*HEADER    LIPID TRANSPORT                         21-JUN-01   1JFN              
*TITLE     SOLUTION STRUCTURE OF HUMAN APOLIPOPROTEIN(A) KRINGLE IV              
*TITLE    2 TYPE 6                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: APOLIPOPROTEIN A, KIV-T6;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: APO(A) KIV-T6;                                             
*COMPND   5 SYNONYM: APO(A) KIV-T6; LIPOPROTEIN, LP(A); APOLIPOPROTEIN           
*COMPND   6 LP(A); APO(A); LP(A);                                                
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: APOA;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PT7-7                                     
*KEYWDS    KRINGLE DOMAIN, PROTEIN-PROTEIN RECOGNITION, LP(A)                    
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    B.MADEREGGER, W.BERMEL, A.HRZENJAK, G.M.KOSTNER, H.STERK              
*REVDAT   1   28-JUN-02 1JFN    0                                                


! ANSIG v3.3 XPLOR distance restraints file
! Distance corrections applied.
! Trivial distances not output.

! residue 1    Ala , intraresidue NOEs

! residue 1    Ala , NOEs forward in sequence

! residue 2    Arg , intraresidue NOEs

! residue 2    Arg , NOEs forward in sequence

! residue 3    Ile , intraresidue NOEs

! residue 3    Ile , NOEs forward in sequence

! residue 4    His , intraresidue NOEs

! residue 4    His , NOEs forward in sequence

! residue 5    His , intraresidue NOEs

! residue 5    His , NOEs forward in sequence

! residue 6    His , intraresidue NOEs

! residue 6    His , NOEs forward in sequence

! residue 7    His , intraresidue NOEs

! residue 7    His , NOEs forward in sequence

! residue 8    His , intraresidue NOEs

! residue 8    His , NOEs forward in sequence

! residue 9    His , intraresidue NOEs

! residue 9    His , NOEs forward in sequence

! residue 10   Ile , intraresidue NOEs

! residue 10   Ile , NOEs forward in sequence
assi (resi 10   and name HA  ) (resi 11   and name HN  )  3.00  1.20  0.60
assi (resi 10   and name HB  ) (resi 11   and name HN  )  4.00  2.20  1.00
assi (resi 10   and name HD1#) (resi 11   and name HN  )  4.00  2.20  1.30

! residue 11   Glu , intraresidue NOEs
! trivial: assi (resi 11   and name HN  ) (resi 11   and name HA  )  4.00  2.20  1.00
assi (resi 11   and name HN  ) (resi 11   and name HB# )  4.00  2.20  2.00
assi (resi 11   and name HN  ) (resi 11   and name HG# )  4.00  2.20  2.00

! residue 11   Glu , NOEs forward in sequence
assi (resi 11   and name HA  ) (resi 12   and name HN  )  3.00  1.20  0.60

! residue 12   Gly , intraresidue NOEs
! trivial: assi (resi 12   and name HN  ) (resi 12   and name HA# )  3.00  1.20  1.60

! residue 12   Gly , NOEs forward in sequence
assi (resi 12   and name HN  ) (resi 13   and name HN  )  4.00  2.20  1.00
assi (resi 12   and name HA# ) (resi 13   and name HN  )  3.00  1.20  1.60

! residue 13   Arg , intraresidue NOEs
! trivial: assi (resi 13   and name HN  ) (resi 13   and name HA  )  4.00  2.20  1.00
assi (resi 13   and name HN  ) (resi 13   and name HB# )  4.00  2.20  2.00
assi (resi 13   and name HN  ) (resi 13   and name HG# )  4.00  2.20  2.00

! residue 13   Arg , NOEs forward in sequence
assi (resi 13   and name HN  ) (resi 14   and name HN  )  4.00  2.20  1.00
assi (resi 13   and name HA  ) (resi 14   and name HN  )  3.00  1.20  0.60
assi (resi 13   and name HB# ) (resi 14   and name HN  )  4.00  2.20  2.00
assi (resi 13   and name HG# ) (resi 14   and name HN  )  4.00  2.20  2.00

! residue 14   Ala , intraresidue NOEs
assi (resi 14   and name HN  ) (resi 14   and name HA  )  3.00  1.20  0.60
assi (resi 14   and name HN  ) (resi 14   and name HB# )  4.00  2.20  1.30

! residue 14   Ala , NOEs forward in sequence

! residue 15   Pro , intraresidue NOEs

! residue 15   Pro , NOEs forward in sequence
assi (resi 15   and name HA  ) (resi 16   and name HN  )  3.00  1.20  0.60
assi (resi 15   and name HB# ) (resi 16   and name HN  )  4.00  2.20  2.00

! residue 16   Thr , intraresidue NOEs
assi (resi 16   and name HN  ) (resi 16   and name HA  )  3.00  1.20  0.60
assi (resi 16   and name HN  ) (resi 16   and name HB  )  3.00  1.20  0.60
assi (resi 16   and name HN  ) (resi 16   and name HG2#)  4.00  2.20  1.30

! residue 16   Thr , NOEs forward in sequence
assi (resi 16   and name HG2#) (resi 17   and name HN  )  4.00  2.20  1.30

! residue 17   Glu , intraresidue NOEs
assi (resi 17   and name HN  ) (resi 17   and name HA  )  2.50  0.70  0.20
assi (resi 17   and name HN  ) (resi 17   and name HB# )  3.00  1.20  1.60
assi (resi 17   and name HN  ) (resi 17   and name HG# )  3.00  1.20  1.60

! residue 17   Glu , NOEs forward in sequence
assi (resi 17   and name HA  ) (resi 18   and name HN  )  3.00  1.20  0.60

! residue 18   Gln , intraresidue NOEs
assi (resi 18   and name HN  ) (resi 18   and name HA  )  2.50  0.70  0.20
assi (resi 18   and name HN  ) (resi 18   and name HB# )  2.50  0.70  1.20
assi (resi 18   and name HN  ) (resi 18   and name HG# )  3.00  1.20  1.60

! residue 18   Gln , NOEs forward in sequence
assi (resi 18   and name HN  ) (resi 19   and name HB# )  4.00  2.20  2.00

! residue 19   Ser , intraresidue NOEs
assi (resi 19   and name HN  ) (resi 19   and name HA  )  3.00  1.20  0.60
assi (resi 19   and name HN  ) (resi 19   and name HB# )  4.00  2.20  2.00

! residue 19   Ser , NOEs forward in sequence

! residue 20   Pro , intraresidue NOEs

! residue 20   Pro , NOEs forward in sequence
assi (resi 20   and name HA  ) (resi 21   and name HN  )  3.00  1.20  0.60
assi (resi 20   and name HB# ) (resi 21   and name HN  )  4.00  2.20  2.00

! residue 21   Gly , intraresidue NOEs
! trivial: assi (resi 21   and name HN  ) (resi 21   and name HA# )  3.00  1.20  1.60

! residue 21   Gly , NOEs forward in sequence
assi (resi 21   and name HN  ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 21   and name HN  ) (resi 22   and name HG# )  4.00  2.20  3.40
assi (resi 21   and name HA# ) (resi 22   and name HN  )  2.50  0.70  1.20
assi (resi 21   and name HA# ) (resi 22   and name HG# )  3.00  1.20  4.00

! residue 22   Val , intraresidue NOEs
assi (resi 22   and name HN  ) (resi 22   and name HA  )  3.00  1.20  0.60
assi (resi 22   and name HN  ) (resi 22   and name HB  )  3.00  1.20  0.60
assi (resi 22   and name HN  ) (resi 22   and name HG# )  3.00  1.20  3.00
assi (resi 22   and name HA  ) (resi 22   and name HG# )  2.50  0.70  2.60

! residue 22   Val , NOEs forward in sequence
assi (resi 22   and name HN  ) (resi 23   and name HN  )  4.00  2.20  1.00
assi (resi 22   and name HN  ) (resi 23   and name HB# )  4.00  2.20  2.00
assi (resi 22   and name HA  ) (resi 23   and name HN  )  2.50  0.70  0.20
assi (resi 22   and name HG# ) (resi 23   and name HN  )  4.00  2.20  3.40
assi (resi 22   and name HG# ) (resi 24   and name HN  )  4.00  2.20  3.40

! residue 23   Gln , intraresidue NOEs
assi (resi 23   and name HN  ) (resi 23   and name HA  )  2.50  0.70  0.20
assi (resi 23   and name HN  ) (resi 23   and name HB# )  3.00  1.20  1.60
assi (resi 23   and name HN  ) (resi 23   and name HG# )  3.00  1.20  1.60

! residue 23   Gln , NOEs forward in sequence
assi (resi 23   and name HN  ) (resi 24   and name HB# )  4.00  2.20  2.00
assi (resi 23   and name HA  ) (resi 24   and name HN  )  2.50  0.70  0.20
assi (resi 23   and name HB# ) (resi 24   and name HN  )  4.00  2.20  2.00
assi (resi 23   and name HG# ) (resi 24   and name HN  )  4.00  2.20  2.00

! residue 24   Asp , intraresidue NOEs
assi (resi 24   and name HN  ) (resi 24   and name HA  )  3.00  1.20  0.60
assi (resi 24   and name HN  ) (resi 24   and name HB# )  3.00  1.20  1.60

! residue 24   Asp , NOEs forward in sequence
assi (resi 24   and name HA  ) (resi 25   and name HN  )  2.50  0.70  0.20
assi (resi 24   and name HB# ) (resi 25   and name HN  )  3.00  1.20  1.60
assi (resi 24   and name HN  ) (resi 99   and name HD# )  4.00  2.20  3.40

! residue 25   Cys , intraresidue NOEs
assi (resi 25   and name HN  ) (resi 25   and name HA  )  3.00  1.20  0.60
assi (resi 25   and name HN  ) (resi 25   and name HB# )  3.00  1.20  1.60

! residue 25   Cys , NOEs forward in sequence
assi (resi 25   and name HN  ) (resi 26   and name HN  )  4.00  2.20  1.00
assi (resi 25   and name HA  ) (resi 26   and name HN  )  2.50  0.70  0.20
assi (resi 25   and name HB# ) (resi 26   and name HN  )  3.00  1.20  1.60
assi (resi 25   and name HN  ) (resi 33   and name HE# )  3.00  1.20  2.60
assi (resi 25   and name HN  ) (resi 98   and name HB# )  4.00  2.20  2.00
assi (resi 25   and name HN  ) (resi 99   and name HB# )  4.00  2.20  2.00
assi (resi 25   and name HN  ) (resi 99   and name HD# )  4.00  2.20  3.40
assi (resi 25   and name HA  ) (resi 100  and name HN  )  4.00  2.20  1.00
assi (resi 25   and name HB# ) (resi 100  and name HN  )  4.00  2.20  2.00
assi (resi 25   and name HB# ) (resi 100  and name HG2#)  4.00  2.20  2.30
assi (resi 25   and name HA  ) (resi 102  and name HN  )  4.00  2.20  1.00
assi (resi 25   and name HB# ) (resi 102  and name HN  )  3.00  1.20  1.60

! residue 26   Tyr , intraresidue NOEs
! trivial: assi (resi 26   and name HN  ) (resi 26   and name HA  )  4.00  2.20  1.00
assi (resi 26   and name HN  ) (resi 26   and name HB# )  4.00  2.20  2.00
assi (resi 26   and name HN  ) (resi 26   and name HD# )  3.00  1.20  2.60
assi (resi 26   and name HN  ) (resi 26   and name HE# )  4.00  2.20  3.00
assi (resi 26   and name HB# ) (resi 26   and name HD# )  4.00  2.20  4.00
assi (resi 26   and name HB# ) (resi 26   and name HE# )  4.00  2.20  4.00
! trivial: assi (resi 26   and name HD# ) (resi 26   and name HE# )  3.00  1.20  4.60

! residue 26   Tyr , NOEs forward in sequence
assi (resi 26   and name HN  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HA  ) (resi 27   and name HN  )  3.00  1.20  0.60
assi (resi 26   and name HB# ) (resi 27   and name HN  )  3.00  1.20  1.60
assi (resi 26   and name HE# ) (resi 27   and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HD# ) (resi 29   and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HA  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HB# ) (resi 30   and name HN  )  4.00  2.20  2.00
assi (resi 26   and name HD# ) (resi 30   and name HN  )  3.00  1.20  2.60
assi (resi 26   and name HE# ) (resi 30   and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HD# ) (resi 31   and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HB# ) (resi 33   and name HN  )  4.00  2.20  2.00
assi (resi 26   and name HN  ) (resi 99   and name HB# )  4.00  2.20  2.00
assi (resi 26   and name HN  ) (resi 99   and name HD# )  4.00  2.20  3.40
assi (resi 26   and name HB# ) (resi 99   and name HD# )  4.00  2.20  4.40
assi (resi 26   and name HD# ) (resi 99   and name HB# )  4.00  2.20  4.00
assi (resi 26   and name HD# ) (resi 99   and name HD# )  4.00  2.20  5.40
assi (resi 26   and name HE# ) (resi 99   and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HE# ) (resi 99   and name HD# )  4.00  2.20  5.40
assi (resi 26   and name HN  ) (resi 100  and name HA  )  4.00  2.20  1.00
assi (resi 26   and name HD# ) (resi 100  and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HE# ) (resi 100  and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HN  ) (resi 101  and name HA  )  3.00  1.20  0.60
assi (resi 26   and name HN  ) (resi 101  and name HB# )  4.00  2.20  2.00
assi (resi 26   and name HN  ) (resi 101  and name HG# )  4.00  2.20  2.00
assi (resi 26   and name HD# ) (resi 101  and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HD# ) (resi 101  and name HE2#)  4.00  2.20  4.00
assi (resi 26   and name HE# ) (resi 101  and name HN  )  4.00  2.20  3.00
assi (resi 26   and name HN  ) (resi 102  and name HN  )  3.00  1.20  0.60
assi (resi 26   and name HN  ) (resi 102  and name HA  )  3.00  1.20  0.60
assi (resi 26   and name HA  ) (resi 102  and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HD# ) (resi 102  and name HN  )  4.00  2.20  3.00

