          3HD1      LEU  11  -4.309 -11.078  -2.811
   93   1HD2  LEU  11          1HD2      LEU  11  -3.165  -9.359  -1.783
   94   2HD2  LEU  11          2HD2      LEU  11  -2.026  -9.916  -0.557
   95   3HD2  LEU  11          3HD2      LEU  11  -3.515  -9.105  -0.075
   96    H    GLU  12           H        GLU  12  -3.949  -9.161   1.864
   97    HA   GLU  12           HA       GLU  12  -6.219  -7.559   2.792
   98   1HB   GLU  12          2HB       GLU  12  -3.778  -8.299   4.360
   99   2HB   GLU  12          1HB       GLU  12  -4.533  -6.736   4.628
  100   1HG   GLU  12          2HG       GLU  12  -6.671  -8.438   4.715
  101   2HG   GLU  12          1HG       GLU  12  -5.386  -9.397   5.449
  102    H    ILE  13           H        ILE  13  -6.218  -5.900   1.413
  103    HA   ILE  13           HA       ILE  13  -3.644  -4.579   0.847
  104    HB   ILE  13           HB       ILE  13  -5.950  -4.746  -1.087
  105   1HG1  ILE  13          2HG1      ILE  13  -3.524  -6.162  -1.853
  106   2HG1  ILE  13          1HG1      ILE  13  -4.237  -6.828  -0.388
  107   1HG2  ILE  13          1HG2      ILE  13  -3.112  -3.772  -1.351
  108   2HG2  ILE  13          2HG2      ILE  13  -4.590  -2.814  -1.462
  109   3HG2  ILE  13          3HG2      ILE  13  -4.214  -4.004  -2.709
  110   1HD1  ILE  13          1HD1      ILE  13  -5.193  -8.045  -2.127
  111   2HD1  ILE  13          2HD1      ILE  13  -5.435  -6.608  -3.121
  112   3HD1  ILE  13          3HD1      ILE  13  -6.430  -6.866  -1.687
  113    H    CYS  14           H        CYS  14  -3.589  -2.375   0.897
  114    HA   CYS  14           HA       CYS  14  -6.105  -0.987   1.525
  115   1HB   CYS  14          2HB       CYS  14  -4.911   0.433   3.108
  116   2HB   CYS  14          1HB       CYS  14  -4.756  -1.257   3.562
  117    HG   CYS  14           HG       CYS  14  -2.473   0.588   2.725
  118    H    CYS  15           H        CYS  15  -6.333   1.112   0.777
  119    HA   CYS  15           HA       CYS  15  -4.464   1.840  -1.370
  120   1HB   CYS  15          2HB       CYS  15  -7.266   2.896  -0.980
  121   2HB   CYS  15          1HB       CYS  15  -6.266   3.002  -2.424
  122    HG   CYS  15           HG       CYS  15  -7.208   0.197  -1.526
  123    H    TYR  16           H        TYR  16  -3.039   3.345  -0.811
  124    HA   TYR  16           HA       TYR  16  -3.697   5.248   1.303
  125   1HB   TYR  16          2HB       TYR  16  -1.389   3.871   0.713
  126   2HB   TYR  16          1HB       TYR  16  -1.046   5.471   0.064
  127    HD1  TYR  16           1HD      TYR  16  -1.262   7.468   1.608
  128    HD2  TYR  16           2HD      TYR  16  -1.286   3.457   3.027
  129    HE1  TYR  16           1HE      TYR  16  -0.714   8.270   3.867
  130    HE2  TYR  16           2HE      TYR  16  -0.738   4.248   5.290
  131    HH   TYR  16           HH       TYR  16  -0.961   7.488   6.210
  132    H    GLY  17           H        GLY  17  -4.456   7.193   0.846
  133   1HA   GLY  17          2HA       GLY  17  -4.478   9.299  -0.162
  134   2HA   GLY  17          1HA       GLY  17  -3.413   8.686  -1.417
  135    HA   PRO  18           HA       PRO  18  -7.876   8.789  -2.937
  136   1HB   PRO  18          2HB       PRO  18  -7.987  11.117  -4.244
  137   2HB   PRO  18          1HB       PRO  18  -8.238  11.035  -2.496
  138   1HG   PRO  18          2HG       PRO  18  -5.799  11.850  -4.023
  139   2HG   PRO  18          1HG       PRO  18  -6.506  12.581  -2.572
  140   1HD   PRO  18          2HD       PRO  18  -4.369  10.839  -2.557
  141   2HD   PRO  18          1HD       PRO  18  -5.452  11.110  -1.179
  142    H    PHE  19           H        PHE  19  -4.784   8.724  -4.148
  143    HA   PHE  19           HA       PHE  19  -3.857   8.021  -6.094
  144   1HB   PHE  19          2HB       PHE  19  -6.696   7.113  -6.539
  145   2HB   PHE  19          1HB       PHE  19  -5.421   6.816  -7.717
  146    HD1  PHE  19           1HD      PHE  19  -5.753   6.547  -4.011
  147    HD2  PHE  19           2HD      PHE  19  -4.602   4.675  -7.653
  148    HE1  PHE  19           1HE      PHE  19  -5.077   4.542  -2.759
  149    HE2  PHE  19           2HE      PHE  19  -3.925   2.664  -6.407
  150    HZ   PHE  19           HZ       PHE  19  -4.162   2.594  -3.958
  151    H    THR  20           H        THR  20  -6.971   8.877  -7.538
  152    HA   THR  20           HA       THR  20  -6.228  11.465  -8.378
  153    HB   THR  20           HB       THR  20  -4.651  10.552  -9.856
  154    HG1  THR  20           1HG      THR  20  -6.211  11.960 -10.874
  155   1HG2  THR  20          1HG2      THR  20  -4.804   8.633 -11.123
  156   2HG2  THR  20          2HG2      THR  20  -6.566   8.604 -11.055
  157   3HG2  THR  20          3HG2      THR  20  -5.621   8.174  -9.629
  158    H    ASN  21           H        ASN  21  -7.986   8.626  -9.652
  159    HA   ASN  21           HA       ASN  21 -10.356  10.357  -9.920
  160   1HB   ASN  21          2HB       ASN  21  -9.254   8.189 -11.636
  161   2HB   ASN  21          1HB       ASN  21 -11.006   8.326 -11.527
  162   1HD2  ASN  21          1HD2      ASN  21 -11.223   8.955 -13.655
  163   2HD2  ASN  21          2HD2      ASN  21 -10.739  10.515 -14.218
  164    H    MET  22           H        MET  22  -9.202   7.161  -8.959
  165    HA   MET  22           HA       MET  22 -11.668   6.061  -8.221
  166   1HB   MET  22          2HB       MET  22  -8.820   5.511  -7.527
  167   2HB   MET  22          1HB       MET  22 -10.073   4.757  -6.551
  168   1HG   MET  22          2HG       MET  22 -10.491   3.238  -8.108
  169   2HG   MET  22          1HG       MET  22 -10.633   4.466  -9.363
  170   1HE   MET  22          1HE       MET  22  -9.827   1.633  -9.441
  171   2HE   MET  22          2HE       MET  22  -8.117   1.205  -9.463
  172   3HE   MET  22          3HE       MET  22  -8.875   1.886 -10.903
  173    HA   PRO  23           HA       PRO  23 -12.497   8.384  -4.527
  174   1HB   PRO  23          2HB       PRO  23 -14.625   7.023  -3.635
  175   2HB   PRO  23          1HB       PRO  23 -14.703   8.005  -5.102
  176   1HG   PRO  23          2HG       PRO  23 -14.416   5.044  -4.816
  177   2HG   PRO  23          1HG       PRO  23 -15.394   5.968  -5.969
  178   1HD   PRO  23          2HD       PRO  23 -12.934   4.863  -6.543
  179   2HD   PRO  23          1HD       PRO  23 -13.644   6.238  -7.410
  180    H    THR  24           H        THR  24 -10.990   5.475  -4.584
  181    HA   THR  24           HA       THR  24  -9.650   4.497  -3.002
  182    HB   THR  24           HB       THR  24 -11.095   5.752  -0.710
  183    HG1  THR  24           1HG      THR  24 -10.759   7.641  -1.544
  184   1HG2  THR  24          1HG2      THR  24  -8.218   5.971  -0.770