! residue 27   His , intraresidue NOEs
assi (resi 27   and name HN  ) (resi 27   and name HA  )  3.00  1.20  0.60
assi (resi 27   and name HN  ) (resi 27   and name HD2 )  4.00  2.20  1.00
assi (resi 27   and name HN  ) (resi 27   and name HB# )  3.00  1.20  1.60
assi (resi 27   and name HD2 ) (resi 27   and name HB# )  4.00  2.20  2.00

! residue 27   His , NOEs forward in sequence
assi (resi 27   and name HA  ) (resi 28   and name HN  )  3.00  1.20  0.60
assi (resi 27   and name HB# ) (resi 28   and name HN  )  4.00  2.20  2.00
assi (resi 27   and name HN  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HN  ) (resi 30   and name HA# )  4.00  2.20  2.00
assi (resi 27   and name HB# ) (resi 30   and name HN  )  4.00  2.20  2.00
assi (resi 27   and name HN  ) (resi 33   and name HB# )  4.00  2.20  2.00
assi (resi 27   and name HA  ) (resi 102  and name HN  )  3.00  1.20  0.60

! residue 28   Gly , intraresidue NOEs
! trivial: assi (resi 28   and name HN  ) (resi 28   and name HA# )  3.00  1.20  1.60

! residue 28   Gly , NOEs forward in sequence
assi (resi 28   and name HN  ) (resi 29   and name HN  )  4.00  2.20  1.00
assi (resi 28   and name HA# ) (resi 29   and name HN  )  2.50  0.70  1.20
assi (resi 28   and name HN  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 28   and name HA# ) (resi 30   and name HN  )  3.00  1.20  1.60
assi (resi 28   and name HA# ) (resi 31   and name HN  )  4.00  2.20  2.00
assi (resi 28   and name HN  ) (resi 101  and name HG# )  4.00  2.20  2.00
assi (resi 28   and name HA# ) (resi 101  and name HE2#)  4.00  2.20  3.00

! residue 29   Asp , intraresidue NOEs
assi (resi 29   and name HN  ) (resi 29   and name HA  )  3.00  1.20  0.60
assi (resi 29   and name HN  ) (resi 29   and name HB# )  3.00  1.20  1.60

! residue 29   Asp , NOEs forward in sequence
assi (resi 29   and name HN  ) (resi 30   and name HN  )  3.00  1.20  0.60
assi (resi 29   and name HA  ) (resi 30   and name HN  )  3.00  1.20  0.60
assi (resi 29   and name HB# ) (resi 30   and name HN  )  4.00  2.20  2.00
assi (resi 29   and name HN  ) (resi 31   and name HN  )  3.00  1.20  0.60
assi (resi 29   and name HN  ) (resi 31   and name HB# )  4.00  2.20  2.00
assi (resi 29   and name HA  ) (resi 31   and name HN  )  3.00  1.20  0.60
assi (resi 29   and name HN  ) (resi 76   and name HD2#)  4.00  2.20  2.00
assi (resi 29   and name HB# ) (resi 76   and name HD2#)  4.00  2.20  3.00
assi (resi 29   and name HA  ) (resi 82   and name HN  )  4.00  2.20  1.00
assi (resi 29   and name HB# ) (resi 82   and name HN  )  4.00  2.20  2.00

! residue 30   Gly , intraresidue NOEs
! trivial: assi (resi 30   and name HN  ) (resi 30   and name HA# )  3.00  1.20  1.60

! residue 30   Gly , NOEs forward in sequence
assi (resi 30   and name HN  ) (resi 31   and name HN  )  3.00  1.20  0.60
assi (resi 30   and name HA# ) (resi 31   and name HN  )  4.00  2.20  2.00
assi (resi 30   and name HN  ) (resi 33   and name HB# )  4.00  2.20  2.00
assi (resi 30   and name HA# ) (resi 33   and name HN  )  4.00  2.20  2.00
assi (resi 30   and name HN  ) (resi 76   and name HD2#)  4.00  2.20  2.00
assi (resi 30   and name HN  ) (resi 82   and name HA  )  4.00  2.20  1.00
assi (resi 30   and name HN  ) (resi 82   and name HB# )  4.00  2.20  2.00
assi (resi 30   and name HN  ) (resi 101  and name HG# )  4.00  2.20  2.00

! residue 31   Gln , intraresidue NOEs
assi (resi 31   and name HN  ) (resi 31   and name HA  )  3.00  1.20  0.60
assi (resi 31   and name HN  ) (resi 31   and name HB# )  2.50  0.70  1.20
assi (resi 31   and name HN  ) (resi 31   and name HG# )  3.00  1.20  1.60
assi (resi 31   and name HB# ) (resi 31   and name HE2#)  4.00  2.20  3.00
assi (resi 31   and name HG# ) (resi 31   and name HE2#)  3.00  1.20  2.60

! residue 31   Gln , NOEs forward in sequence
assi (resi 31   and name HN  ) (resi 33   and name HN  )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 33   and name HN  )  3.00  1.20  0.60
assi (resi 31   and name HN  ) (resi 76   and name HB# )  3.00  1.20  1.60
assi (resi 31   and name HA  ) (resi 76   and name HN  )  4.00  2.20  1.00
assi (resi 31   and name HG# ) (resi 76   and name HD2#)  4.00  2.20  3.00
assi (resi 31   and name HG# ) (resi 79   and name HN  )  4.00  2.20  2.00
assi (resi 31   and name HE2#) (resi 79   and name HA  )  4.00  2.20  2.00
assi (resi 31   and name HE2#) (resi 79   and name HB# )  4.00  2.20  2.30

! residue 32   Ser , intraresidue NOEs

! residue 32   Ser , NOEs forward in sequence

! residue 33   Tyr , intraresidue NOEs
assi (resi 33   and name HN  ) (resi 33   and name HA  )  3.00  1.20  0.60
assi (resi 33   and name HN  ) (resi 33   and name HB# )  3.00  1.20  1.60
assi (resi 33   and name HN  ) (resi 33   and name HD# )  3.00  1.20  2.60
assi (resi 33   and name HB# ) (resi 33   and name HD# )  4.00  2.20  4.00
! trivial: assi (resi 33   and name HD# ) (resi 33   and name HE# )  4.00  2.20  5.00

! residue 33   Tyr , NOEs forward in sequence
assi (resi 33   and name HD# ) (resi 74   and name HN  )  4.00  2.20  3.00
assi (resi 33   and name HE# ) (resi 74   and name HN  )  4.00  2.20  3.00
assi (resi 33   and name HN  ) (resi 76   and name HB# )  4.00  2.20  2.00
assi (resi 33   and name HD# ) (resi 76   and name HN  )  4.00  2.20  3.00
assi (resi 33   and name HE# ) (resi 99   and name HD# )  4.00  2.20  5.40

! residue 34   Arg , intraresidue NOEs

! residue 34   Arg , NOEs forward in sequence

! residue 35   Gly , intraresidue NOEs

! residue 35   Gly , NOEs forward in sequence
assi (resi 35   and name HA# ) (resi 36   and name HN  )  3.00  1.20  1.60
assi (resi 35   and name HA# ) (resi 37   and name HN  )  3.00  1.20  1.60

! residue 36   Ser , intraresidue NOEs
assi (resi 36   and name HN  ) (resi 36   and name HA  )  3.00  1.20  0.60
assi (resi 36   and name HN  ) (resi 36   and name HB# )  3.00  1.20  1.60

! residue 36   Ser , NOEs forward in sequence
assi (resi 36   and name HN  ) (resi 37   and name HN  )  3.00  1.20  0.60
assi (resi 36   and name HN  ) (resi 37   and name HB# )  4.00  2.20  2.00
assi (resi 36   and name HA  ) (resi 37   and name HN  )  3.00  1.20  0.60
assi (resi 36   and name HB# ) (resi 37   and name HN  )  4.00  2.20  2.00
assi (resi 36   and name HA  ) (resi 74   and name HN  )  3.00  1.20  0.60

! residue 37   Phe , intraresidue NOEs
assi (resi 37   and name HN  ) (resi 37   and name HA  )  3.00  1.20  0.60
assi (resi 37   and name HN  ) (resi 37   and name HB# )  3.00  1.20  1.60

! residue 37   Phe , NOEs forward in sequence
assi (resi 37   and name HN  ) (resi 38   and name HN  )  4.00  2.20  1.00
assi (resi 37   and name HA  ) (resi 38   and name HN  )  2.50  0.70  0.20
assi (resi 37   and name HB# ) (resi 38   and name HN  )  4.00  2.20  2.00
assi (resi 37   and name HD# ) (resi 38   and name HN  )  3.00  1.20  2.60
assi (resi 37   and name HA  ) (resi 39   and name HN  )  3.00  1.20  0.60
assi (resi 37   and name HB# ) (resi 39   and name HN  )  4.00  2.20  2.00
assi (resi 37   and name HD# ) (resi 39   and name HN  )  2.50  0.70  2.20
assi (resi 37   and name HE# ) (resi 39   and name HN  )  2.50  0.70  2.20
assi (resi 37   and name HN  ) (resi 73   and name HA  )  4.00  2.20  1.00
assi (resi 37   and name HN  ) (resi 74   and name HN  )  4.00  2.20  1.00
assi (resi 37   and name HA  ) (resi 74   and name HN  )  4.00  2.20  1.00
assi (resi 37   and name HZ  ) (resi 98   and name HD2#)  3.00  1.20  1.60
assi (resi 37   and name HE# ) (resi 98   and name HN  )  3.00  1.20  2.60
assi (resi 37   and name HN  ) (resi 99   and name HD# )  4.00  2.20  3.40
assi (resi 37   and name HB# ) (resi 99   and name HD# )  4.00  2.20  4.40
assi (resi 37   and name HD# ) (resi 99   and name HD# )  4.00  2.20  5.40

! residue 38   Ser , intraresidue NOEs
assi (resi 38   and name HN  ) (resi 38   and name HA  )  3.00  1.20  0.60
assi (resi 38   and name HN  ) (resi 38   and name HB# )  3.00  1.20  1.60

! residue 38   Ser , NOEs forward in sequence
assi (resi 38   and name HN  ) (resi 39   and name HN  )  3.00  1.20  0.60
assi (resi 38   and name HA  ) (resi 39   and name HN  )  3.00  1.20  0.60
assi (resi 38   and name HB# ) (resi 39   and name HN  )  4.00  2.20  2.00
assi (resi 38   and name HA  ) (resi 46   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HB# ) (resi 46   and name HN  )  4.00  2.20  2.00
assi (resi 38   and name HN  ) (resi 73   and name HA  )  3.00  1.20  0.60
assi (resi 38   and name HB# ) (resi 73   and name HN  )  4.00  2.20  2.00
assi (resi 38   and name HA  ) (resi 74   and name HN  )  3.00  1.20  0.60
assi (resi 38   and name HB# ) (resi 74   and name HN  )  4.00  2.20  2.00

! residue 39   Thr , intraresidue NOEs
assi (resi 39   and name HN  ) (resi 39   and name HA  )  3.00  1.20  0.60
assi (resi 39   and name HN  ) (resi 39   and name HB  )  3.00  1.20  0.60
assi (resi 39   and name HN  ) (resi 39   and name HG2#)  4.00  2.20  1.30
assi (resi 39   and name HA  ) (resi 39   and name HG2#)  3.00  1.20  0.90
! trivial: assi (resi 39   and name HB  ) (resi 39   and name HG2#)  3.00  1.20  0.90

! residue 39   Thr , NOEs forward in sequence
assi (resi 39   and name HN  ) (resi 40   and name HN  )  4.00  2.20  1.00
assi (resi 39   and name HN  ) (resi 40   and name HA  )  4.00  2.20  1.00
assi (resi 39   and name HA  ) (resi 40   and name HN  )  2.50  0.70  0.20
assi (resi 39   and name HB  ) (resi 40   and name HN  )  4.00  2.20  1.00
assi (resi 39   and name HG2#) (resi 40   and name HN  )  4.00  2.20  1.30
assi (resi 39   and name HG2#) (resi 43   and name HN  )  4.00  2.20  1.30
assi (resi 39   and name HG2#) (resi 43   and name HA# )  4.00  2.20  2.30
assi (resi 39   and name HG2#) (resi 44   and name HN  )  4.00  2.20  1.30
assi (resi 39   and name HA  ) (resi 46   and name HN  )  3.00  1.20  0.60
assi (resi 39   and name HN  ) (resi 99   and name HD# )  4.00  2.20  3.40

! residue 40   Thr , intraresidue NOEs
! trivial: assi (resi 40   and name HN  ) (resi 40   and name HA  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 40   and name HB  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 40   and name HG2#)  3.00  1.20  0.90

! residue 40   Thr , NOEs forward in sequence
assi (resi 40   and name HN  ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 41   and name HN  )  3.00  1.20  0.60
assi (resi 40   and name HB  ) (resi 41   and name HN  )  3.00  1.20  0.60
assi (resi 40   and name HB  ) (resi 41   and name HG# )  4.00  2.20  3.40
assi (resi 40   and name HG1 ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HG1 ) (resi 42   and name HN  )  3.00  1.20  0.60
assi (resi 40   and name HN  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 43   and name HA# )  4.00  2.20  2.00
assi (resi 40   and name HG1 ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 44   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 44   and name HB# )  4.00  2.20  2.00
assi (resi 40   and name HG1 ) (resi 44   and name HN  )  3.00  1.20  0.60
assi (resi 40   and name HG2#) (resi 44   and name HN  )  4.00  2.20  1.30
assi (resi 40   and name HN  ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 45   and name HA  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 46   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HG2#) (resi 46   and name HN  )  4.00  2.20  1.30
assi (resi 40   and name HG2#) (resi 85   and name HN  )  4.00  2.20  1.30
assi (resi 40   and name HG2#) (resi 88   and name HN  )  4.00  2.20  1.30
assi (resi 40   and name HG2#) (resi 95   and name HN  )  4.00  2.20  1.30
assi (resi 40   and name HB  ) (resi 96   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 97   and name HA  )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 98   and name HN  )  3.00  1.20  0.60