  185   2HG2  THR  24          2HG2      THR  24  -8.754   4.299  -0.950
  186   3HG2  THR  24          3HG2      THR  24  -9.274   5.247   0.444
  187    H    ASP  25           H        ASP  25 -13.124   4.689  -2.525
  188    HA   ASP  25           HA       ASP  25 -13.202   2.214  -1.024
  189   1HB   ASP  25          2HB       ASP  25 -15.414   3.958  -2.131
  190   2HB   ASP  25          1HB       ASP  25 -15.672   2.527  -1.138
  191    H    GLN  26           H        GLN  26 -13.581   3.345  -4.272
  192    HA   GLN  26           HA       GLN  26 -14.859   1.028  -5.321
  193   1HB   GLN  26          2HB       GLN  26 -14.398   3.550  -6.239
  194   2HB   GLN  26          1HB       GLN  26 -13.187   2.647  -7.133
  195   1HG   GLN  26          2HG       GLN  26 -15.064   1.083  -7.808
  196   2HG   GLN  26          1HG       GLN  26 -16.163   2.299  -7.156
  197   1HE2  GLN  26          1HE2      GLN  26 -14.800   1.207  -9.906
  198   2HE2  GLN  26          2HE2      GLN  26 -14.854   2.644 -10.864
  199    H    LEU  27           H        LEU  27 -11.554   2.019  -4.778
  200    HA   LEU  27           HA       LEU  27 -10.343  -0.009  -6.372
  201   1HB   LEU  27          2HB       LEU  27  -9.245   2.128  -5.636
  202   2HB   LEU  27          1HB       LEU  27  -9.146   1.456  -4.020
  203    HG   LEU  27           HG       LEU  27  -7.639  -0.269  -4.755
  204   1HD1  LEU  27          1HD1      LEU  27  -8.439  -0.871  -6.884
  205   2HD1  LEU  27          2HD1      LEU  27  -6.828  -0.206  -7.158
  206   3HD1  LEU  27          3HD1      LEU  27  -8.255   0.770  -7.505
  207   1HD2  LEU  27          1HD2      LEU  27  -5.810   1.047  -4.855
  208   2HD2  LEU  27          2HD2      LEU  27  -6.981   2.330  -4.554
  209   3HD2  LEU  27          3HD2      LEU  27  -6.436   2.002  -6.198
  210    H    GLU  28           H        GLU  28 -10.895   0.340  -2.865
  211    HA   GLU  28           HA       GLU  28  -9.830  -2.148  -2.127
  212   1HB   GLU  28          2HB       GLU  28 -12.048  -0.594  -0.783
  213   2HB   GLU  28          1HB       GLU  28 -11.135  -1.913  -0.066
  214   1HG   GLU  28          2HG       GLU  28  -9.096  -0.352  -0.699
  215   2HG   GLU  28          1HG       GLU  28 -10.338   0.889  -0.565
  216    H    TRP  29           H        TRP  29 -12.884  -1.278  -3.539
  217    HA   TRP  29           HA       TRP  29 -14.328  -3.609  -2.853
  218   1HB   TRP  29          2HB       TRP  29 -15.678  -1.881  -3.664
  219   2HB   TRP  29          1HB       TRP  29 -14.581  -1.513  -4.989
  220    HD1  TRP  29           HD       TRP  29 -16.891  -4.459  -3.975
  221    HE1  TRP  29           1HE      TRP  29 -17.987  -5.382  -6.114
  222    HE3  TRP  29           3HE      TRP  29 -14.611  -1.446  -7.410
  223    HZ2  TRP  29           2HZ      TRP  29 -17.892  -4.895  -8.894
  224    HZ3  TRP  29           3HZ      TRP  29 -15.164  -1.738  -9.789
  225    HH2  TRP  29           HH       TRP  29 -16.769  -3.429 -10.515
  226    H    MET  30           H        MET  30 -12.477  -2.717  -5.718
  227    HA   MET  30           HA       MET  30 -12.780  -4.990  -7.242
  228   1HB   MET  30          2HB       MET  30 -10.272  -3.324  -6.963
  229   2HB   MET  30          1HB       MET  30 -10.652  -4.398  -8.301
  230   1HG   MET  30          2HG       MET  30 -12.231  -2.986  -9.175
  231   2HG   MET  30          1HG       MET  30 -12.545  -2.206  -7.626
  232   1HE   MET  30          1HE       MET  30 -11.783   0.623  -9.638
  233   2HE   MET  30          2HE       MET  30 -12.588  -0.888 -10.059
  234   3HE   MET  30          3HE       MET  30 -11.111  -0.412 -10.898
  235    H    VAL  31           H        VAL  31 -10.222  -4.369  -4.816
  236    HA   VAL  31           HA       VAL  31  -8.954  -6.855  -5.067
  237    HB   VAL  31           HB       VAL  31  -8.051  -6.475  -2.800
  238   1HG1  VAL  31          1HG1      VAL  31  -7.533  -5.057  -5.091
  239   2HG1  VAL  31          2HG1      VAL  31  -6.539  -5.051  -3.634
  240   3HG1  VAL  31          3HG1      VAL  31  -7.743  -3.785  -3.885
  241   1HG2  VAL  31          1HG2      VAL  31  -8.584  -4.450  -1.578
  242   2HG2  VAL  31          2HG2      VAL  31 -10.020  -5.451  -1.781
  243   3HG2  VAL  31          3HG2      VAL  31  -9.789  -4.024  -2.790
  244    H    GLN  32           H        GLN  32 -11.556  -5.802  -2.904
  245    HA   GLN  32           HA       GLN  32 -11.840  -8.173  -1.446
  246   1HB   GLN  32          2HB       GLN  32 -13.212  -5.704  -1.673
  247   2HB   GLN  32          1HB       GLN  32 -14.412  -6.972  -1.877
  248   1HG   GLN  32          2HG       GLN  32 -12.492  -6.757   0.431
  249   2HG   GLN  32          1HG       GLN  32 -14.178  -6.241   0.454
  250   1HE2  GLN  32          1HE2      GLN  32 -12.966  -8.172   2.164
  251   2HE2  GLN  32          2HE2      GLN  32 -13.761  -9.681   1.885
  252    H    LEU  33           H        LEU  33 -13.022  -7.206  -4.582
  253    HA   LEU  33           HA       LEU  33 -14.816  -9.378  -4.974
  254   1HB   LEU  33          2HB       LEU  33 -14.814  -7.173  -6.208
  255   2HB   LEU  33          1HB       LEU  33 -13.422  -7.756  -7.100
  256    HG   LEU  33           HG       LEU  33 -14.720  -9.527  -8.094
  257   1HD1  LEU  33          1HD1      LEU  33 -17.327  -9.240  -7.559
  258   2HD1  LEU  33          2HD1      LEU  33 -16.658  -8.778  -5.994
  259   3HD1  LEU  33          3HD1      LEU  33 -16.280 -10.357  -6.683
  260   1HD2  LEU  33          1HD2      LEU  33 -16.645  -7.316  -8.410
  261   2HD2  LEU  33          2HD2      LEU  33 -15.740  -8.220  -9.625
  262   3HD2  LEU  33          3HD2      LEU  33 -14.954  -6.925  -8.722
  263    H    CYS  34           H        CYS  34 -11.405  -9.038  -5.168
  264    HA   CYS  34           HA       CYS  34 -11.075 -11.386  -6.859
  265   1HB   CYS  34          2HB       CYS  34  -9.316  -9.197  -5.893
  266   2HB   CYS  34          1HB       CYS  34  -8.556 -10.751  -6.210
  267    HG   CYS  34           HG       CYS  34 -10.231  -9.610  -8.517
  268    H    GLY  35           H        GLY  35 -11.611 -10.867  -3.628
  269   1HA   GLY  35          2HA       GLY  35 -11.726 -12.872  -2.243
  270   2HA   GLY  35          1HA       GLY  35 -10.188 -13.357  -2.937
  271    H    ALA  36           H        ALA  36  -9.331 -10.430  -2.661
  272    HA   ALA  36           HA       ALA  36  -8.011 -10.741  -0.163
  273   1HB   ALA  36          1HB       ALA  36  -8.192  -8.437  -2.089
  274   2HB   ALA  36          2HB       ALA  36  -6.856  -9.566  -1.864
  275   3HB   ALA  36          3HB       ALA  36  -7.234  -8.386  -0.609
  276    H    SER  37           H        SER  37  -7.988  -8.755   1.374
  277    HA   SER  37           HA       SER  37 -10.776  -8.017   1.980
  278   1HB   SER  37          2HB       SER  37  -8.946  -9.504   3.566
  279   2HB   SER  37          1HB       SER  37  -9.150  -7.933   4.341
  280    HG   SER  37           HG       SER  37 -10.952  -8.729   5.054
  281    H    VAL  38           H        VAL  38 -11.188  -5.902   2.379
  282    HA   VAL  38           HA       VAL  38  -9.189  -3.994   1.687
  283    HB   VAL  38           HB       VAL  38 -10.839  -2.353   1.797
  284   1HG1  VAL  38          1HG1      VAL  38 -11.303  -4.261   0.194
  285   2HG1  VAL  38          2HG1      VAL  38 -12.665  -3.206   0.576
  286   3HG1  VAL  38          3HG1      VAL  38 -12.536  -4.791   1.338
  287   1HG2  VAL  38          1HG2      VAL  38 -12.054  -4.040   3.936
  288   2HG2  VAL  38          2HG2      VAL  38 -13.079  -2.931   3.024
  289   3HG2  VAL  38          3HG2      VAL  38 -11.697  -2.312   3.927
  290    H    VAL  39           H        VAL  39  -7.728  -3.063   2.948
  291    HA   VAL  39           HA       VAL  39  -8.019  -3.326   5.856
  292    HB   VAL  39           HB       VAL  39  -5.519  -2.579   4.349
  293   1HG1  VAL  39          1HG1      VAL  39  -5.575  -3.941   6.991
  294   2HG1  VAL  39          2HG1      VAL  39  -5.912  -2.212   6.915
  295   3HG1  VAL  39          3HG1      VAL  39  -4.376  -2.838   6.315
  296   1HG2  VAL  39          1HG2      VAL  39  -6.517  -4.831   3.710
  297   2HG2  VAL  39          2HG2      VAL  39  -6.152  -5.332   5.361
  298   3HG2  VAL  39          3HG2      VAL  39  -4.850  -4.827   4.285
  299    H    LYS  40           H        LYS  40  -8.548  -1.605   7.010
  300    HA   LYS  40           HA       LYS  40  -9.043   0.915   5.942
  301   1HB   LYS  40          2HB       LYS  40  -9.590  -0.311   8.307
  302   2HB   LYS  40          1HB       LYS  40  -8.383   0.863   8.811
  303   1HG   LYS  40          2HG       LYS  40  -9.724   2.660   7.832
  304   2HG   LYS  40          1HG       LYS  40 -10.939   1.478   7.342
  305   1HD   LYS  40          2HD       LYS  40 -10.172   1.418  10.188
  306   2HD   LYS  40          1HD       LYS  40 -11.026   2.868   9.658
  307   1HE   LYS  40          2HE       LYS  40 -12.877   1.660  10.037
  308   2HE   LYS  40          1HE       LYS  40 -12.507   0.911   8.485
  309   1HZ   LYS  40          1HZ       LYS  40 -12.807  -0.411  10.818
  310   2HZ   LYS  40          2HZ       LYS  40 -11.125  -0.286  10.707
  311   3HZ   LYS  40          3HZ       LYS  40 -12.002  -1.015   9.459
  312    H    GLU  41           H        GLU  41  -6.282  -0.155   7.898
  313    HA   GLU  41           HA       GLU  41  -4.698   1.999   6.704
  314   1HB   GLU  41          2HB       GLU  41  -5.057   1.502   9.652
  315   2HB   GLU  41          1HB       GLU  41  -3.667   2.367   9.014
  316   1HG   GLU  41          2HG       GLU  41  -6.288   3.322   8.086
  317   2HG   GLU  41          1HG       GLU  41  -5.954   3.544   9.802
  318    H    LEU  42           H        LEU  42  -2.313   1.737   7.578
  319    HA   LEU  42           HA       LEU  42  -1.394  -0.758   6.609
  320   1HB   LEU  42          2HB       LEU  42   0.207   1.219   8.224
  321   2HB   LEU  42          1HB       LEU  42   0.810   0.046   7.068
  322    HG   LEU  42           HG       LEU  42  -0.994   2.314   6.252
  323   1HD1  LEU  42          1HD1      LEU  42   0.713   3.637   6.912
  324   2HD1  LEU  42          2HD1      LEU  42   1.408   3.114   5.379
  325   3HD1  LEU  42          3HD1      LEU  42   1.890   2.325   6.880
  326   1HD2  LEU  42          1HD2      LEU  42   0.614   1.726   4.152
  327   2HD2  LEU  42          2HD2      LEU  42  -0.986   1.032   4.408
  328   3HD2  LEU  42          3HD2      LEU  42   0.451   0.140   4.905
  329    H    SER  43           H        SER  43  -1.468   0.659   9.868
  330    HA   SER  43           HA       SER  43  -0.276  -1.475  11.224
  331   1HB   SER  43          2HB       SER  43  -2.216   0.662  12.092
  332   2HB   SER  43          1HB       SER  43  -1.620  -0.557  13.219
  333    HG   SER  43           HG       SER  43   0.173   0.514  13.345
  334    H    SER  44           H        SER  44  -3.410  -1.195   9.830
  335    HA   SER  44           HA       SER  44  -4.808  -3.031  11.457
  336   1HB   SER  44          2HB       SER  44  -5.301  -1.543   9.037
  337   2HB   SER  44          1HB       SER  44  -5.888  -3.195   8.862
  338    HG   SER  44           HG       SER  44  -6.530  -1.380  10.948
  339    H    PHE  45           H        PHE  45  -2.413  -3.465   9.025
  340    HA   PHE  45           HA       PHE  45  -3.018  -5.938   7.954
  341   1HB   PHE  45          2HB       PHE  45  -0.352  -4.714   8.662
  342   2HB   PHE  45          1HB       PHE  45  -0.499  -6.238   7.793
  343    HD1  PHE  45           1HD      PHE  45   0.533  -3.230   7.128
  344    HD2  PHE  45           2HD      PHE  45  -2.752  -5.687   5.993
  345    HE1  PHE  45           1HE      PHE  45   0.345  -1.994   5.010
  346    HE2  PHE  45           2HE      PHE  45  -2.945  -4.455   3.871
  347    HZ   PHE  45           HZ       PHE  45  -1.394  -2.606   3.380
  348    H    THR  46           H        THR  46  -3.030  -7.985   8.666
  349    HA   THR  46           HA       THR  46  -1.598  -8.728  11.079
  350    HB   THR  46           HB       THR  46  -3.694  -7.950  12.010
  351    HG1  THR  46           1HG      THR  46  -3.742 -10.780  11.897
  352   1HG2  THR  46          1HG2      THR  46  -5.827  -8.721  11.415
  353   2HG2  THR  46          2HG2      THR  46  -5.169  -9.978  10.367
  354   3HG2  THR  46          3HG2      THR  46  -5.040  -8.282   9.899
  355    H    LEU  47           H        LEU  47  -0.566 -10.524  10.544
  356    HA   LEU  47           HA       LEU  47  -1.649 -12.268   8.475
  357   1HB   LEU  47          2HB       LEU  47   0.882 -11.414   8.976
  358   2HB   LEU  47          1HB       LEU  47   0.903 -12.976   9.773
  359    HG   LEU  47           HG       LEU  47   0.068 -12.603   6.899
  360   1HD1  LEU  47          1HD1      LEU  47   2.343 -13.583   6.417
  361   2HD1  LEU  47          2HD1      LEU  47   2.769 -13.191   8.082
  362   3HD1  LEU  47          3HD1      LEU  47   2.325 -11.906   6.960
  363   1HD2  LEU  47          1HD2      LEU  47   0.867 -15.105   7.008
  364   2HD2  LEU  47          2HD2      LEU  47  -0.765 -14.649   7.500
  365   3HD2  LEU  47          3HD2      LEU  47   0.480 -14.922   8.719
  366    H    GLY  48           H        GLY  48  -3.153 -13.635   9.242
  367   1HA   GLY  48          2HA       GLY  48  -2.603 -15.026  11.781
  368   2HA   GLY  48          1HA       GLY  48  -4.193 -14.831  11.060
  369    H    THR  49           H        THR  49  -4.974 -16.416   9.800
  370    HA   THR  49           HA       THR  49  -3.404 -18.829   9.538
  371    HB   THR  49           HB       THR  49  -6.149 -18.450   8.379