! residue 41   Val , intraresidue NOEs
assi (resi 41   and name HN  ) (resi 41   and name HA  )  3.00  1.20  0.60
assi (resi 41   and name HN  ) (resi 41   and name HB  )  3.00  1.20  0.60
assi (resi 41   and name HN  ) (resi 41   and name HG# )  3.00  1.20  3.00
assi (resi 41   and name HA  ) (resi 41   and name HG# )  3.00  1.20  3.00
! trivial: assi (resi 41   and name HB  ) (resi 41   and name HG# )  3.00  1.20  3.00

! residue 41   Val , NOEs forward in sequence
assi (resi 41   and name HN  ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HB  ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HG# ) (resi 42   and name HN  )  4.00  2.20  3.40
assi (resi 41   and name HN  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HB  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HG# ) (resi 43   and name HN  )  4.00  2.20  3.40
assi (resi 41   and name HN  ) (resi 95   and name HB# )  4.00  2.20  2.00
assi (resi 41   and name HG# ) (resi 95   and name HB# )  3.00  1.20  4.00
assi (resi 41   and name HB  ) (resi 96   and name HN  )  3.00  1.20  0.60
assi (resi 41   and name HG# ) (resi 96   and name HN  )  4.00  2.20  3.40
assi (resi 41   and name HG# ) (resi 96   and name HB# )  4.00  2.20  4.40
assi (resi 41   and name HN  ) (resi 97   and name HA  )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 98   and name HN  )  3.00  1.20  0.60
assi (resi 41   and name HA  ) (resi 98   and name HB# )  4.00  2.20  2.00
assi (resi 41   and name HA  ) (resi 98   and name HD2#)  4.00  2.20  2.00
assi (resi 41   and name HG# ) (resi 98   and name HN  )  4.00  2.20  3.40
assi (resi 41   and name HG# ) (resi 98   and name HA  )  3.00  1.20  3.00
assi (resi 41   and name HG# ) (resi 98   and name HB# )  4.00  2.20  4.40
assi (resi 41   and name HG# ) (resi 98   and name HD2#)  4.00  2.20  4.40
assi (resi 41   and name HA  ) (resi 99   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HG# ) (resi 99   and name HN  )  4.00  2.20  3.40

! residue 42   Thr , intraresidue NOEs
assi (resi 42   and name HN  ) (resi 42   and name HA  )  3.00  1.20  0.60
assi (resi 42   and name HN  ) (resi 42   and name HB  )  3.00  1.20  0.60
assi (resi 42   and name HN  ) (resi 42   and name HG2#)  4.00  2.20  1.30

! residue 42   Thr , NOEs forward in sequence
assi (resi 42   and name HN  ) (resi 43   and name HN  )  2.50  0.70  0.20
assi (resi 42   and name HN  ) (resi 43   and name HA# )  4.00  2.20  2.00
assi (resi 42   and name HA  ) (resi 43   and name HN  )  3.00  1.20  0.60
assi (resi 42   and name HB  ) (resi 43   and name HN  )  3.00  1.20  0.60
assi (resi 42   and name HG2#) (resi 43   and name HN  )  4.00  2.20  1.30
assi (resi 42   and name HN  ) (resi 44   and name HB# )  4.00  2.20  2.00
assi (resi 42   and name HG2#) (resi 44   and name HN  )  4.00  2.20  1.30
assi (resi 42   and name HN  ) (resi 95   and name HB# )  4.00  2.20  2.00

! residue 43   Gly , intraresidue NOEs
assi (resi 43   and name HN  ) (resi 43   and name HA# )  2.50  0.70  1.20

! residue 43   Gly , NOEs forward in sequence
assi (resi 43   and name HN  ) (resi 44   and name HN  )  2.50  0.70  0.20
assi (resi 43   and name HN  ) (resi 44   and name HB# )  3.00  1.20  1.60
assi (resi 43   and name HA# ) (resi 44   and name HN  )  3.00  1.20  1.60
assi (resi 43   and name HN  ) (resi 98   and name HB# )  4.00  2.20  2.00

! residue 44   Arg , intraresidue NOEs
assi (resi 44   and name HN  ) (resi 44   and name HA  )  3.00  1.20  0.60
assi (resi 44   and name HN  ) (resi 44   and name HE  )  4.00  2.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HB# )  3.00  1.20  1.60
assi (resi 44   and name HN  ) (resi 44   and name HG# )  3.00  1.20  1.60
assi (resi 44   and name HN  ) (resi 44   and name HD# )  4.00  2.20  2.00
assi (resi 44   and name HE  ) (resi 44   and name HG# )  4.00  2.20  2.00
! trivial: assi (resi 44   and name HE  ) (resi 44   and name HD# )  3.00  1.20  1.60

! residue 44   Arg , NOEs forward in sequence
assi (resi 44   and name HN  ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 44   and name HA  ) (resi 45   and name HN  )  2.50  0.70  0.20
assi (resi 44   and name HB# ) (resi 45   and name HN  )  3.00  1.20  1.60
assi (resi 44   and name HG# ) (resi 45   and name HN  )  3.00  1.20  1.60
assi (resi 44   and name HB# ) (resi 88   and name HN  )  4.00  2.20  2.00
assi (resi 44   and name HE  ) (resi 89   and name HB# )  3.00  1.20  1.60
assi (resi 44   and name HE  ) (resi 92   and name HB  )  3.00  1.20  0.60
assi (resi 44   and name HE  ) (resi 92   and name HG# )  4.00  2.20  3.40
assi (resi 44   and name HD# ) (resi 92   and name HG# )  4.00  2.20  4.40

! residue 45   Thr , intraresidue NOEs
assi (resi 45   and name HN  ) (resi 45   and name HA  )  3.00  1.20  0.60
assi (resi 45   and name HN  ) (resi 45   and name HB  )  2.50  0.70  0.20
assi (resi 45   and name HN  ) (resi 45   and name HG2#)  4.00  2.20  1.30
assi (resi 45   and name HA  ) (resi 45   and name HG2#)  3.00  1.20  0.90
! trivial: assi (resi 45   and name HB  ) (resi 45   and name HG2#)  3.00  1.20  0.90

! residue 45   Thr , NOEs forward in sequence
assi (resi 45   and name HG2#) (resi 46   and name HN  )  3.00  1.20  0.90
assi (resi 45   and name HG2#) (resi 72   and name HD2#)  4.00  2.20  2.30
assi (resi 45   and name HN  ) (resi 87   and name HG2#)  4.00  2.20  1.30
assi (resi 45   and name HN  ) (resi 88   and name HN  )  4.00  2.20  1.00
assi (resi 45   and name HN  ) (resi 88   and name HB# )  4.00  2.20  2.00
assi (resi 45   and name HB  ) (resi 88   and name HN  )  4.00  2.20  1.00
assi (resi 45   and name HG2#) (resi 88   and name HN  )  4.00  2.20  1.30
assi (resi 45   and name HG2#) (resi 88   and name HB# )  4.00  2.20  2.30

! residue 46   Cys , intraresidue NOEs
assi (resi 46   and name HN  ) (resi 46   and name HA  )  2.50  0.70  0.20
assi (resi 46   and name HN  ) (resi 46   and name HB# )  3.00  1.20  1.60

! residue 46   Cys , NOEs forward in sequence
assi (resi 46   and name HN  ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 46   and name HB# ) (resi 47   and name HN  )  4.00  2.20  2.00
assi (resi 46   and name HN  ) (resi 72   and name HB# )  4.00  2.20  2.00
assi (resi 46   and name HN  ) (resi 72   and name HD2#)  3.00  1.20  1.60
assi (resi 46   and name HB# ) (resi 86   and name HN  )  4.00  2.20  2.00
assi (resi 46   and name HN  ) (resi 87   and name HA  )  4.00  2.20  1.00

! residue 47   Gln , intraresidue NOEs
assi (resi 47   and name HN  ) (resi 47   and name HA  )  3.00  1.20  0.60
assi (resi 47   and name HN  ) (resi 47   and name HB# )  3.00  1.20  1.60
assi (resi 47   and name HN  ) (resi 47   and name HG# )  4.00  2.20  2.00
assi (resi 47   and name HG# ) (resi 47   and name HE2#)  4.00  2.20  3.00

! residue 47   Gln , NOEs forward in sequence
assi (resi 47   and name HN  ) (resi 48   and name HN  )  4.00  2.20  1.00
assi (resi 47   and name HA  ) (resi 48   and name HN  )  2.50  0.70  0.20
assi (resi 47   and name HB# ) (resi 48   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HG# ) (resi 48   and name HN  )  3.00  1.20  1.60
assi (resi 47   and name HG# ) (resi 51   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HG# ) (resi 53   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HB# ) (resi 55   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HG# ) (resi 55   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HN  ) (resi 86   and name HN  )  4.00  2.20  1.00
assi (resi 47   and name HN  ) (resi 86   and name HB# )  4.00  2.20  2.00
assi (resi 47   and name HB# ) (resi 86   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HB# ) (resi 86   and name HD# )  3.00  1.20  3.60
assi (resi 47   and name HG# ) (resi 86   and name HD# )  4.00  2.20  4.00
assi (resi 47   and name HN  ) (resi 87   and name HN  )  4.00  2.20  1.00
assi (resi 47   and name HN  ) (resi 87   and name HA  )  3.00  1.20  0.60
assi (resi 47   and name HB# ) (resi 87   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HN  ) (resi 88   and name HN  )  4.00  2.20  1.00
assi (resi 47   and name HA  ) (resi 88   and name HN  )  3.00  1.20  0.60
assi (resi 47   and name HB# ) (resi 88   and name HN  )  3.00  1.20  1.60

! residue 48   Ser , intraresidue NOEs
assi (resi 48   and name HN  ) (resi 48   and name HA  )  3.00  1.20  0.60
assi (resi 48   and name HN  ) (resi 48   and name HB# )  3.00  1.20  1.60

! residue 48   Ser , NOEs forward in sequence
assi (resi 48   and name HA  ) (resi 49   and name HN  )  3.00  1.20  0.60
assi (resi 48   and name HA  ) (resi 49   and name HD1 )  4.00  2.20  1.00
assi (resi 48   and name HB# ) (resi 50   and name HN  )  3.00  1.20  1.60
assi (resi 48   and name HN  ) (resi 51   and name HN  )  4.00  2.20  1.00
assi (resi 48   and name HN  ) (resi 51   and name HB# )  3.00  1.20  1.60
assi (resi 48   and name HB# ) (resi 51   and name HN  )  2.50  0.70  1.20
assi (resi 48   and name HN  ) (resi 72   and name HA  )  3.00  1.20  0.60
assi (resi 48   and name HN  ) (resi 72   and name HB# )  4.00  2.20  2.00
assi (resi 48   and name HA  ) (resi 72   and name HN  )  4.00  2.20  1.00
assi (resi 48   and name HA  ) (resi 73   and name HN  )  4.00  2.20  1.00

! residue 49   Trp , intraresidue NOEs
assi (resi 49   and name HN  ) (resi 49   and name HA  )  3.00  1.20  0.60
assi (resi 49   and name HN  ) (resi 49   and name HD1 )  3.00  1.20  0.60
assi (resi 49   and name HN  ) (resi 49   and name HE1 )  4.00  2.20  1.00
assi (resi 49   and name HN  ) (resi 49   and name HB# )  3.00  1.20  1.60
! trivial: assi (resi 49   and name HD1 ) (resi 49   and name HE1 )  3.00  1.20  0.60
assi (resi 49   and name HD1 ) (resi 49   and name HE3 )  4.00  2.20  1.00
assi (resi 49   and name HD1 ) (resi 49   and name HZ2 )  4.00  2.20  1.00
assi (resi 49   and name HD1 ) (resi 49   and name HB# )  4.00  2.20  2.00
assi (resi 49   and name HE1 ) (resi 49   and name HE3 )  4.00  2.20  1.00
! trivial: assi (resi 49   and name HE1 ) (resi 49   and name HZ2 )  3.00  1.20  0.60
assi (resi 49   and name HE1 ) (resi 49   and name HB# )  4.00  2.20  2.00
! trivial: assi (resi 49   and name HZ2 ) (resi 49   and name HH2 )  4.00  2.20  1.00

! residue 49   Trp , NOEs forward in sequence
assi (resi 49   and name HN  ) (resi 50   and name HB# )  3.00  1.20  1.60
assi (resi 49   and name HA  ) (resi 50   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HB# ) (resi 50   and name HN  )  3.00  1.20  1.60
assi (resi 49   and name HA  ) (resi 51   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HE1 ) (resi 69   and name HA  )  4.00  2.20  1.00
assi (resi 49   and name HE1 ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 49   and name HB# ) (resi 69   and name HD# )  4.00  2.20  4.40
assi (resi 49   and name HE1 ) (resi 70   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HN  ) (resi 72   and name HA  )  3.00  1.20  0.60
assi (resi 49   and name HN  ) (resi 72   and name HB# )  4.00  2.20  2.00
assi (resi 49   and name HE1 ) (resi 72   and name HA  )  4.00  2.20  1.00
assi (resi 49   and name HD1 ) (resi 73   and name HN  )  3.00  1.20  0.60
assi (resi 49   and name HD1 ) (resi 73   and name HB# )  4.00  2.20  2.00
assi (resi 49   and name HE1 ) (resi 73   and name HN  )  3.00  1.20  0.60
assi (resi 49   and name HE1 ) (resi 73   and name HB# )  4.00  2.20  2.00
assi (resi 49   and name HE1 ) (resi 74   and name HA  )  4.00  2.20  1.00
assi (resi 49   and name HE1 ) (resi 75   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HE1 ) (resi 75   and name HB# )  3.00  1.20  1.60
assi (resi 49   and name HE1 ) (resi 75   and name HG# )  4.00  2.20  2.00
assi (resi 49   and name HZ2 ) (resi 75   and name HN  )  3.00  1.20  0.60
assi (resi 49   and name HH2 ) (resi 75   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HH2 ) (resi 84   and name HZ2 )  4.00  2.20  1.00
assi (resi 49   and name HH2 ) (resi 86   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HB# ) (resi 86   and name HD# )  3.00  1.20  3.60