  372    HG1  THR  49           1HG      THR  49  -5.593 -19.013  11.100
  373   1HG2  THR  49          1HG2      THR  49  -4.844 -20.793   9.743
  374   2HG2  THR  49          2HG2      THR  49  -5.080 -20.603   8.006
  375   3HG2  THR  49          3HG2      THR  49  -6.475 -20.755   9.073
  376    H    GLY  50           H        GLY  50  -5.299 -16.860   7.236
  377   1HA   GLY  50          2HA       GLY  50  -3.183 -17.244   5.250
  378   2HA   GLY  50          1HA       GLY  50  -4.793 -17.818   4.843
  379    H    VAL  51           H        VAL  51  -2.874 -14.975   5.600
  380    HA   VAL  51           HA       VAL  51  -4.446 -13.383   3.788
  381    HB   VAL  51           HB       VAL  51  -4.794 -11.572   5.566
  382   1HG1  VAL  51          1HG1      VAL  51  -6.461 -13.380   4.525
  383   2HG1  VAL  51          2HG1      VAL  51  -6.967 -12.198   5.731
  384   3HG1  VAL  51          3HG1      VAL  51  -6.571 -13.844   6.224
  385   1HG2  VAL  51          1HG2      VAL  51  -5.140 -12.459   7.863
  386   2HG2  VAL  51          2HG2      VAL  51  -3.455 -12.478   7.342
  387   3HG2  VAL  51          3HG2      VAL  51  -4.393 -13.971   7.346
  388    H    HIS  52           H        HIS  52  -2.841 -12.532   2.634
  389    HA   HIS  52           HA       HIS  52  -0.363 -11.738   3.956
  390   1HB   HIS  52          2HB       HIS  52  -1.143 -12.080   1.066
  391   2HB   HIS  52          1HB       HIS  52   0.376 -11.328   1.540
  392    HD1  HIS  52           1HD      HIS  52   2.168 -12.865   2.638
  393    HD2  HIS  52           2HD      HIS  52  -1.252 -14.848   1.356
  394    HE1  HIS  52           1HE      HIS  52   2.757 -15.309   2.669
  395    HE2  HIS  52           2HE      HIS  52   0.701 -16.483   1.805
  396    HA   PRO  53           HA       PRO  53  -1.609  -7.467   3.847
  397   1HB   PRO  53          2HB       PRO  53   0.654  -6.351   4.736
  398   2HB   PRO  53          1HB       PRO  53  -0.354  -7.350   5.791
  399   1HG   PRO  53          2HG       PRO  53   2.165  -8.068   4.343
  400   2HG   PRO  53          1HG       PRO  53   1.670  -8.473   5.997
  401   1HD   PRO  53          2HD       PRO  53   1.444 -10.181   3.851
  402   2HD   PRO  53          1HD       PRO  53   0.440 -10.274   5.312
  403    H    ILE  54           H        ILE  54  -1.608  -5.880   2.363
  404    HA   ILE  54           HA       ILE  54   0.687  -5.514   0.589
  405    HB   ILE  54           HB       ILE  54  -2.072  -5.690  -0.595
  406   1HG1  ILE  54          2HG1      ILE  54  -1.478  -7.886   0.432
  407   2HG1  ILE  54          1HG1      ILE  54  -1.635  -7.945  -1.319
  408   1HG2  ILE  54          1HG2      ILE  54   0.638  -5.186  -1.564
  409   2HG2  ILE  54          2HG2      ILE  54  -0.920  -4.745  -2.261
  410   3HG2  ILE  54          3HG2      ILE  54  -0.263  -6.361  -2.523
  411   1HD1  ILE  54          1HD1      ILE  54   0.513  -8.497  -1.621
  412   2HD1  ILE  54          2HD1      ILE  54   0.403  -9.027   0.057
  413   3HD1  ILE  54          3HD1      ILE  54   1.078  -7.442  -0.325
  414    H    VAL  55           H        VAL  55   0.756  -3.456  -0.413
  415    HA   VAL  55           HA       VAL  55  -1.251  -1.514   0.517
  416    HB   VAL  55           HB       VAL  55   1.726  -0.990   0.457
  417   1HG1  VAL  55          1HG1      VAL  55  -0.662   0.694   0.856
  418   2HG1  VAL  55          2HG1      VAL  55   0.931   1.111   0.228
  419   3HG1  VAL  55          3HG1      VAL  55   0.678   0.972   1.968
  420   1HG2  VAL  55          1HG2      VAL  55   0.459  -0.799   3.052
  421   2HG2  VAL  55          2HG2      VAL  55   1.905  -1.682   2.566
  422   3HG2  VAL  55          3HG2      VAL  55   0.315  -2.420   2.376
  423    H    VAL  56           H        VAL  56  -1.846   0.031  -0.962
  424    HA   VAL  56           HA       VAL  56  -0.416  -0.017  -3.540
  425    HB   VAL  56           HB       VAL  56  -3.389   0.265  -3.164
  426   1HG1  VAL  56          1HG1      VAL  56  -1.619   0.394  -5.575
  427   2HG1  VAL  56          2HG1      VAL  56  -2.893   1.505  -5.074
  428   3HG1  VAL  56          3HG1      VAL  56  -3.311  -0.087  -5.709
  429   1HG2  VAL  56          1HG2      VAL  56  -1.701  -2.032  -4.109
  430   2HG2  VAL  56          2HG2      VAL  56  -3.433  -1.917  -4.421
  431   3HG2  VAL  56          3HG2      VAL  56  -2.839  -2.000  -2.763
  432    H    VAL  57           H        VAL  57  -0.580   1.927  -4.821
  433    HA   VAL  57           HA       VAL  57  -1.542   4.358  -3.585
  434    HB   VAL  57           HB       VAL  57   1.325   4.538  -4.340
  435   1HG1  VAL  57          1HG1      VAL  57   0.849   5.838  -1.927
  436   2HG1  VAL  57          2HG1      VAL  57  -0.646   6.039  -2.841
  437   3HG1  VAL  57          3HG1      VAL  57   0.888   6.569  -3.531
  438   1HG2  VAL  57          1HG2      VAL  57   1.272   2.497  -2.962
  439   2HG2  VAL  57          2HG2      VAL  57   0.489   3.409  -1.670
  440   3HG2  VAL  57          3HG2      VAL  57   2.129   3.821  -2.172
  441    H    GLN  58           H        GLN  58  -0.388   6.263  -5.080
  442    HA   GLN  58           HA       GLN  58   0.145   5.754  -7.757
  443   1HB   GLN  58          2HB       GLN  58  -2.425   5.071  -7.368
  444   2HB   GLN  58          1HB       GLN  58  -2.637   6.786  -7.687
  445   1HG   GLN  58          2HG       GLN  58  -1.142   6.329  -9.752
  446   2HG   GLN  58          1HG       GLN  58  -1.589   4.646  -9.483
  447   1HE2  GLN  58          1HE2      GLN  58  -2.259   5.932 -11.805
  448   2HE2  GLN  58          2HE2      GLN  58  -3.970   6.164 -11.868
  449    HA   PRO  59           HA       PRO  59   1.036  10.002  -6.062
  450   1HB   PRO  59          2HB       PRO  59   3.026   9.628  -8.258
  451   2HB   PRO  59          1HB       PRO  59   3.242  10.331  -6.650
  452   1HG   PRO  59          2HG       PRO  59   4.109   7.872  -7.180
  453   2HG   PRO  59          1HG       PRO  59   3.366   8.258  -5.616
  454   1HD   PRO  59          2HD       PRO  59   2.240   6.757  -7.931
  455   2HD   PRO  59          1HD       PRO  59   1.962   6.530  -6.192
  456    H    ASP  60           H        ASP  60  -0.491  11.356  -6.788
  457    HA   ASP  60           HA       ASP  60  -0.262  12.611  -9.299
  458   1HB   ASP  60          2HB       ASP  60  -1.505  10.225  -9.609
  459   2HB   ASP  60          1HB       ASP  60  -2.890  11.252  -9.251
  460    H    ALA  61           H        ALA  61  -2.448  11.763  -6.664
  461    HA   ALA  61           HA       ALA  61  -3.287  14.587  -6.551
  462   1HB   ALA  61          1HB       ALA  61  -5.467  13.856  -5.734
  463   2HB   ALA  61          2HB       ALA  61  -4.966  12.171  -5.880
  464   3HB   ALA  61          3HB       ALA  61  -5.125  13.174  -7.323
  465    H    TRP  62           H        TRP  62  -1.066  13.259  -5.190
  466    HA   TRP  62           HA       TRP  62  -1.982  13.299  -2.400
  467   1HB   TRP  62          2HB       TRP  62  -0.301  11.538  -3.734
  468   2HB   TRP  62          1HB       TRP  62   0.806  12.553  -2.816
  469    HD1  TRP  62           HD       TRP  62  -2.206  10.203  -2.260
  470    HE1  TRP  62           1HE      TRP  62  -2.070   9.279   0.139
  471    HE3  TRP  62           3HE      TRP  62   1.783  12.919  -0.569
  472    HZ2  TRP  62           2HZ      TRP  62  -0.482   9.654   2.443
  473    HZ3  TRP  62           3HZ      TRP  62   2.547  12.576   1.745
  474    HH2  TRP  62           HH       TRP  62   1.437  10.978   3.218
  475    H    THR  63           H        THR  63   0.082  14.907  -4.698
  476    HA   THR  63           HA       THR  63   1.217  16.876  -4.626
  477    HB   THR  63           HB       THR  63  -0.069  17.473  -1.973
  478    HG1  THR  63           1HG      THR  63  -1.270  17.663  -4.533
  479   1HG2  THR  63          1HG2      THR  63   1.227  19.288  -2.505
  480   2HG2  THR  63          2HG2      THR  63  -0.320  19.731  -3.228
  481   3HG2  THR  63          3HG2      THR  63   0.976  19.095  -4.241
  482    H    GLU  64           H        GLU  64   2.974  17.998  -3.526
  483    HA   GLU  64           HA       GLU  64   4.419  16.167  -1.751
  484   1HB   GLU  64          2HB       GLU  64   6.420  17.485  -2.379
  485   2HB   GLU  64          1HB       GLU  64   5.614  16.766  -3.766
  486   1HG   GLU  64          2HG       GLU  64   5.383  18.744  -4.720
  487   2HG   GLU  64          1HG       GLU  64   4.553  19.379  -3.300
  488    H    ASP  65           H        ASP  65   3.353  16.731   0.183
  489    HA   ASP  65           HA       ASP  65   4.324  19.241   1.337
  490   1HB   ASP  65          2HB       ASP  65   1.632  18.815   0.612
  491   2HB   ASP  65          1HB       ASP  65   1.692  18.669   2.367
  492    H    ASN  66           H        ASN  66   2.618  16.191   2.000
  493    HA   ASN  66           HA       ASN  66   3.518  16.147   4.739
  494   1HB   ASN  66          2HB       ASN  66   2.165  13.964   3.141
  495   2HB   ASN  66          1HB       ASN  66   2.331  14.028   4.892
  496   1HD2  ASN  66          1HD2      ASN  66   1.457  16.148   5.845
  497   2HD2  ASN  66          2HD2      ASN  66  -0.094  16.639   5.264
  498    H    GLY  67           H        GLY  67   4.525  14.804   1.685
  499   1HA   GLY  67          2HA       GLY  67   6.798  14.144   1.339
  500   2HA   GLY  67          1HA       GLY  67   6.884  13.679   3.031
  501    H    PHE  68           H        PHE  68   6.420  12.603  -0.133
  502    HA   PHE  68           HA       PHE  68   5.152  10.106   0.708
  503   1HB   PHE  68          2HB       PHE  68   4.386  11.392  -1.346
  504   2HB   PHE  68          1HB       PHE  68   5.895  10.899  -2.106
  505    HD1  PHE  68           1HD      PHE  68   2.690   9.716  -0.748
  506    HD2  PHE  68           2HD      PHE  68   6.213   8.676  -2.897
  507    HE1  PHE  68           1HE      PHE  68   1.650   7.589  -1.417
  508    HE2  PHE  68           2HE      PHE  68   5.179   6.549  -3.571
  509    HZ   PHE  68           HZ       PHE  68   2.895   6.002  -2.830
  510    H    HIS  69           H        HIS  69   8.170  11.173   0.828
  511    HA   HIS  69           HA       HIS  69   9.469   8.897  -0.439
  512   1HB   HIS  69          2HB       HIS  69  11.575  10.037   0.387
  513   2HB   HIS  69          1HB       HIS  69  10.621  10.950  -0.775
  514    HD1  HIS  69           1HD      HIS  69   9.275  10.986   2.649
  515    HD2  HIS  69           2HD      HIS  69  11.901  13.260   0.370
  516    HE1  HIS  69           1HE      HIS  69   9.546  13.151   3.898
  517    HE2  HIS  69           2HE      HIS  69  11.074  14.543   2.458
  518    H    ALA  70           H        ALA  70   7.879   7.911   1.450
  519    HA   ALA  70           HA       ALA  70   9.622   6.495   3.141
  520   1HB   ALA  70          1HB       ALA  70   8.629   7.390   5.329
  521   2HB   ALA  70          2HB       ALA  70   8.175   8.809   4.385
  522   3HB   ALA  70          3HB       ALA  70   9.872   8.353   4.532
  523    H    ILE  71           H        ILE  71   7.578   5.842   1.349
  524    HA   ILE  71           HA       ILE  71   5.136   5.246   2.692
  525    HB   ILE  71           HB       ILE  71   6.176   3.885   0.211
  526   1HG1  ILE  71          2HG1      ILE  71   6.339   6.290  -0.129
  527   2HG1  ILE  71          1HG1      ILE  71   4.987   5.652  -1.056
  528   1HG2  ILE  71          1HG2      ILE  71   4.212   2.860   1.214
  529   2HG2  ILE  71          2HG2      ILE  71   3.793   3.639  -0.311
  530   3HG2  ILE  71          3HG2      ILE  71   3.383   4.416   1.218
  531   1HD1  ILE  71          1HD1      ILE  71   4.700   7.848   0.262
  532   2HD1  ILE  71          2HD1      ILE  71   4.540   6.793   1.666
  533   3HD1  ILE  71          3HD1      ILE  71   3.415   6.641   0.316
  534    H    GLY  72           H        GLY  72   7.695   3.076   1.462
  535   1HA   GLY  72          2HA       GLY  72   6.760   0.768   2.750
  536   2HA   GLY  72          1HA       GLY  72   8.406   1.018   2.188
  537    H    GLN  73           H        GLN  73   8.665   3.420   3.948
  538    HA   GLN  73           HA       GLN  73   9.629   2.018   6.263
  539   1HB   GLN  73          2HB       GLN  73  10.458   4.248   4.977
  540   2HB   GLN  73          1HB       GLN  73   9.549   4.975   6.294
  541   1HG   GLN  73          2HG       GLN  73  10.928   3.355   7.786
  542   2HG   GLN  73          1HG       GLN  73  12.010   3.292   6.394
  543   1HE2  GLN  73          1HE2      GLN  73  13.429   4.888   6.108
  544   2HE2  GLN  73          2HE2      GLN  73  13.486   6.347   7.031
  545    H    MET  74           H        MET  74   6.770   3.762   5.428
  546    HA   MET  74           HA       MET  74   5.999   4.117   8.220
  547   1HB   MET  74          2HB       MET  74   5.252   5.324   5.676
  548   2HB   MET  74          1HB       MET  74   3.848   4.895   6.643
  549   1HG   MET  74          2HG       MET  74   5.759   6.143   8.337
  550   2HG   MET  74          1HG       MET  74   5.549   7.136   6.898
  551   1HE   MET  74          1HE       MET  74   1.635   7.661   6.928
  552   2HE   MET  74          2HE       MET  74   2.502   6.332   6.160
  553   3HE   MET  74          3HE       MET  74   3.131   7.975   6.048
  554    H    CYS  75           H        CYS  75   5.279   2.139   5.436
  555    HA   CYS  75           HA       CYS  75   3.143   0.784   6.934
  556   1HB   CYS  75          2HB       CYS  75   2.421  -0.139   4.794
  557   2HB   CYS  75          1HB       CYS  75   2.529   1.615   4.695