! residue 50   Ser , intraresidue NOEs
assi (resi 50   and name HN  ) (resi 50   and name HA  )  3.00  1.20  0.60
assi (resi 50   and name HN  ) (resi 50   and name HB# )  3.00  1.20  1.60

! residue 50   Ser , NOEs forward in sequence
assi (resi 50   and name HN  ) (resi 51   and name HN  )  3.00  1.20  0.60
assi (resi 50   and name HA  ) (resi 51   and name HN  )  3.00  1.20  0.60
assi (resi 50   and name HB# ) (resi 51   and name HN  )  3.00  1.20  1.60
assi (resi 50   and name HN  ) (resi 60   and name HB  )  4.00  2.20  1.00

! residue 51   Ser , intraresidue NOEs
assi (resi 51   and name HN  ) (resi 51   and name HA  )  3.00  1.20  0.60
assi (resi 51   and name HN  ) (resi 51   and name HB# )  3.00  1.20  1.60

! residue 51   Ser , NOEs forward in sequence
assi (resi 51   and name HN  ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HN  ) (resi 52   and name HE# )  4.00  2.20  1.30
assi (resi 51   and name HA  ) (resi 52   and name HN  )  2.50  0.70  0.20
assi (resi 51   and name HB# ) (resi 52   and name HN  )  4.00  2.20  2.00
assi (resi 51   and name HA  ) (resi 53   and name HN  )  3.00  1.20  0.60
assi (resi 51   and name HB# ) (resi 53   and name HN  )  3.00  1.20  1.60

! residue 52   Met , intraresidue NOEs
assi (resi 52   and name HN  ) (resi 52   and name HA  )  3.00  1.20  0.60
assi (resi 52   and name HN  ) (resi 52   and name HE# )  4.00  2.20  1.30
assi (resi 52   and name HN  ) (resi 52   and name HB# )  3.00  1.20  1.60
assi (resi 52   and name HN  ) (resi 52   and name HG# )  3.00  1.20  1.60

! residue 52   Met , NOEs forward in sequence
assi (resi 52   and name HN  ) (resi 53   and name HN  )  3.00  1.20  0.60
assi (resi 52   and name HN  ) (resi 53   and name HG2#)  4.00  2.20  1.30
assi (resi 52   and name HA  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 52   and name HA  ) (resi 56   and name HN  )  4.00  2.20  1.00
assi (resi 52   and name HA  ) (resi 56   and name HE1 )  4.00  2.20  1.00
assi (resi 52   and name HE# ) (resi 56   and name HD1 )  4.00  2.20  1.30
assi (resi 52   and name HE# ) (resi 56   and name HE1 )  4.00  2.20  1.30
assi (resi 52   and name HE# ) (resi 56   and name HZ3 )  4.00  2.20  1.30
assi (resi 52   and name HB# ) (resi 56   and name HD1 )  4.00  2.20  2.00
assi (resi 52   and name HB# ) (resi 56   and name HE1 )  4.00  2.20  2.00
assi (resi 52   and name HB# ) (resi 56   and name HH2 )  4.00  2.20  2.00
assi (resi 52   and name HG# ) (resi 56   and name HD1 )  4.00  2.20  2.00
assi (resi 52   and name HG# ) (resi 56   and name HE1 )  4.00  2.20  2.00
assi (resi 52   and name HA  ) (resi 57   and name HN  )  4.00  2.20  1.00
assi (resi 52   and name HE# ) (resi 57   and name HN  )  4.00  2.20  1.30
assi (resi 52   and name HE# ) (resi 57   and name HE1 )  4.00  2.20  1.30
assi (resi 52   and name HB# ) (resi 57   and name HN  )  4.00  2.20  2.00
assi (resi 52   and name HG# ) (resi 57   and name HN  )  4.00  2.20  2.00

! residue 53   Thr , intraresidue NOEs
assi (resi 53   and name HN  ) (resi 53   and name HA  )  3.00  1.20  0.60
assi (resi 53   and name HN  ) (resi 53   and name HB  )  3.00  1.20  0.60
assi (resi 53   and name HN  ) (resi 53   and name HG2#)  4.00  2.20  1.30

! residue 53   Thr , NOEs forward in sequence
assi (resi 53   and name HN  ) (resi 55   and name HN  )  4.00  2.20  1.00

! residue 54   Pro , intraresidue NOEs

! residue 54   Pro , NOEs forward in sequence
assi (resi 54   and name HA  ) (resi 55   and name HN  )  3.00  1.20  0.60
assi (resi 54   and name HB# ) (resi 55   and name HN  )  4.00  2.20  2.00
assi (resi 54   and name HG# ) (resi 55   and name HN  )  4.00  2.20  2.00
assi (resi 54   and name HD# ) (resi 55   and name HN  )  4.00  2.20  2.00
assi (resi 54   and name HG# ) (resi 89   and name HN  )  4.00  2.20  2.00

! residue 55   His , intraresidue NOEs
assi (resi 55   and name HN  ) (resi 55   and name HA  )  3.00  1.20  0.60
assi (resi 55   and name HN  ) (resi 55   and name HE1 )  3.00  1.20  0.60
assi (resi 55   and name HN  ) (resi 55   and name HB# )  3.00  1.20  1.60

! residue 55   His , NOEs forward in sequence
assi (resi 55   and name HA  ) (resi 56   and name HN  )  3.00  1.20  0.60
assi (resi 55   and name HB# ) (resi 56   and name HN  )  4.00  2.20  2.00
assi (resi 55   and name HE1 ) (resi 87   and name HN  )  3.00  1.20  0.60
assi (resi 55   and name HE1 ) (resi 89   and name HN  )  3.00  1.20  0.60

! residue 56   Trp , intraresidue NOEs
! trivial: assi (resi 56   and name HN  ) (resi 56   and name HA  )  4.00  2.20  1.00
assi (resi 56   and name HN  ) (resi 56   and name HB# )  3.00  1.20  1.60
assi (resi 56   and name HA  ) (resi 56   and name HD1 )  4.00  2.20  1.00
assi (resi 56   and name HA  ) (resi 56   and name HE1 )  4.00  2.20  1.00
! trivial: assi (resi 56   and name HD1 ) (resi 56   and name HE1 )  2.50  0.70  0.20
assi (resi 56   and name HD1 ) (resi 56   and name HE3 )  4.00  2.20  1.00
assi (resi 56   and name HD1 ) (resi 56   and name HZ2 )  4.00  2.20  1.00
assi (resi 56   and name HD1 ) (resi 56   and name HB# )  4.00  2.20  2.00
! trivial: assi (resi 56   and name HE1 ) (resi 56   and name HZ2 )  2.50  0.70  0.20
assi (resi 56   and name HE1 ) (resi 56   and name HB# )  4.00  2.20  2.00
! trivial: assi (resi 56   and name HZ2 ) (resi 56   and name HH2 )  3.00  1.20  0.60
! trivial: assi (resi 56   and name HZ3 ) (resi 56   and name HH2 )  3.00  1.20  0.60

! residue 56   Trp , NOEs forward in sequence
assi (resi 56   and name HN  ) (resi 57   and name HN  )  4.00  2.20  1.00
assi (resi 56   and name HA  ) (resi 57   and name HN  )  2.50  0.70  0.20
assi (resi 56   and name HE1 ) (resi 57   and name HA  )  4.00  2.20  1.00
assi (resi 56   and name HB# ) (resi 57   and name HN  )  3.00  1.20  1.60

! residue 57   His , intraresidue NOEs
assi (resi 57   and name HN  ) (resi 57   and name HA  )  3.00  1.20  0.60
assi (resi 57   and name HN  ) (resi 57   and name HB# )  4.00  2.20  2.00

! residue 57   His , NOEs forward in sequence
assi (resi 57   and name HN  ) (resi 58   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HB# ) (resi 58   and name HN  )  4.00  2.20  2.00
assi (resi 57   and name HE1 ) (resi 60   and name HG2#)  4.00  2.20  1.30

! residue 58   Gln , intraresidue NOEs
assi (resi 58   and name HN  ) (resi 58   and name HA  )  3.00  1.20  0.60
assi (resi 58   and name HN  ) (resi 58   and name HB# )  4.00  2.20  2.00
assi (resi 58   and name HN  ) (resi 58   and name HG# )  3.00  1.20  1.60
assi (resi 58   and name HA  ) (resi 58   and name HE2#)  4.00  2.20  2.00
assi (resi 58   and name HB# ) (resi 58   and name HE2#)  4.00  2.20  3.00
assi (resi 58   and name HG# ) (resi 58   and name HE2#)  3.00  1.20  2.60

! residue 58   Gln , NOEs forward in sequence
assi (resi 58   and name HA  ) (resi 60   and name HG2#)  4.00  2.20  1.30

! residue 59   Arg , intraresidue NOEs

! residue 59   Arg , NOEs forward in sequence

! residue 60   Thr , intraresidue NOEs
assi (resi 60   and name HA  ) (resi 60   and name HG2#)  4.00  2.20  1.30
! trivial: assi (resi 60   and name HB  ) (resi 60   and name HG2#)  3.00  1.20  0.90

! residue 60   Thr , NOEs forward in sequence
assi (resi 60   and name HA  ) (resi 61   and name HN  )  3.00  1.20  0.60
assi (resi 60   and name HA  ) (resi 61   and name HG2#)  4.00  2.20  1.30
assi (resi 60   and name HB  ) (resi 61   and name HN  )  3.00  1.20  0.60
assi (resi 60   and name HG2#) (resi 61   and name HN  )  4.00  2.20  1.30
assi (resi 60   and name HA  ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 60   and name HB  ) (resi 62   and name HN  )  3.00  1.20  0.60
assi (resi 60   and name HG2#) (resi 62   and name HN  )  4.00  2.20  1.30
assi (resi 60   and name HG2#) (resi 63   and name HD# )  4.00  2.20  3.30
assi (resi 60   and name HG2#) (resi 64   and name HN  )  4.00  2.20  1.30
assi (resi 60   and name HA  ) (resi 69   and name HD# )  4.00  2.20  3.40

! residue 61   Thr , intraresidue NOEs
assi (resi 61   and name HN  ) (resi 61   and name HA  )  3.00  1.20  0.60
assi (resi 61   and name HN  ) (resi 61   and name HB  )  3.00  1.20  0.60
assi (resi 61   and name HN  ) (resi 61   and name HG2#)  4.00  2.20  1.30
assi (resi 61   and name HA  ) (resi 61   and name HG2#)  3.00  1.20  0.90
! trivial: assi (resi 61   and name HB  ) (resi 61   and name HG2#)  3.00  1.20  0.90

! residue 61   Thr , NOEs forward in sequence
assi (resi 61   and name HN  ) (resi 62   and name HN  )  3.00  1.20  0.60
assi (resi 61   and name HN  ) (resi 62   and name HB# )  4.00  2.20  2.00
assi (resi 61   and name HA  ) (resi 62   and name HN  )  3.00  1.20  0.60
assi (resi 61   and name HG2#) (resi 62   and name HN  )  4.00  2.20  1.30
assi (resi 61   and name HG2#) (resi 64   and name HN  )  4.00  2.20  1.30
assi (resi 61   and name HG2#) (resi 67   and name HN  )  4.00  2.20  1.30
assi (resi 61   and name HN  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 61   and name HA  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 61   and name HG2#) (resi 69   and name HN  )  4.00  2.20  1.30
assi (resi 61   and name HG2#) (resi 69   and name HB# )  4.00  2.20  2.30
assi (resi 61   and name HG2#) (resi 69   and name HD# )  4.00  2.20  3.70

! residue 62   Glu , intraresidue NOEs
assi (resi 62   and name HN  ) (resi 62   and name HA  )  2.50  0.70  0.20
assi (resi 62   and name HN  ) (resi 62   and name HB# )  3.00  1.20  1.60
assi (resi 62   and name HN  ) (resi 62   and name HG# )  3.00  1.20  1.60

! residue 62   Glu , NOEs forward in sequence
assi (resi 62   and name HN  ) (resi 63   and name HN  )  3.00  1.20  0.60
assi (resi 62   and name HN  ) (resi 63   and name HA  )  4.00  2.20  1.00
assi (resi 62   and name HN  ) (resi 63   and name HB# )  4.00  2.20  2.00
assi (resi 62   and name HA  ) (resi 63   and name HN  )  3.00  1.20  0.60
assi (resi 62   and name HB# ) (resi 63   and name HN  )  3.00  1.20  1.60
assi (resi 62   and name HG# ) (resi 63   and name HD# )  4.00  2.20  4.00
assi (resi 62   and name HG# ) (resi 63   and name HE# )  4.00  2.20  4.00
assi (resi 62   and name HN  ) (resi 64   and name HN  )  4.00  2.20  1.00
assi (resi 62   and name HA  ) (resi 64   and name HN  )  3.00  1.20  0.60
assi (resi 62   and name HB# ) (resi 64   and name HN  )  4.00  2.20  2.00

! residue 63   Tyr , intraresidue NOEs
assi (resi 63   and name HN  ) (resi 63   and name HA  )  3.00  1.20  0.60
assi (resi 63   and name HN  ) (resi 63   and name HB# )  3.00  1.20  1.60
assi (resi 63   and name HN  ) (resi 63   and name HD# )  3.00  1.20  2.60
assi (resi 63   and name HA  ) (resi 63   and name HD# )  3.00  1.20  2.60
assi (resi 63   and name HA  ) (resi 63   and name HE# )  4.00  2.20  3.00
assi (resi 63   and name HB# ) (resi 63   and name HD# )  3.00  1.20  3.60
assi (resi 63   and name HB# ) (resi 63   and name HE# )  4.00  2.20  4.00
! trivial: assi (resi 63   and name HD# ) (resi 63   and name HE# )  2.50  0.70  4.20

! residue 63   Tyr , NOEs forward in sequence
assi (resi 63   and name HN  ) (resi 64   and name HN  )  3.00  1.20  0.60
assi (resi 63   and name HN  ) (resi 64   and name HB# )  4.00  2.20  2.00
assi (resi 63   and name HN  ) (resi 64   and name HD# )  3.00  1.20  2.60
assi (resi 63   and name HA  ) (resi 64   and name HN  )  3.00  1.20  0.60
assi (resi 63   and name HB# ) (resi 64   and name HN  )  3.00  1.20  1.60
assi (resi 63   and name HB# ) (resi 64   and name HD# )  4.00  2.20  4.00
assi (resi 63   and name HB# ) (resi 64   and name HE# )  4.00  2.20  4.00

! residue 64   Tyr , intraresidue NOEs
assi (resi 64   and name HN  ) (resi 64   and name HA  )  3.00  1.20  0.60
assi (resi 64   and name HN  ) (resi 64   and name HB# )  3.00  1.20  1.60
assi (resi 64   and name HN  ) (resi 64   and name HD# )  3.00  1.20  2.60
assi (resi 64   and name HA  ) (resi 64   and name HD# )  4.00  2.20  3.00
assi (resi 64   and name HB# ) (resi 64   and name HD# )  4.00  2.20  4.00
! trivial: assi (resi 64   and name HD# ) (resi 64   and name HE# )  3.00  1.20  4.60

! residue 64   Tyr , NOEs forward in sequence
assi (resi 64   and name HN  ) (resi 65   and name HA  )  4.00  2.20  1.00
assi (resi 64   and name HN  ) (resi 65   and name HD# )  4.00  2.20  2.00
assi (resi 64   and name HA  ) (resi 66   and name HN  )  3.00  1.20  0.60
assi (resi 64   and name HA  ) (resi 67   and name HN  )  4.00  2.20  1.00
assi (resi 64   and name HB# ) (resi 67   and name HN  )  4.00  2.20  2.00
assi (resi 64   and name HD# ) (resi 67   and name HN  )  4.00  2.20  3.00
assi (resi 64   and name HN  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 64   and name HB# ) (resi 69   and name HD# )  4.00  2.20  4.40
assi (resi 64   and name HD# ) (resi 69   and name HD# )  4.00  2.20  5.40

! residue 65   Pro , intraresidue NOEs

! residue 65   Pro , NOEs forward in sequence
assi (resi 65   and name HA  ) (resi 66   and name HN  )  4.00  2.20  1.00
assi (resi 65   and name HB# ) (resi 66   and name HN  )  4.00  2.20  2.00
assi (resi 65   and name HG# ) (resi 66   and name HN  )  4.00  2.20  2.00
assi (resi 65   and name HD# ) (resi 66   and name HN  )  4.00  2.20  2.00
assi (resi 65   and name HA  ) (resi 67   and name HN  )  4.00  2.20  1.00

! residue 66   Asn , intraresidue NOEs
assi (resi 66   and name HN  ) (resi 66   and name HA  )  3.00  1.20  0.60
assi (resi 66   and name HN  ) (resi 66   and name HB# )  3.00  1.20  1.60
! trivial: assi (resi 66   and name HA  ) (resi 66   and name HB# )  3.00  1.20  1.60
assi (resi 66   and name HA  ) (resi 66   and name HD2#)  4.00  2.20  2.00
assi (resi 66   and name HB# ) (resi 66   and name HD2#)  4.00  2.20  3.00

! residue 66   Asn , NOEs forward in sequence
assi (resi 66   and name HN  ) (resi 67   and name HN  )  3.00  1.20  0.60
assi (resi 66   and name HA  ) (resi 67   and name HN  )  3.00  1.20  0.60
assi (resi 66   and name HB# ) (resi 67   and name HN  )  4.00  2.20  2.00
assi (resi 66   and name HA  ) (resi 68   and name HN  )  4.00  2.20  1.00

! residue 67   Gly , intraresidue NOEs
! trivial: assi (resi 67   and name HN  ) (resi 67   and name HA# )  3.00  1.20  1.60

! residue 67   Gly , NOEs forward in sequence
assi (resi 67   and name HN  ) (resi 68   and name HN  )  3.00  1.20  0.60
assi (resi 67   and name HN  ) (resi 68   and name HA# )  4.00  2.20  2.00
assi (resi 67   and name HA# ) (resi 68   and name HN  )  3.00  1.20  1.60
assi (resi 67   and name HN  ) (resi 69   and name HN  )  4.00  2.20  1.00
assi (resi 67   and name HN  ) (resi 69   and name HG  )  4.00  2.20  1.00
assi (resi 67   and name HN  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 67   and name HA# ) (resi 69   and name HN  )  4.00  2.20  2.00
assi (resi 67   and name HA# ) (resi 69   and name HB# )  3.00  1.20  2.60
assi (resi 67   and name HA# ) (resi 69   and name HD# )  4.00  2.20  4.40

! residue 68   Gly , intraresidue NOEs
assi (resi 68   and name HN  ) (resi 68   and name HA# )  2.50  0.70  1.20

! residue 68   Gly , NOEs forward in sequence
assi (resi 68   and name HN  ) (resi 69   and name HN  )  3.00  1.20  0.60
assi (resi 68   and name HN  ) (resi 69   and name HA  )  4.00  2.20  1.00
assi (resi 68   and name HN  ) (resi 69   and name HG  )  4.00  2.20  1.00
assi (resi 68   and name HN  ) (resi 69   and name HB# )  4.00  2.20  2.00
assi (resi 68   and name HN  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 68   and name HA# ) (resi 69   and name HN  )  3.00  1.20  1.60
assi (resi 68   and name HA# ) (resi 69   and name HD# )  4.00  2.20  4.40
assi (resi 68   and name HN  ) (resi 70   and name HN  )  4.00  2.20  1.00
assi (resi 68   and name HA# ) (resi 70   and name HN  )  4.00  2.20  2.00
assi (resi 68   and name HA# ) (resi 75   and name HE  )  3.00  1.20  1.60

! residue 69   Leu , intraresidue NOEs
assi (resi 69   and name HN  ) (resi 69   and name HA  )  3.00  1.20  0.60
assi (resi 69   and name HN  ) (resi 69   and name HG  )  3.00  1.20  0.60
assi (resi 69   and name HN  ) (resi 69   and name HB# )  3.00  1.20  1.60
assi (resi 69   and name HN  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 69   and name HA  ) (resi 69   and name HG  )  4.00  2.20  1.00
assi (resi 69   and name HA  ) (resi 69   and name HD# )  4.00  2.20  3.40
! trivial: assi (resi 69   and name HG  ) (resi 69   and name HD# )  4.00  2.20  3.40
assi (resi 69   and name HB# ) (resi 69   and name HD# )  4.00  2.20  4.40
! trivial: assi (resi 69   and name HD# ) (resi 69   and name HD# )  4.00  2.20  5.80

! residue 69   Leu , NOEs forward in sequence
assi (resi 69   and name HN  ) (resi 70   and name HN  )  3.00  1.20  0.60
assi (resi 69   and name HG  ) (resi 70   and name HN  )  4.00  2.20  1.00
assi (resi 69   and name HB# ) (resi 70   and name HN  )  4.00  2.20  2.00
assi (resi 69   and name HD# ) (resi 70   and name HN  )  4.00  2.20  3.40
assi (resi 69   and name HD# ) (resi 74   and name HN  )  4.00  2.20  3.40
assi (resi 69   and name HN  ) (resi 75   and name HB# )  4.00  2.20  2.00
assi (resi 69   and name HA  ) (resi 75   and name HE  )  4.00  2.20  1.00
assi (resi 69   and name HA  ) (resi 75   and name HB# )  4.00  2.20  2.00
assi (resi 69   and name HD# ) (resi 75   and name HN  )  4.00  2.20  3.40
assi (resi 69   and name HD# ) (resi 75   and name HE  )  4.00  2.20  3.40
assi (resi 69   and name HD# ) (resi 75   and name HB# )  4.00  2.20  4.40
assi (resi 69   and name HD# ) (resi 75   and name HG# )  4.00  2.20  4.40
assi (resi 69   and name HD# ) (resi 76   and name HN  )  4.00  2.20  3.40

! residue 70   Thr , intraresidue NOEs
assi (resi 70   and name HN  ) (resi 70   and name HA  )  3.00  1.20  0.60
assi (resi 70   and name HN  ) (resi 70   and name HB  )  3.00  1.20  0.60
assi (resi 70   and name HN  ) (resi 70   and name HG2#)  4.00  2.20  1.30
assi (resi 70   and name HA  ) (resi 70   and name HG2#)  3.00  1.20  0.90
! trivial: assi (resi 70   and name HB  ) (resi 70   and name HG2#)  4.00  2.20  1.30

! residue 70   Thr , NOEs forward in sequence
assi (resi 70   and name HN  ) (resi 71   and name HN  )  4.00  2.20  1.00
assi (resi 70   and name HA  ) (resi 71   and name HN  )  2.50  0.70  0.20
assi (resi 70   and name HB  ) (resi 71   and name HN  )  4.00  2.20  1.00
assi (resi 70   and name HG2#) (resi 71   and name HD# )  4.00  2.20  2.30
assi (resi 70   and name HN  ) (resi 73   and name HB# )  4.00  2.20  2.00
assi (resi 70   and name HN  ) (resi 73   and name HD# )  4.00  2.20  3.00
assi (resi 70   and name HG2#) (resi 73   and name HB# )  4.00  2.20  2.30
assi (resi 70   and name HG2#) (resi 73   and name HD# )  4.00  2.20  3.30
assi (resi 70   and name HN  ) (resi 75   and name HE  )  4.00  2.20  1.00
assi (resi 70   and name HN  ) (resi 75   and name HG# )  4.00  2.20  2.00

! residue 71   Arg , intraresidue NOEs
assi (resi 71   and name HN  ) (resi 71   and name HA  )  2.50  0.70  0.20
assi (resi 71   and name HN  ) (resi 71   and name HB# )  3.00  1.20  1.60
assi (resi 71   and name HN  ) (resi 71   and name HG# )  3.00  1.20  1.60
assi (resi 71   and name HN  ) (resi 71   and name HD# )  4.00  2.20  2.00
assi (resi 71   and name HA  ) (resi 71   and name HD# )  3.00  1.20  1.60
assi (resi 71   and name HB# ) (resi 71   and name HD# )  3.00  1.20  2.60

! residue 71   Arg , NOEs forward in sequence
assi (resi 71   and name HN  ) (resi 72   and name HN  )  4.00  2.20  1.00
assi (resi 71   and name HA  ) (resi 72   and name HN  )  3.00  1.20  0.60
assi (resi 71   and name HB# ) (resi 72   and name HN  )  2.50  0.70  1.20
assi (resi 71   and name HG# ) (resi 72   and name HN  )  3.00  1.20  1.60
assi (resi 71   and name HD# ) (resi 72   and name HN  )  3.00  1.20  1.60
assi (resi 71   and name HA  ) (resi 73   and name HN  )  4.00  2.20  1.00
assi (resi 71   and name HB# ) (resi 73   and name HN  )  3.00  1.20  1.60
assi (resi 71   and name HG# ) (resi 73   and name HN  )  4.00  2.20  2.00
assi (resi 71   and name HD# ) (resi 73   and name HN  )  4.00  2.20  2.00

! residue 72   Asn , intraresidue NOEs
assi (resi 72   and name HN  ) (resi 72   and name HA  )  3.00  1.20  0.60
assi (resi 72   and name HN  ) (resi 72   and name HB# )  4.00  2.20  2.00
assi (resi 72   and name HN  ) (resi 72   and name HD2#)  3.00  1.20  1.60
assi (resi 72   and name HA  ) (resi 72   and name HD2#)  4.00  2.20  2.00
assi (resi 72   and name HB# ) (resi 72   and name HD2#)  4.00  2.20  3.00

! residue 72   Asn , NOEs forward in sequence
assi (resi 72   and name HN  ) (resi 73   and name HN  )  3.00  1.20  0.60
assi (resi 72   and name HA  ) (resi 73   and name HN  )  3.00  1.20  0.60
assi (resi 72   and name HB# ) (resi 73   and name HN  )  4.00  2.20  2.00
assi (resi 72   and name HD2#) (resi 73   and name HN  )  3.00  1.20  1.60
assi (resi 72   and name HD2#) (resi 74   and name HN  )  3.00  1.20  1.60

! residue 73   Tyr , intraresidue NOEs
assi (resi 73   and name HN  ) (resi 73   and name HA  )  3.00  1.20  0.60
assi (resi 73   and name HN  ) (resi 73   and name HB# )  3.00  1.20  1.60
assi (resi 73   and name HN  ) (resi 73   and name HD# )  3.00  1.20  2.60
assi (resi 73   and name HN  ) (resi 73   and name HE# )  4.00  2.20  3.00
assi (resi 73   and name HB# ) (resi 73   and name HD# )  3.00  1.20  3.60
! trivial: assi (resi 73   and name HD# ) (resi 73   and name HE# )  2.50  0.70  4.20

! residue 73   Tyr , NOEs forward in sequence
assi (resi 73   and name HN  ) (resi 74   and name HN  )  4.00  2.20  1.00
assi (resi 73   and name HA  ) (resi 74   and name HN  )  3.00  1.20  0.60
assi (resi 73   and name HB# ) (resi 74   and name HN  )  3.00  1.20  1.60

! residue 74   Cys , intraresidue NOEs
assi (resi 74   and name HN  ) (resi 74   and name HA  )  3.00  1.20  0.60
assi (resi 74   and name HN  ) (resi 74   and name HB# )  3.00  1.20  1.60

! residue 74   Cys , NOEs forward in sequence
assi (resi 74   and name HA  ) (resi 75   and name HN  )  3.00  1.20  0.60
assi (resi 74   and name HB# ) (resi 75   and name HN  )  4.00  2.20  2.00
assi (resi 74   and name HA  ) (resi 84   and name HN  )  4.00  2.20  1.00
assi (resi 74   and name HB# ) (resi 99   and name HD# )  4.00  2.20  4.40