  558    HG   CYS  75           HG       CYS  75   4.729   1.326   3.309
  559    H    GLU  76           H        GLU  76   3.031  -1.595   6.689
  560    HA   GLU  76           HA       GLU  76   5.734  -2.767   6.655
  561   1HB   GLU  76          2HB       GLU  76   3.874  -2.732   8.733
  562   2HB   GLU  76          1HB       GLU  76   3.749  -4.354   8.064
  563   1HG   GLU  76          2HG       GLU  76   6.237  -4.534   8.279
  564   2HG   GLU  76          1HG       GLU  76   6.201  -3.007   9.162
  565    H    ALA  77           H        ALA  77   4.163  -2.478   4.319
  566    HA   ALA  77           HA       ALA  77   3.968  -5.276   3.548
  567   1HB   ALA  77          1HB       ALA  77   1.759  -5.393   3.297
  568   2HB   ALA  77          2HB       ALA  77   1.701  -3.843   2.458
  569   3HB   ALA  77          3HB       ALA  77   1.660  -3.895   4.220
  570    HA   PRO  78           HA       PRO  78   5.537  -3.897  -0.329
  571   1HB   PRO  78          2HB       PRO  78   4.116  -5.275  -2.182
  572   2HB   PRO  78          1HB       PRO  78   5.314  -6.041  -1.130
  573   1HG   PRO  78          2HG       PRO  78   2.332  -5.955  -0.857
  574   2HG   PRO  78          1HG       PRO  78   3.436  -7.324  -0.626
  575   1HD   PRO  78          2HD       PRO  78   2.434  -5.904   1.445
  576   2HD   PRO  78          1HD       PRO  78   4.052  -6.632   1.487
  577    H    VAL  79           H        VAL  79   5.195  -1.830  -0.866
  578    HA   VAL  79           HA       VAL  79   2.559  -0.793  -1.417
  579    HB   VAL  79           HB       VAL  79   5.226   0.579  -1.777
  580   1HG1  VAL  79          1HG1      VAL  79   2.995   1.467  -2.805
  581   2HG1  VAL  79          2HG1      VAL  79   4.093   2.569  -1.976
  582   3HG1  VAL  79          3HG1      VAL  79   2.661   1.963  -1.146
  583   1HG2  VAL  79          1HG2      VAL  79   5.170   1.298   0.429
  584   2HG2  VAL  79          2HG2      VAL  79   4.639  -0.379   0.553
  585   3HG2  VAL  79          3HG2      VAL  79   3.456   0.927   0.612
  586    H    VAL  80           H        VAL  80   1.605  -0.663  -3.377
  587    HA   VAL  80           HA       VAL  80   3.312  -0.668  -5.767
  588    HB   VAL  80           HB       VAL  80   1.797  -2.291  -6.880
  589   1HG1  VAL  80          1HG1      VAL  80   3.319  -3.178  -4.444
  590   2HG1  VAL  80          2HG1      VAL  80   3.860  -3.157  -6.123
  591   3HG1  VAL  80          3HG1      VAL  80   2.629  -4.309  -5.607
  592   1HG2  VAL  80          1HG2      VAL  80  -0.121  -1.913  -5.325
  593   2HG2  VAL  80          2HG2      VAL  80   0.744  -2.858  -4.115
  594   3HG2  VAL  80          3HG2      VAL  80   0.244  -3.611  -5.629
  595    H    THR  81           H        THR  81   1.793  -0.410  -7.778
  596    HA   THR  81           HA       THR  81   0.093   1.891  -7.211
  597    HB   THR  81           HB       THR  81   0.324   2.488  -9.492
  598    HG1  THR  81           1HG      THR  81   0.297   0.980 -10.924
  599   1HG2  THR  81          1HG2      THR  81   2.476   2.523  -8.053
  600   2HG2  THR  81          2HG2      THR  81   2.581   2.789  -9.793
  601   3HG2  THR  81          3HG2      THR  81   2.990   1.213  -9.116
  602    H    ARG  82           H        ARG  82  -2.001   2.084  -8.326
  603    HA   ARG  82           HA       ARG  82  -3.695  -0.042  -7.808
  604   1HB   ARG  82          2HB       ARG  82  -5.258   1.164  -9.495
  605   2HB   ARG  82          1HB       ARG  82  -4.803   1.974  -8.004
  606   1HG   ARG  82          2HG       ARG  82  -4.035   3.687  -9.171
  607   2HG   ARG  82          1HG       ARG  82  -2.864   2.636  -9.959
  608   1HD   ARG  82          2HD       ARG  82  -5.577   2.387 -11.019
  609   2HD   ARG  82          1HD       ARG  82  -4.881   3.996 -11.215
  610    HE   ARG  82           HE       ARG  82  -2.920   2.291 -12.055
  611   1HH1  ARG  82          1HH1      ARG  82  -6.255   2.830 -12.930
  612   2HH1  ARG  82          2HH1      ARG  82  -6.031   2.350 -14.579
  613   1HH2  ARG  82          1HH2      ARG  82  -2.624   1.660 -14.225
  614   2HH2  ARG  82          2HH2      ARG  82  -3.970   1.686 -15.314
  615    H    GLU  83           H        GLU  83  -1.647   0.447 -10.540
  616    HA   GLU  83           HA       GLU  83  -2.888  -0.893 -12.585
  617   1HB   GLU  83          2HB       GLU  83   0.003  -0.855 -11.737
  618   2HB   GLU  83          1HB       GLU  83  -0.523  -1.701 -13.184
  619   1HG   GLU  83          2HG       GLU  83  -1.047   0.239 -14.296
  620   2HG   GLU  83          1HG       GLU  83  -1.283   1.154 -12.808
  621    H    TRP  84           H        TRP  84  -1.221  -2.267  -9.798
  622    HA   TRP  84           HA       TRP  84  -1.325  -4.974 -10.561
  623   1HB   TRP  84          2HB       TRP  84   0.054  -4.145  -8.699
  624   2HB   TRP  84          1HB       TRP  84  -1.396  -3.752  -7.793
  625    HD1  TRP  84           HD       TRP  84   0.556  -6.825  -9.074
  626    HE1  TRP  84           1HE      TRP  84  -0.063  -8.837  -7.591
  627    HE3  TRP  84           3HE      TRP  84  -3.095  -4.650  -6.239
  628    HZ2  TRP  84           2HZ      TRP  84  -1.865  -9.422  -5.493
  629    HZ3  TRP  84           3HZ      TRP  84  -4.219  -6.001  -4.519
  630    HH2  TRP  84           HH       TRP  84  -3.617  -8.337  -4.153
  631    H    VAL  85           H        VAL  85  -3.375  -3.154  -8.340
  632    HA   VAL  85           HA       VAL  85  -5.317  -5.090  -7.884
  633    HB   VAL  85           HB       VAL  85  -5.726  -2.097  -7.951
  634   1HG1  VAL  85          1HG1      VAL  85  -7.447  -4.356  -7.185
  635   2HG1  VAL  85          2HG1      VAL  85  -7.873  -2.721  -7.692
  636   3HG1  VAL  85          3HG1      VAL  85  -7.383  -3.028  -6.026
  637   1HG2  VAL  85          1HG2      VAL  85  -5.306  -2.218  -5.521
  638   2HG2  VAL  85          2HG2      VAL  85  -3.898  -2.674  -6.478
  639   3HG2  VAL  85          3HG2      VAL  85  -4.877  -3.918  -5.702
  640    H    LEU  86           H        LEU  86  -5.036  -2.742 -10.494
  641    HA   LEU  86           HA       LEU  86  -7.618  -3.330 -11.596
  642   1HB   LEU  86          2HB       LEU  86  -5.907  -1.256 -11.874
  643   2HB   LEU  86          1HB       LEU  86  -5.539  -2.151 -13.336
  644    HG   LEU  86           HG       LEU  86  -8.329  -2.055 -13.260
  645   1HD1  LEU  86          1HD1      LEU  86  -9.044  -0.045 -12.542
  646   2HD1  LEU  86          2HD1      LEU  86  -7.565   0.778 -13.038
  647   3HD1  LEU  86          3HD1      LEU  86  -7.606  -0.125 -11.524
  648   1HD2  LEU  86          1HD2      LEU  86  -6.402  -1.669 -15.078
  649   2HD2  LEU  86          2HD2      LEU  86  -6.891   0.005 -14.815
  650   3HD2  LEU  86          3HD2      LEU  86  -8.080  -1.189 -15.336