! residue 75   Arg , intraresidue NOEs
! trivial: assi (resi 75   and name HN  ) (resi 75   and name HA  )  4.00  2.20  1.00
assi (resi 75   and name HN  ) (resi 75   and name HB# )  4.00  2.20  2.00
assi (resi 75   and name HN  ) (resi 75   and name HG# )  4.00  2.20  2.00
assi (resi 75   and name HE  ) (resi 75   and name HG# )  4.00  2.20  2.00
! trivial: assi (resi 75   and name HE  ) (resi 75   and name HD# )  3.00  1.20  1.60

! residue 75   Arg , NOEs forward in sequence
assi (resi 75   and name HN  ) (resi 84   and name HN  )  4.00  2.20  1.00
assi (resi 75   and name HN  ) (resi 85   and name HB# )  4.00  2.20  2.00

! residue 76   Asn , intraresidue NOEs
assi (resi 76   and name HN  ) (resi 76   and name HA  )  3.00  1.20  0.60
assi (resi 76   and name HN  ) (resi 76   and name HB# )  3.00  1.20  1.60
assi (resi 76   and name HB# ) (resi 76   and name HD2#)  4.00  2.20  3.00

! residue 76   Asn , NOEs forward in sequence
assi (resi 76   and name HN  ) (resi 77   and name HD# )  4.00  2.20  2.00
assi (resi 76   and name HN  ) (resi 78   and name HN  )  4.00  2.20  1.00
assi (resi 76   and name HA  ) (resi 78   and name HN  )  4.00  2.20  1.00
assi (resi 76   and name HB# ) (resi 78   and name HN  )  4.00  2.20  2.00
assi (resi 76   and name HD2#) (resi 78   and name HN  )  4.00  2.20  2.00
assi (resi 76   and name HD2#) (resi 79   and name HN  )  3.00  1.20  1.60
assi (resi 76   and name HD2#) (resi 79   and name HA  )  4.00  2.20  2.00
assi (resi 76   and name HD2#) (resi 80   and name HN  )  3.00  1.20  1.60
assi (resi 76   and name HB# ) (resi 84   and name HN  )  3.00  1.20  1.60

! residue 77   Pro , intraresidue NOEs

! residue 77   Pro , NOEs forward in sequence
assi (resi 77   and name HD# ) (resi 78   and name HN  )  4.00  2.20  2.00

! residue 78   Asp , intraresidue NOEs
assi (resi 78   and name HN  ) (resi 78   and name HA  )  3.00  1.20  0.60
assi (resi 78   and name HN  ) (resi 78   and name HB# )  4.00  2.20  2.00

! residue 78   Asp , NOEs forward in sequence
assi (resi 78   and name HN  ) (resi 79   and name HN  )  3.00  1.20  0.60
assi (resi 78   and name HN  ) (resi 79   and name HB# )  4.00  2.20  1.30
assi (resi 78   and name HA  ) (resi 79   and name HN  )  3.00  1.20  0.60
assi (resi 78   and name HN  ) (resi 80   and name HN  )  4.00  2.20  1.00
assi (resi 78   and name HN  ) (resi 84   and name HE1 )  4.00  2.20  1.00
assi (resi 78   and name HN  ) (resi 84   and name HZ2 )  4.00  2.20  1.00

! residue 79   Ala , intraresidue NOEs
assi (resi 79   and name HN  ) (resi 79   and name HA  )  2.50  0.70  0.20
assi (resi 79   and name HN  ) (resi 79   and name HB# )  4.00  2.20  1.30
! trivial: assi (resi 79   and name HA  ) (resi 79   and name HB# )  3.00  1.20  0.90

! residue 79   Ala , NOEs forward in sequence
assi (resi 79   and name HN  ) (resi 80   and name HN  )  3.00  1.20  0.60
assi (resi 79   and name HA  ) (resi 80   and name HN  )  3.00  1.20  0.60
assi (resi 79   and name HB# ) (resi 80   and name HN  )  4.00  2.20  1.30

! residue 80   Glu , intraresidue NOEs
assi (resi 80   and name HN  ) (resi 80   and name HA  )  3.00  1.20  0.60
assi (resi 80   and name HN  ) (resi 80   and name HB# )  3.00  1.20  1.60
assi (resi 80   and name HN  ) (resi 80   and name HG# )  3.00  1.20  1.60

! residue 80   Glu , NOEs forward in sequence
assi (resi 80   and name HA  ) (resi 81   and name HN  )  3.00  1.20  0.60
assi (resi 80   and name HA  ) (resi 81   and name HG2#)  4.00  2.20  1.30
assi (resi 80   and name HB# ) (resi 81   and name HN  )  4.00  2.20  2.00
assi (resi 80   and name HG# ) (resi 81   and name HN  )  3.00  1.20  1.60
assi (resi 80   and name HA  ) (resi 82   and name HN  )  4.00  2.20  1.00
assi (resi 80   and name HB# ) (resi 82   and name HN  )  3.00  1.20  1.60
assi (resi 80   and name HG# ) (resi 82   and name HN  )  3.00  1.20  1.60
assi (resi 80   and name HN  ) (resi 84   and name HD1 )  4.00  2.20  1.00
assi (resi 80   and name HN  ) (resi 84   and name HE1 )  4.00  2.20  1.00
assi (resi 80   and name HB# ) (resi 84   and name HD1 )  4.00  2.20  2.00
assi (resi 80   and name HB# ) (resi 84   and name HE1 )  4.00  2.20  2.00
assi (resi 80   and name HG# ) (resi 84   and name HD1 )  4.00  2.20  2.00

! residue 81   Ile , intraresidue NOEs
assi (resi 81   and name HN  ) (resi 81   and name HA  )  3.00  1.20  0.60
assi (resi 81   and name HN  ) (resi 81   and name HB  )  3.00  1.20  0.60
assi (resi 81   and name HN  ) (resi 81   and name HG2#)  4.00  2.20  1.30
assi (resi 81   and name HN  ) (resi 81   and name HD1#)  4.00  2.20  1.30
assi (resi 81   and name HN  ) (resi 81   and name HG1#)  3.00  1.20  1.60
assi (resi 81   and name HA  ) (resi 81   and name HG2#)  3.00  1.20  0.90
assi (resi 81   and name HA  ) (resi 81   and name HD1#)  4.00  2.20  1.30
! trivial: assi (resi 81   and name HB  ) (resi 81   and name HG2#)  3.00  1.20  0.90
assi (resi 81   and name HB  ) (resi 81   and name HD1#)  3.00  1.20  0.90
assi (resi 81   and name HG2#) (resi 81   and name HD1#)  3.00  1.20  1.20
assi (resi 81   and name HG2#) (resi 81   and name HG1#)  4.00  2.20  2.30
! trivial: assi (resi 81   and name HD1#) (resi 81   and name HG1#)  3.00  1.20  1.90

! residue 81   Ile , NOEs forward in sequence
assi (resi 81   and name HN  ) (resi 82   and name HN  )  3.00  1.20  0.60
assi (resi 81   and name HA  ) (resi 82   and name HN  )  4.00  2.20  1.00
assi (resi 81   and name HB  ) (resi 82   and name HN  )  3.00  1.20  0.60
assi (resi 81   and name HG2#) (resi 82   and name HN  )  4.00  2.20  1.30
assi (resi 81   and name HD1#) (resi 82   and name HN  )  4.00  2.20  1.30
assi (resi 81   and name HG1#) (resi 82   and name HN  )  4.00  2.20  2.00
assi (resi 81   and name HN  ) (resi 96   and name HE# )  3.00  1.20  2.60
assi (resi 81   and name HG2#) (resi 96   and name HE# )  4.00  2.20  3.30
assi (resi 81   and name HD1#) (resi 96   and name HE# )  4.00  2.20  3.30
assi (resi 81   and name HD1#) (resi 99   and name HD# )  4.00  2.20  3.70

! residue 82   Ser , intraresidue NOEs
assi (resi 82   and name HN  ) (resi 82   and name HA  )  3.00  1.20  0.60
assi (resi 82   and name HN  ) (resi 82   and name HB# )  4.00  2.20  2.00

! residue 82   Ser , NOEs forward in sequence
assi (resi 82   and name HN  ) (resi 96   and name HD# )  4.00  2.20  3.00
assi (resi 82   and name HN  ) (resi 96   and name HE# )  2.50  0.70  2.20

! residue 83   Pro , intraresidue NOEs

! residue 83   Pro , NOEs forward in sequence
assi (resi 83   and name HA  ) (resi 84   and name HN  )  2.50  0.70  0.20
assi (resi 83   and name HB# ) (resi 84   and name HN  )  3.00  1.20  1.60
assi (resi 83   and name HB# ) (resi 97   and name HN  )  4.00  2.20  2.00
assi (resi 83   and name HB# ) (resi 99   and name HD# )  4.00  2.20  4.40

! residue 84   Trp , intraresidue NOEs
assi (resi 84   and name HN  ) (resi 84   and name HA  )  3.00  1.20  0.60
assi (resi 84   and name HN  ) (resi 84   and name HD1 )  3.00  1.20  0.60
assi (resi 84   and name HN  ) (resi 84   and name HB# )  4.00  2.20  2.00
! trivial: assi (resi 84   and name HD1 ) (resi 84   and name HE1 )  4.00  2.20  1.00
! trivial: assi (resi 84   and name HE1 ) (resi 84   and name HZ2 )  4.00  2.20  1.00
! trivial: assi (resi 84   and name HZ2 ) (resi 84   and name HH2 )  4.00  2.20  1.00

! residue 84   Trp , NOEs forward in sequence
assi (resi 84   and name HN  ) (resi 85   and name HN  )  4.00  2.20  1.00
assi (resi 84   and name HA  ) (resi 85   and name HN  )  3.00  1.20  0.60
assi (resi 84   and name HE3 ) (resi 85   and name HN  )  3.00  1.20  0.60
assi (resi 84   and name HB# ) (resi 85   and name HN  )  3.00  1.20  1.60
assi (resi 84   and name HE3 ) (resi 95   and name HN  )  4.00  2.20  1.00
assi (resi 84   and name HB# ) (resi 95   and name HN  )  4.00  2.20  2.00
assi (resi 84   and name HN  ) (resi 96   and name HA  )  4.00  2.20  1.00
assi (resi 84   and name HN  ) (resi 96   and name HD# )  4.00  2.20  3.00
assi (resi 84   and name HB# ) (resi 96   and name HN  )  4.00  2.20  2.00
assi (resi 84   and name HB# ) (resi 96   and name HD# )  4.00  2.20  4.00
assi (resi 84   and name HN  ) (resi 97   and name HN  )  4.00  2.20  1.00
assi (resi 84   and name HA  ) (resi 97   and name HN  )  3.00  1.20  0.60
assi (resi 84   and name HB# ) (resi 97   and name HN  )  4.00  2.20  2.00

! residue 85   Cys , intraresidue NOEs
assi (resi 85   and name HN  ) (resi 85   and name HA  )  3.00  1.20  0.60
assi (resi 85   and name HN  ) (resi 85   and name HB# )  4.00  2.20  2.00

! residue 85   Cys , NOEs forward in sequence
assi (resi 85   and name HN  ) (resi 86   and name HN  )  4.00  2.20  1.00
assi (resi 85   and name HN  ) (resi 86   and name HA  )  4.00  2.20  1.00
assi (resi 85   and name HA  ) (resi 86   and name HN  )  3.00  1.20  0.60
assi (resi 85   and name HB# ) (resi 86   and name HN  )  3.00  1.20  1.60
assi (resi 85   and name HN  ) (resi 94   and name HE3 )  3.00  1.20  0.60
assi (resi 85   and name HN  ) (resi 94   and name HB# )  4.00  2.20  2.00
assi (resi 85   and name HN  ) (resi 95   and name HN  )  2.50  0.70  0.20
assi (resi 85   and name HN  ) (resi 95   and name HA  )  4.00  2.20  1.00
assi (resi 85   and name HA  ) (resi 95   and name HN  )  4.00  2.20  1.00
assi (resi 85   and name HN  ) (resi 96   and name HA  )  3.00  1.20  0.60

! residue 86   Tyr , intraresidue NOEs
! trivial: assi (resi 86   and name HN  ) (resi 86   and name HA  )  4.00  2.20  1.00
assi (resi 86   and name HN  ) (resi 86   and name HB# )  3.00  1.20  1.60
assi (resi 86   and name HN  ) (resi 86   and name HD# )  3.00  1.20  2.60
! trivial: assi (resi 86   and name HA  ) (resi 86   and name HB# )  4.00  2.20  2.00
assi (resi 86   and name HA  ) (resi 86   and name HD# )  4.00  2.20  3.00
assi (resi 86   and name HB# ) (resi 86   and name HD# )  4.00  2.20  4.00

! residue 86   Tyr , NOEs forward in sequence
assi (resi 86   and name HA  ) (resi 87   and name HN  )  3.00  1.20  0.60
assi (resi 86   and name HB# ) (resi 87   and name HN  )  3.00  1.20  1.60
assi (resi 86   and name HD# ) (resi 87   and name HN  )  4.00  2.20  3.00
assi (resi 86   and name HD# ) (resi 93   and name HD# )  4.00  2.20  4.00
assi (resi 86   and name HN  ) (resi 94   and name HB# )  4.00  2.20  2.00
assi (resi 86   and name HA  ) (resi 94   and name HN  )  4.00  2.20  1.00
assi (resi 86   and name HA  ) (resi 94   and name HA  )  3.00  1.20  0.60
assi (resi 86   and name HA  ) (resi 94   and name HB# )  4.00  2.20  2.00
assi (resi 86   and name HD# ) (resi 94   and name HD1 )  4.00  2.20  3.00
assi (resi 86   and name HA  ) (resi 95   and name HN  )  4.00  2.20  1.00

! residue 87   Thr , intraresidue NOEs
assi (resi 87   and name HN  ) (resi 87   and name HA  )  3.00  1.20  0.60
assi (resi 87   and name HN  ) (resi 87   and name HB  )  4.00  2.20  1.00
assi (resi 87   and name HN  ) (resi 87   and name HG1 )  4.00  2.20  1.00
assi (resi 87   and name HN  ) (resi 87   and name HG2#)  4.00  2.20  1.30

! residue 87   Thr , NOEs forward in sequence
assi (resi 87   and name HB  ) (resi 88   and name HN  )  3.00  1.20  0.60
assi (resi 87   and name HG2#) (resi 88   and name HN  )  4.00  2.20  1.30
assi (resi 87   and name HA  ) (resi 89   and name HN  )  4.00  2.20  1.00
assi (resi 87   and name HG1 ) (resi 89   and name HN  )  3.00  1.20  0.60
assi (resi 87   and name HG2#) (resi 89   and name HN  )  4.00  2.20  1.30
assi (resi 87   and name HG1 ) (resi 91   and name HN  )  4.00  2.20  1.00
assi (resi 87   and name HN  ) (resi 92   and name HG# )  4.00  2.20  3.40
assi (resi 87   and name HG1 ) (resi 92   and name HN  )  4.00  2.20  1.00
assi (resi 87   and name HG1 ) (resi 92   and name HG# )  4.00  2.20  3.40
assi (resi 87   and name HG2#) (resi 92   and name HN  )  4.00  2.20  1.30
assi (resi 87   and name HG2#) (resi 92   and name HG# )  4.00  2.20  3.70
assi (resi 87   and name HN  ) (resi 94   and name HA  )  3.00  1.20  0.60
assi (resi 87   and name HN  ) (resi 94   and name HB# )  4.00  2.20  2.00
assi (resi 87   and name HG2#) (resi 94   and name HN  )  4.00  2.20  1.30
assi (resi 87   and name HG2#) (resi 94   and name HA  )  4.00  2.20  1.30
assi (resi 87   and name HN  ) (resi 95   and name HN  )  4.00  2.20  1.00
assi (resi 87   and name HG2#) (resi 95   and name HN  )  4.00  2.20  1.30

! residue 88   Met , intraresidue NOEs
assi (resi 88   and name HN  ) (resi 88   and name HA  )  3.00  1.20  0.60
assi (resi 88   and name HN  ) (resi 88   and name HB# )  3.00  1.20  1.60
assi (resi 88   and name HN  ) (resi 88   and name HG# )  3.00  1.20  1.60

! residue 88   Met , NOEs forward in sequence
assi (resi 88   and name HN  ) (resi 89   and name HN  )  3.00  1.20  0.60
assi (resi 88   and name HA  ) (resi 89   and name HN  )  4.00  2.20  1.00
assi (resi 88   and name HB# ) (resi 89   and name HN  )  4.00  2.20  2.00

! residue 89   Asp , intraresidue NOEs
assi (resi 89   and name HN  ) (resi 89   and name HA  )  3.00  1.20  0.60
assi (resi 89   and name HN  ) (resi 89   and name HB# )  3.00  1.20  1.60

! residue 89   Asp , NOEs forward in sequence
assi (resi 89   and name HN  ) (resi 90   and name HD# )  3.00  1.20  1.60
assi (resi 89   and name HA  ) (resi 90   and name HD# )  3.00  1.20  1.60
assi (resi 89   and name HA  ) (resi 91   and name HN  )  4.00  2.20  1.00
assi (resi 89   and name HB# ) (resi 91   and name HN  )  4.00  2.20  2.00
assi (resi 89   and name HN  ) (resi 92   and name HN  )  4.00  2.20  1.00
assi (resi 89   and name HN  ) (resi 92   and name HB  )  3.00  1.20  0.60
assi (resi 89   and name HN  ) (resi 92   and name HG# )  4.00  2.20  3.40
assi (resi 89   and name HA  ) (resi 92   and name HN  )  4.00  2.20  1.00
assi (resi 89   and name HB# ) (resi 92   and name HN  )  3.00  1.20  1.60
assi (resi 89   and name HB# ) (resi 92   and name HG# )  4.00  2.20  4.40

! residue 90   Pro , intraresidue NOEs

! residue 90   Pro , NOEs forward in sequence
assi (resi 90   and name HA  ) (resi 91   and name HN  )  3.00  1.20  0.60
assi (resi 90   and name HB# ) (resi 91   and name HN  )  3.00  1.20  1.60
assi (resi 90   and name HG# ) (resi 91   and name HN  )  3.00  1.20  1.60
assi (resi 90   and name HD# ) (resi 91   and name HN  )  3.00  1.20  1.60
assi (resi 90   and name HA  ) (resi 92   and name HN  )  3.00  1.20  0.60
assi (resi 90   and name HD# ) (resi 92   and name HN  )  4.00  2.20  2.00

! residue 91   Asn , intraresidue NOEs
assi (resi 91   and name HN  ) (resi 91   and name HA  )  3.00  1.20  0.60
assi (resi 91   and name HN  ) (resi 91   and name HB# )  3.00  1.20  1.60
assi (resi 91   and name HN  ) (resi 91   and name HD2#)  3.00  1.20  1.60
assi (resi 91   and name HA  ) (resi 91   and name HB# )  2.50  0.70  1.20
assi (resi 91   and name HB# ) (resi 91   and name HD2#)  3.00  1.20  2.60

! residue 91   Asn , NOEs forward in sequence
assi (resi 91   and name HN  ) (resi 92   and name HN  )  2.50  0.70  0.20
assi (resi 91   and name HN  ) (resi 92   and name HB  )  4.00  2.20  1.00
assi (resi 91   and name HN  ) (resi 92   and name HG# )  4.00  2.20  3.40
assi (resi 91   and name HA  ) (resi 92   and name HN  )  3.00  1.20  0.60
assi (resi 91   and name HB# ) (resi 92   and name HN  )  3.00  1.20  1.60
assi (resi 91   and name HB# ) (resi 92   and name HG# )  4.00  2.20  4.40

! residue 92   Val , intraresidue NOEs
assi (resi 92   and name HN  ) (resi 92   and name HA  )  3.00  1.20  0.60
assi (resi 92   and name HN  ) (resi 92   and name HB  )  3.00  1.20  0.60
assi (resi 92   and name HN  ) (resi 92   and name HG# )  3.00  1.20  3.00
assi (resi 92   and name HA  ) (resi 92   and name HG# )  3.00  1.20  3.00
! trivial: assi (resi 92   and name HB  ) (resi 92   and name HG# )  3.00  1.20  3.00
! trivial: assi (resi 92   and name HG# ) (resi 92   and name HG# )  2.50  0.70  5.00

! residue 92   Val , NOEs forward in sequence
assi (resi 92   and name HN  ) (resi 93   and name HN  )  4.00  2.20  1.00
assi (resi 92   and name HA  ) (resi 93   and name HN  )  2.50  0.70  0.20
assi (resi 92   and name HG# ) (resi 93   and name HN  )  4.00  2.20  3.40
assi (resi 92   and name HA  ) (resi 94   and name HN  )  4.00  2.20  1.00
assi (resi 92   and name HG# ) (resi 94   and name HN  )  4.00  2.20  3.40
assi (resi 92   and name HG# ) (resi 95   and name HN  )  4.00  2.20  3.40
assi (resi 92   and name HG# ) (resi 95   and name HB# )  4.00  2.20  4.40
assi (resi 92   and name HG# ) (resi 95   and name HG# )  4.00  2.20  4.40

! residue 93   Arg , intraresidue NOEs
assi (resi 93   and name HN  ) (resi 93   and name HA  )  2.50  0.70  0.20
assi (resi 93   and name HN  ) (resi 93   and name HB# )  3.00  1.20  1.60
assi (resi 93   and name HN  ) (resi 93   and name HG# )  4.00  2.20  2.00

! residue 93   Arg , NOEs forward in sequence
assi (resi 93   and name HN  ) (resi 94   and name HN  )  3.00  1.20  0.60
assi (resi 93   and name HN  ) (resi 94   and name HD1 )  4.00  2.20  1.00
assi (resi 93   and name HB# ) (resi 94   and name HN  )  3.00  1.20  1.60
assi (resi 93   and name HB# ) (resi 94   and name HD1 )  4.00  2.20  2.00
assi (resi 93   and name HB# ) (resi 94   and name HE1 )  4.00  2.20  2.00
assi (resi 93   and name HG# ) (resi 94   and name HN  )  3.00  1.20  1.60
assi (resi 93   and name HG# ) (resi 94   and name HD1 )  4.00  2.20  2.00
assi (resi 93   and name HG# ) (resi 94   and name HE1 )  4.00  2.20  2.00

! residue 94   Trp , intraresidue NOEs
assi (resi 94   and name HN  ) (resi 94   and name HA  )  3.00  1.20  0.60
assi (resi 94   and name HN  ) (resi 94   and name HD1 )  3.00  1.20  0.60
assi (resi 94   and name HN  ) (resi 94   and name HE1 )  4.00  2.20  1.00
assi (resi 94   and name HN  ) (resi 94   and name HB# )  4.00  2.20  2.00
! trivial: assi (resi 94   and name HA  ) (resi 94   and name HB# )  4.00  2.20  2.00
! trivial: assi (resi 94   and name HD1 ) (resi 94   and name HE1 )  2.50  0.70  0.20
! trivial: assi (resi 94   and name HE1 ) (resi 94   and name HZ2 )  2.50  0.70  0.20
! trivial: assi (resi 94   and name HZ2 ) (resi 94   and name HZ3 )  4.00  2.20  1.00
! trivial: assi (resi 94   and name HZ2 ) (resi 94   and name HH2 )  3.00  1.20  0.60
! trivial: assi (resi 94   and name HZ3 ) (resi 94   and name HH2 )  4.00  2.20  1.00

! residue 94   Trp , NOEs forward in sequence
assi (resi 94   and name HN  ) (resi 95   and name HN  )  4.00  2.20  1.00
assi (resi 94   and name HA  ) (resi 95   and name HN  )  2.50  0.70  0.20
assi (resi 94   and name HE3 ) (resi 95   and name HN  )  3.00  1.20  0.60
assi (resi 94   and name HB# ) (resi 95   and name HN  )  3.00  1.20  1.60
assi (resi 94   and name HE3 ) (resi 96   and name HN  )  4.00  2.20  1.00
assi (resi 94   and name HZ3 ) (resi 96   and name HN  )  4.00  2.20  1.00
assi (resi 94   and name HZ3 ) (resi 96   and name HD# )  4.00  2.20  3.00
assi (resi 94   and name HZ3 ) (resi 96   and name HE# )  4.00  2.20  3.00
assi (resi 94   and name HH2 ) (resi 96   and name HN  )  4.00  2.20  1.00

! residue 95   Glu , intraresidue NOEs
assi (resi 95   and name HN  ) (resi 95   and name HA  )  3.00  1.20  0.60
assi (resi 95   and name HN  ) (resi 95   and name HB# )  3.00  1.20  1.60
assi (resi 95   and name HN  ) (resi 95   and name HG# )  4.00  2.20  2.00

! residue 95   Glu , NOEs forward in sequence
assi (resi 95   and name HN  ) (resi 96   and name HA  )  4.00  2.20  1.00
assi (resi 95   and name HA  ) (resi 96   and name HN  )  2.50  0.70  0.20
assi (resi 95   and name HB# ) (resi 96   and name HN  )  3.00  1.20  1.60
assi (resi 95   and name HG# ) (resi 96   and name HN  )  4.00  2.20  2.00

! residue 96   Tyr , intraresidue NOEs
assi (resi 96   and name HN  ) (resi 96   and name HA  )  3.00  1.20  0.60
assi (resi 96   and name HN  ) (resi 96   and name HB# )  3.00  1.20  1.60
assi (resi 96   and name HN  ) (resi 96   and name HD# )  3.00  1.20  2.60
assi (resi 96   and name HN  ) (resi 96   and name HE# )  4.00  2.20  3.00
assi (resi 96   and name HA  ) (resi 96   and name HD# )  4.00  2.20  3.00
assi (resi 96   and name HB# ) (resi 96   and name HD# )  4.00  2.20  4.00
assi (resi 96   and name HB# ) (resi 96   and name HE# )  4.00  2.20  4.00
! trivial: assi (resi 96   and name HD# ) (resi 96   and name HE# )  3.00  1.20  4.60

! residue 96   Tyr , NOEs forward in sequence
assi (resi 96   and name HN  ) (resi 97   and name HN  )  4.00  2.20  1.00
assi (resi 96   and name HA  ) (resi 97   and name HN  )  3.00  1.20  0.60
assi (resi 96   and name HB# ) (resi 97   and name HN  )  3.00  1.20  1.60
assi (resi 96   and name HD# ) (resi 97   and name HN  )  3.00  1.20  2.60

! residue 97   Cys , intraresidue NOEs
assi (resi 97   and name HN  ) (resi 97   and name HA  )  3.00  1.20  0.60
assi (resi 97   and name HN  ) (resi 97   and name HB# )  3.00  1.20  1.60

! residue 97   Cys , NOEs forward in sequence
assi (resi 97   and name HA  ) (resi 98   and name HN  )  3.00  1.20  0.60
assi (resi 97   and name HB# ) (resi 98   and name HN  )  4.00  2.20  2.00
assi (resi 97   and name HN  ) (resi 99   and name HG  )  4.00  2.20  1.00
assi (resi 97   and name HA  ) (resi 99   and name HN  )  4.00  2.20  1.00
assi (resi 97   and name HA  ) (resi 99   and name HD# )  4.00  2.20  3.40
assi (resi 97   and name HB# ) (resi 99   and name HN  )  4.00  2.20  2.00
assi (resi 97   and name HB# ) (resi 99   and name HD# )  4.00  2.20  4.40

! residue 98   Asn , intraresidue NOEs
assi (resi 98   and name HN  ) (resi 98   and name HA  )  3.00  1.20  0.60
assi (resi 98   and name HN  ) (resi 98   and name HB# )  3.00  1.20  1.60
assi (resi 98   and name HA  ) (resi 98   and name HD2#)  4.00  2.20  2.00
assi (resi 98   and name HB# ) (resi 98   and name HD2#)  3.00  1.20  2.60

! residue 98   Asn , NOEs forward in sequence
assi (resi 98   and name HA  ) (resi 99   and name HN  )  2.50  0.70  0.20
assi (resi 98   and name HB# ) (resi 99   and name HN  )  4.00  2.20  2.00