  651    H    ASP  87           H        ASP  87  -4.290  -4.014 -12.673
  652    HA   ASP  87           HA       ASP  87  -4.954  -5.611 -14.860
  653   1HB   ASP  87          2HB       ASP  87  -2.690  -4.723 -14.444
  654   2HB   ASP  87          1HB       ASP  87  -2.514  -5.822 -13.079
  655    H    SER  88           H        SER  88  -4.817  -6.344 -11.453
  656    HA   SER  88           HA       SER  88  -4.908  -9.191 -11.787
  657   1HB   SER  88          2HB       SER  88  -5.380  -7.420  -9.382
  658   2HB   SER  88          1HB       SER  88  -5.393  -9.183  -9.321
  659    HG   SER  88           HG       SER  88  -3.204  -7.672 -10.298
  660    H    VAL  89           H        VAL  89  -7.276  -6.731 -10.756
  661    HA   VAL  89           HA       VAL  89  -9.439  -8.579 -10.625
  662    HB   VAL  89           HB       VAL  89  -9.564  -5.570 -10.862
  663   1HG1  VAL  89          1HG1      VAL  89 -11.607  -7.492 -10.934
  664   2HG1  VAL  89          2HG1      VAL  89 -11.776  -5.747 -10.754
  665   3HG1  VAL  89          3HG1      VAL  89 -11.668  -6.775  -9.325
  666   1HG2  VAL  89          1HG2      VAL  89  -8.384  -7.019  -8.841
  667   2HG2  VAL  89          2HG2      VAL  89 -10.016  -6.742  -8.234
  668   3HG2  VAL  89          3HG2      VAL  89  -9.009  -5.375  -8.705
  669    H    ALA  90           H        ALA  90  -8.072  -6.615 -13.156
  670    HA   ALA  90           HA       ALA  90 -10.293  -6.626 -14.912
  671   1HB   ALA  90          1HB       ALA  90  -8.779  -5.850 -16.589
  672   2HB   ALA  90          2HB       ALA  90  -7.386  -6.442 -15.685
  673   3HB   ALA  90          3HB       ALA  90  -8.331  -5.088 -15.064
  674    H    LEU  91           H        LEU  91  -7.323  -8.597 -14.893
  675    HA   LEU  91           HA       LEU  91  -8.601 -10.488 -16.722
  676   1HB   LEU  91          2HB       LEU  91  -6.397  -9.759 -17.362
  677   2HB   LEU  91          1HB       LEU  91  -5.750 -10.188 -15.789
  678    HG   LEU  91           HG       LEU  91  -6.998 -12.426 -17.228
  679   1HD1  LEU  91          1HD1      LEU  91  -6.104 -11.760 -19.212
  680   2HD1  LEU  91          2HD1      LEU  91  -4.696 -12.570 -18.526
  681   3HD1  LEU  91          3HD1      LEU  91  -4.827 -10.813 -18.449
  682   1HD2  LEU  91          1HD2      LEU  91  -5.352 -12.145 -15.091
  683   2HD2  LEU  91          2HD2      LEU  91  -4.195 -12.530 -16.364
  684   3HD2  LEU  91          3HD2      LEU  91  -5.531 -13.629 -16.027
  685    H    TYR  92           H        TYR  92  -8.557 -10.078 -13.502
  686    HA   TYR  92           HA       TYR  92  -8.808 -11.407 -11.675
  687   1HB   TYR  92          2HB       TYR  92 -10.228 -12.659 -13.866
  688   2HB   TYR  92          1HB       TYR  92  -9.670 -13.864 -12.711
  689    HD1  TYR  92           1HD      TYR  92 -12.532 -12.576 -13.494
  690    HD2  TYR  92           2HD      TYR  92  -9.881 -12.317 -10.174
  691    HE1  TYR  92           1HE      TYR  92 -14.430 -12.035 -12.028
  692    HE2  TYR  92           2HE      TYR  92 -11.773 -11.776  -8.700
  693    HH   TYR  92           HH       TYR  92 -14.204 -12.074  -8.638
  694    H    GLN  93           H        GLN  93  -6.533 -11.492 -11.284
  695    HA   GLN  93           HA       GLN  93  -5.525 -14.067 -10.880
  696   1HB   GLN  93          2HB       GLN  93  -5.242 -13.359 -13.526
  697   2HB   GLN  93          1HB       GLN  93  -3.684 -12.912 -12.846
  698   1HG   GLN  93          2HG       GLN  93  -3.060 -15.043 -12.535
  699   2HG   GLN  93          1HG       GLN  93  -4.675 -15.557 -12.051
  700   1HE2  GLN  93          1HE2      GLN  93  -5.706 -16.830 -13.409
  701   2HE2  GLN  93          2HE2      GLN  93  -5.390 -16.985 -15.100
  702    H    CYS  94           H        CYS  94  -4.115 -13.926  -9.259
  703    HA   CYS  94           HA       CYS  94  -3.326 -11.425  -8.208
  704   1HB   CYS  94          2HB       CYS  94  -1.921 -12.811  -6.653
  705   2HB   CYS  94          1HB       CYS  94  -3.619 -13.270  -6.706
  706    HG   CYS  94           HG       CYS  94  -2.083 -15.018  -8.583
  707    H    GLN  95           H        GLN  95  -2.210 -10.351  -9.879
  708    HA   GLN  95           HA       GLN  95   0.078 -11.409 -11.166
  709   1HB   GLN  95          2HB       GLN  95  -0.600  -8.494 -10.740
  710   2HB   GLN  95          1HB       GLN  95   0.453  -9.163 -11.979
  711   1HG   GLN  95          2HG       GLN  95  -2.490  -9.742 -11.761
  712   2HG   GLN  95          1HG       GLN  95  -1.790  -8.500 -12.797
  713   1HE2  GLN  95          1HE2      GLN  95  -0.179  -9.254 -14.384
  714   2HE2  GLN  95          2HE2      GLN  95  -0.423 -10.794 -15.126
  715    H    GLU  96           H        GLU  96   2.253 -10.221 -11.002
  716    HA   GLU  96           HA       GLU  96   3.145 -10.468  -8.262
  717   1HB   GLU  96          2HB       GLU  96   5.388 -10.300  -9.170
  718   2HB   GLU  96          1HB       GLU  96   4.448 -11.441 -10.124
  719   1HG   GLU  96          2HG       GLU  96   4.041  -9.599 -11.764
  720   2HG   GLU  96          1HG       GLU  96   5.187  -8.620 -10.851
  721    H    LEU  97           H        LEU  97   3.441  -8.844  -6.891
  722    HA   LEU  97           HA       LEU  97   2.753  -6.188  -7.527
  723   1HB   LEU  97          2HB       LEU  97   4.033  -7.512  -5.168
  724   2HB   LEU  97          1HB       LEU  97   3.952  -5.762  -5.247
  725    HG   LEU  97           HG       LEU  97   1.378  -6.329  -5.757
  726   1HD1  LEU  97          1HD1      LEU  97   2.253  -8.829  -5.281
  727   2HD1  LEU  97          2HD1      LEU  97   0.609  -8.286  -4.951
  728   3HD1  LEU  97          3HD1      LEU  97   1.797  -8.342  -3.649
  729   1HD2  LEU  97          1HD2      LEU  97   1.889  -6.470  -2.894
  730   2HD2  LEU  97          2HD2      LEU  97   1.065  -5.230  -3.841
  731   3HD2  LEU  97          3HD2      LEU  97   2.822  -5.207  -3.700
  732    H    ASP  98           H        ASP  98   5.786  -7.900  -7.539
  733    HA   ASP  98           HA       ASP  98   7.609  -5.816  -7.401
  734   1HB   ASP  98          2HB       ASP  98   8.104  -8.299  -7.475
  735   2HB   ASP  98          1HB       ASP  98   7.903  -8.208  -9.221
  736    H    THR  99           H        THR  99   5.520  -6.769 -10.024
  737    HA   THR  99           HA       THR  99   6.888  -5.227 -12.024
  738    HB   THR  99           HB       THR  99   4.114  -6.430 -12.032
  739    HG1  THR  99           1HG      THR  99   5.155  -8.045 -13.289
  740   1HG2  THR  99          1HG2      THR  99   3.771  -5.437 -13.972
  741   2HG2  THR  99          2HG2      THR  99   5.156  -6.312 -14.626
  742   3HG2  THR  99          3HG2      THR  99   5.376  -4.707 -13.930
  743    H    TYR 100           H        TYR 100   4.657  -4.507  -9.537
  744    HA   TYR 100           HA       TYR 100   4.298  -1.818 -10.661
  745   1HB   TYR 100          2HB       TYR 100   2.094  -3.203  -9.143
  746   2HB   TYR 100          1HB       TYR 100   1.998  -1.735 -10.109
  747    HD1  TYR 100           1HD      TYR 100   2.286  -1.941 -12.630
  748    HD2  TYR 100           2HD      TYR 100   1.645  -5.299 -10.098
  749    HE1  TYR 100           1HE      TYR 100   1.571  -3.265 -14.576
  750    HE2  TYR 100           2HE      TYR 100   0.930  -6.632 -12.036
  751    HH   TYR 100           HH       TYR 100   0.279  -5.225 -15.095
  752    H    LEU 101           H        LEU 101   6.135  -2.918  -8.661
  753    HA   LEU 101           HA       LEU 101   5.169  -1.696  -6.182
  754   1HB   LEU 101          2HB       LEU 101   6.701  -3.973  -6.726
  755   2HB   LEU 101          1HB       LEU 101   7.833  -2.820  -6.050
  756    HG   LEU 101           HG       LEU 101   5.306  -3.082  -4.562
  757   1HD1  LEU 101          1HD1      LEU 101   5.511  -5.217  -3.803
  758   2HD1  LEU 101          2HD1      LEU 101   7.247  -5.278  -4.106
  759   3HD1  LEU 101          3HD1      LEU 101   6.113  -5.439  -5.446
  760   1HD2  LEU 101          1HD2      LEU 101   7.017  -3.235  -2.686
  761   2HD2  LEU 101          2HD2      LEU 101   6.969  -1.728  -3.602
  762   3HD2  LEU 101          3HD2      LEU 101   8.235  -2.914  -3.920
  763    H    ILE 102           H        ILE 102   6.035   0.121  -5.320
  764    HA   ILE 102           HA       ILE 102   7.605   1.801  -7.030
  765    HB   ILE 102           HB       ILE 102   6.890   2.305  -4.143
  766   1HG1  ILE 102          2HG1      ILE 102   5.317   3.068  -6.612
  767   2HG1  ILE 102          1HG1      ILE 102   4.892   1.746  -5.530
  768   1HG2  ILE 102          1HG2      ILE 102   7.853   4.009  -6.407
  769   2HG2  ILE 102          2HG2      ILE 102   8.456   3.904  -4.753
  770   3HG2  ILE 102          3HG2      ILE 102   6.923   4.710  -5.082
  771   1HD1  ILE 102          1HD1      ILE 102   3.556   3.365  -4.681
  772   2HD1  ILE 102          2HD1      ILE 102   4.648   4.669  -5.148
  773   3HD1  ILE 102          3HD1      ILE 102   5.008   3.684  -3.730
  774    HA   PRO 103           HA       PRO 103  11.433   0.199  -5.243
  775   1HB   PRO 103          2HB       PRO 103  13.102   1.236  -7.075
  776   2HB   PRO 103          1HB       PRO 103  12.092  -0.171  -7.428
  777   1HG   PRO 103          2HG       PRO 103  11.665   2.701  -8.160
  778   2HG   PRO 103          1HG       PRO 103  11.430   1.247  -9.149
  779   1HD   PRO 103          2HD       PRO 103   9.393   2.565  -7.889
  780   2HD   PRO 103          1HD       PRO 103   9.359   0.831  -8.262
  781    H    GLN 104           H        GLN 104  13.608   1.289  -4.747
  782    HA   GLN 104           HA       GLN 104  13.204   4.104  -3.987
  783   1HB   GLN 104          2HB       GLN 104  13.101   2.151  -2.149
  784   2HB   GLN 104          1HB       GLN 104  14.842   2.393  -2.194
  785   1HG   GLN 104          2HG       GLN 104  14.670   4.609  -1.471
  786   2HG   GLN 104          1HG       GLN 104  12.948   4.686  -1.839
  787   1HE2  GLN 104          1HE2      GLN 104  11.533   4.237  -0.278
  788   2HE2  GLN 104          2HE2      GLN 104  11.934   3.610   1.280
  789    H    ILE 105           H        ILE 105  15.562   1.503  -4.493
  790    HA   ILE 105           HA       ILE 105  17.332   3.394  -5.812
  791    HB   ILE 105           HB       ILE 105  18.054   3.457  -3.458
  792   1HG1  ILE 105          2HG1      ILE 105  20.463   2.485  -3.967
  793   2HG1  ILE 105          1HG1      ILE 105  19.814   2.332  -5.596
  794   1HG2  ILE 105          1HG2      ILE 105  19.124   0.716  -3.509
  795   2HG2  ILE 105          2HG2      ILE 105  17.376   0.854  -3.332
  796   3HG2  ILE 105          3HG2      ILE 105  18.444   1.648  -2.176
  797   1HD1  ILE 105          1HD1      ILE 105  19.146   4.807  -5.308
  798   2HD1  ILE 105          2HD1      ILE 105  20.832   4.401  -5.628
  799   3HD1  ILE 105          3HD1      ILE 105  20.316   4.795  -3.989
  800    HA   PRO 106           HA       PRO 106  17.730  -0.115  -8.510
  801   1HB   PRO 106          2HB       PRO 106  20.076   0.628  -9.737
  802   2HB   PRO 106          1HB       PRO 106  18.484   1.255 -10.174
  803   1HG   PRO 106          2HG       PRO 106  20.591   2.477  -8.438
  804   2HG   PRO 106          1HG       PRO 106  19.556   3.246  -9.656
  805   1HD   PRO 106          2HD       PRO 106  19.038   3.462  -7.031
  806   2HD   PRO 106          1HD       PRO 106  17.733   3.339  -8.228
  807    H    HIS 107           H        HIS 107  20.661   1.013  -6.830
  808    HA   HIS 107           HA       HIS 107  21.896  -1.580  -6.935
  809   1HB   HIS 107          2HB       HIS 107  22.637   0.910  -5.384
  810   2HB   HIS 107          1HB       HIS 107  23.632  -0.538  -5.498
  811    HD1  HIS 107           1HD      HIS 107  24.373   2.394  -6.548
  812    HD2  HIS 107           2HD      HIS 107  23.114  -0.829  -8.849
  813    HE1  HIS 107           1HE      HIS 107  25.231   2.848  -8.868
  814    HE2  HIS 107           2HE      HIS 107  24.385   0.925 -10.260
  815    H    SER 108           H        SER 108  20.176  -2.810  -5.940
  816    HA   SER 108           HA       SER 108  20.085  -2.516  -3.010
  817   1HB   SER 108          2HB       SER 108  17.910  -3.613  -3.060
  818   2HB   SER 108          1HB       SER 108  17.896  -2.222  -4.144
  819    HG   SER 108           HG       SER 108  18.073  -4.966  -4.811
  820    H    HIS 109           H        HIS 109  20.239  -4.854  -5.665
  821    HA   HIS 109           HA       HIS 109  20.603  -7.126  -3.996
  822   1HB   HIS 109          2HB       HIS 109  21.211  -8.297  -6.063
  823   2HB   HIS 109          1HB       HIS 109  19.764  -7.321  -6.294
  824    HD1  HIS 109           1HD      HIS 109  23.039  -7.961  -7.713
  825    HD2  HIS 109           2HD      HIS 109  20.347  -4.795  -7.690
  826    HE1  HIS 109           1HE      HIS 109  23.739  -6.471  -9.613
  827    HE2  HIS 109           2HE      HIS 109  22.150  -4.517  -9.524
  828    H    TYR 110           H        TYR 110  22.696  -8.538  -4.647
  829    HA   TYR 110           HA       TYR 110  24.866  -7.235  -3.351
  830   1HB   TYR 110          2HB       TYR 110  24.899  -9.855  -4.863
  831   2HB   TYR 110          1HB       TYR 110  26.068  -9.321  -3.659
  832    HD1  TYR 110           1HD      TYR 110  25.203  -8.931  -1.272
  833    HD2  TYR 110           2HD      TYR 110  23.023 -11.089  -4.219
  834    HE1  TYR 110           1HE      TYR 110  23.869  -9.993   0.500
  835    HE2  TYR 110           2HE      TYR 110  21.683 -12.155  -2.456
  836    HH   TYR 110           HH       TYR 110  21.407 -11.070   0.555