! residue 99   Leu , intraresidue NOEs
assi (resi 99   and name HN  ) (resi 99   and name HA  )  3.00  1.20  0.60
assi (resi 99   and name HN  ) (resi 99   and name HG  )  3.00  1.20  0.60
assi (resi 99   and name HN  ) (resi 99   and name HB# )  3.00  1.20  1.60
assi (resi 99   and name HN  ) (resi 99   and name HD# )  4.00  2.20  3.40
assi (resi 99   and name HA  ) (resi 99   and name HD# )  4.00  2.20  3.40
! trivial: assi (resi 99   and name HG  ) (resi 99   and name HD# )  4.00  2.20  3.40
assi (resi 99   and name HB# ) (resi 99   and name HD# )  4.00  2.20  4.40
! trivial: assi (resi 99   and name HD# ) (resi 99   and name HD# )  3.00  1.20  5.40

! residue 99   Leu , NOEs forward in sequence
assi (resi 99   and name HN  ) (resi 100  and name HN  )  4.00  2.20  1.00
assi (resi 99   and name HA  ) (resi 100  and name HN  )  2.50  0.70  0.20
assi (resi 99   and name HB# ) (resi 100  and name HN  )  3.00  1.20  1.60
assi (resi 99   and name HD# ) (resi 100  and name HN  )  4.00  2.20  3.40

! residue 100  Thr , intraresidue NOEs
assi (resi 100  and name HN  ) (resi 100  and name HA  )  3.00  1.20  0.60
assi (resi 100  and name HN  ) (resi 100  and name HB  )  3.00  1.20  0.60
assi (resi 100  and name HN  ) (resi 100  and name HG2#)  4.00  2.20  1.30
assi (resi 100  and name HA  ) (resi 100  and name HG2#)  2.50  0.70  0.50
! trivial: assi (resi 100  and name HB  ) (resi 100  and name HG2#)  3.00  1.20  0.90

! residue 100  Thr , NOEs forward in sequence
assi (resi 100  and name HA  ) (resi 101  and name HN  )  2.50  0.70  0.20
assi (resi 100  and name HB  ) (resi 101  and name HN  )  2.50  0.70  0.20
assi (resi 100  and name HG2#) (resi 101  and name HN  )  4.00  2.20  1.30

! residue 101  Gln , intraresidue NOEs
assi (resi 101  and name HN  ) (resi 101  and name HA  )  3.00  1.20  0.60
assi (resi 101  and name HN  ) (resi 101  and name HB# )  2.50  0.70  1.20
assi (resi 101  and name HN  ) (resi 101  and name HG# )  3.00  1.20  1.60
assi (resi 101  and name HA  ) (resi 101  and name HE2#)  4.00  2.20  2.00
assi (resi 101  and name HB# ) (resi 101  and name HE2#)  4.00  2.20  3.00
assi (resi 101  and name HG# ) (resi 101  and name HE2#)  3.00  1.20  2.60

! residue 101  Gln , NOEs forward in sequence
assi (resi 101  and name HN  ) (resi 102  and name HN  )  4.00  2.20  1.00
assi (resi 101  and name HA  ) (resi 102  and name HN  )  2.50  0.70  0.20
assi (resi 101  and name HB# ) (resi 102  and name HN  )  3.00  1.20  1.60
assi (resi 101  and name HG# ) (resi 102  and name HN  )  3.00  1.20  1.60

! residue 102  Cys , intraresidue NOEs
assi (resi 102  and name HN  ) (resi 102  and name HA  )  3.00  1.20  0.60
assi (resi 102  and name HN  ) (resi 102  and name HB# )  3.00  1.20  1.60

! residue 102  Cys , NOEs forward in sequence

! residue 103  Pro , intraresidue NOEs

! residue 103  Pro , NOEs forward in sequence

! residue 104  Val , intraresidue NOEs
assi (resi 104  and name HN  ) (resi 104  and name HA  )  3.00  1.20  0.60
assi (resi 104  and name HN  ) (resi 104  and name HB  )  2.50  0.70  0.20
assi (resi 104  and name HN  ) (resi 104  and name HG# )  3.00  1.20  3.00

! residue 104  Val , NOEs forward in sequence
assi (resi 104  and name HB  ) (resi 105  and name HN  )  3.00  1.20  0.60
assi (resi 104  and name HG# ) (resi 105  and name HN  )  4.00  2.20  3.40

! residue 105  Thr , intraresidue NOEs
assi (resi 105  and name HN  ) (resi 105  and name HA  )  3.00  1.20  0.60
assi (resi 105  and name HN  ) (resi 105  and name HB  )  2.50  0.70  0.20
assi (resi 105  and name HN  ) (resi 105  and name HG2#)  4.00  2.20  1.30

! residue 105  Thr , NOEs forward in sequence

! residue 106  Glu , intraresidue NOEs
assi (resi 106  and name HN  ) (resi 106  and name HA  )  2.50  0.70  0.20
assi (resi 106  and name HN  ) (resi 106  and name HB# )  3.00  1.20  1.60
assi (resi 106  and name HN  ) (resi 106  and name HG# )  3.00  1.20  1.60

! residue 106  Glu , NOEs forward in sequence
assi (resi 106  and name HA  ) (resi 107  and name HN  )  3.00  1.20  0.60

! residue 107  Ser , intraresidue NOEs
! trivial: assi (resi 107  and name HN  ) (resi 107  and name HA  )  4.00  2.20  1.00
assi (resi 107  and name HN  ) (resi 107  and name HB# )  4.00  2.20  2.00

! residue 107  Ser , NOEs forward in sequence

! residue 108  Ser , intraresidue NOEs

! residue 108  Ser , NOEs forward in sequence

! residue 109  Val , intraresidue NOEs
! trivial: assi (resi 109  and name HN  ) (resi 109  and name HA  )  4.00  2.20  1.00
assi (resi 109  and name HN  ) (resi 109  and name HB  )  4.00  2.20  1.00
assi (resi 109  and name HN  ) (resi 109  and name HG# )  4.00  2.20  3.40

! residue 109  Val , NOEs forward in sequence

! residue 110  Leu , intraresidue NOEs
! trivial: assi (resi 110  and name HN  ) (resi 110  and name HA  )  4.00  2.20  1.00
assi (resi 110  and name HN  ) (resi 110  and name HB# )  4.00  2.20  2.00

! residue 110  Leu , NOEs forward in sequence
assi (resi 110  and name HA  ) (resi 111  and name HN  )  3.00  1.20  0.60

! residue 111  Ala , intraresidue NOEs
! trivial: assi (resi 111  and name HN  ) (resi 111  and name HA  )  4.00  2.20  1.00
assi (resi 111  and name HN  ) (resi 111  and name HB# )  4.00  2.20  1.30

! residue 111  Ala , NOEs forward in sequence

! residue 112  Thr , intraresidue NOEs
! trivial: assi (resi 112  and name HN  ) (resi 112  and name HA  )  4.00  2.20  1.00

! residue 112  Thr , NOEs forward in sequence

! residue 113  Ser , intraresidue NOEs
assi (resi 113  and name HN  ) (resi 113  and name HA  )  3.00  1.20  0.60
assi (resi 113  and name HN  ) (resi 113  and name HB# )  4.00  2.20  2.00

! residue 113  Ser , NOEs forward in sequence

! residue 114  Thr , intraresidue NOEs

! residue 114  Thr , NOEs forward in sequence

! residue 115  Ala , intraresidue NOEs
! trivial: assi (resi 115  and name HN  ) (resi 115  and name HA  )  4.00  2.20  1.00

! residue 115  Ala , NOEs forward in sequence

! residue 116  Val , intraresidue NOEs
! trivial: assi (resi 116  and name HN  ) (resi 116  and name HA  )  4.00  2.20  1.00
assi (resi 116  and name HN  ) (resi 116  and name HB  )  4.00  2.20  1.00
assi (resi 116  and name HN  ) (resi 116  and name HG# )  4.00  2.20  3.40

! residue 116  Val , NOEs forward in sequence
assi (resi 116  and name HA  ) (resi 117  and name HN  )  4.00  2.20  1.00

! residue 117  Ser , intraresidue NOEs
assi (resi 117  and name HN  ) (resi 117  and name HA  )  3.00  1.20  0.60

! residue 117  Ser , NOEs forward in sequence

! residue 118  Glu , intraresidue NOEs
assi (resi 118  and name HN  ) (resi 118  and name HA  )  3.00  1.20  0.60
assi (resi 118  and name HN  ) (resi 118  and name HB# )  3.00  1.20  1.60

! residue 118  Glu , NOEs forward in sequence

! residue 119  Gln , intraresidue NOEs
!
! number of restraints as function of range
! |i-j| = 0 :    292
! |i-j| = 1 :    273
! |i-j| = 2 :     76
! |i-j| = 3 :     35
! |i-j| = 4 :     29
! |i-j| > 4 :    233
! total     :    938



!dihedralrestraints

set message=off echo=off end
restraints dihedral reset

assign (resid  9  and name c )   (resid 10  and name n )  (resid 10  and name ca)   (resid 10  and name c )  1.0 -105.0 55.0 2
assign (resid  10  and name c )   (resid 11  and name n )  (resid 11  and name ca)   (resid 11  and name c )  1.0 -105.0 55.0 2
assign (resid  12  and name c )   (resid 13  and name n )  (resid 13  and name ca)   (resid 13  and name c )  1.0 -105.0 55.0 2
assign (resid  13  and name c )   (resid 14  and name n )  (resid 14  and name ca)   (resid 14  and name c )  1.0 -105.0 55.0 2
assign (resid  15  and name c )   (resid 16  and name n )  (resid 16  and name ca)   (resid 16  and name c )  1.0 -105.0 55.0 2
assign (resid  16  and name c )   (resid 17  and name n )  (resid 17  and name ca)   (resid 17  and name c )  1.0 -81.0 20.0 2
assign (resid  17  and name c )   (resid 18  and name n )  (resid 18  and name ca)   (resid 18  and name c )  1.0 -105.0 55.0 2
assign (resid  18  and name c )   (resid 19  and name n )  (resid 19  and name ca)   (resid 19  and name c )   1.0 -60.0 30.0 2
assign (resid  21  and name c )   (resid 22  and name n )  (resid 22  and name ca)   (resid 22  and name c )  1.0 -105.0 55.0 2
assign (resid  23  and name c )   (resid 24  and name n )  (resid 24  and name ca)   (resid 24  and name c )   1.0 -60.0 30.0 2
assign (resid  24  and name c )   (resid 25  and name n )  (resid 25  and name ca)   (resid 25  and name c )  1.0 -105.0 55.0 2
assign (resid  25  and name c )   (resid 26  and name n )  (resid 26  and name ca)   (resid 26  and name c )  1.0 -122.0 36.0 2
assign (resid  26  and name c )   (resid 27  and name n )  (resid 27  and name ca)   (resid 27  and name c )  1.0 -121.0 21.0 2
assign (resid  28  and name c )   (resid 29  and name n )  (resid 29  and name ca)   (resid 29  and name c )  1.0 -105.0 55.0 2
assign (resid  30  and name c )   (resid 31  and name n )  (resid 31  and name ca)   (resid 31  and name c )   1.0 -60.0 30.0 2
assign (resid  35  and name c )   (resid 36  and name n )  (resid 36  and name ca)   (resid 36  and name c )  1.0 -105.0 55.0 2
assign (resid  36  and name c )   (resid 37  and name n )  (resid 37  and name ca)   (resid 37  and name c )   1.0 -60.0 30.0 2
assign (resid  37  and name c )   (resid 38  and name n )  (resid 38  and name ca)   (resid 38  and name c )  1.0 -118.0 54.0 2
assign (resid  38  and name c )   (resid 39  and name n )  (resid 39  and name ca)   (resid 39  and name c )  1.0 -125.0 24.0  2
assign (resid  39  and name c )   (resid 40  and name n )  (resid 40  and name ca)   (resid 40  and name c )  1.0 -105.0 55.0 2
assign (resid  40  and name c )   (resid 41  and name n )  (resid 41  and name ca)   (resid 41  and name c )   1.0 -60.0 30.0 2
assign (resid  41  and name c )   (resid 42  and name n )  (resid 42  and name ca)   (resid 42  and name c )  1.0 -105.0 55.0 2
assign (resid  43  and name c )   (resid 44  and name n )  (resid 44  and name ca)   (resid 44  and name c )  1.0 -92.0 21.0 2
assign (resid  44  and name c )   (resid 45  and name n )  (resid 45  and name ca)   (resid 45  and name c )  1.0 -105.0 55.0 2
assign (resid  46  and name c )   (resid 47  and name n )  (resid 47  and name ca)   (resid 47  and name c )  1.0 -74.0 16.0 2
assign (resid  47  and name c )   (resid 48  and name n )  (resid 48  and name ca)   (resid 48  and name c )   1.0 -60.0 30.0 2
assign (resid  49  and name c )   (resid 50  and name n )  (resid 50  and name ca)   (resid 50  and name c )   1.0 -63.0 14.0 2
assign (resid  50  and name c )   (resid 51  and name n )  (resid 51  and name ca)   (resid 51  and name c )  1.0 -105.0 55.0 2
assign (resid  51  and name c )   (resid 52  and name n )  (resid 52  and name ca)   (resid 52  and name c )  1.0 -105.0 55.0 2
assign (resid  52  and name c )   (resid 53  and name n )  (resid 53  and name ca)   (resid 53  and name c )  1.0 -105.0 55.0 2
assign (resid  54  and name c )   (resid 55  and name n )  (resid 55  and name ca)   (resid 55  and name c )  1.0 -105.0 55.0 2 
assign (resid  55  and name c )   (resid 56  and name n )  (resid 56  and name ca)   (resid 56  and name c )  1.0 -77.0 26.0 2      assign (resid  57  and name c )   (resid 58  and name n )  (resid 58  and name ca)   (resid 58  and name c )  1.0 -105.0 55.0 2
assign (resid  60  and name c )   (resid 61  and name n )  (resid 61  and name ca)   (resid 61  and name c )   1.0 -69.0 12.0 2
assign (resid  61  and name c )   (resid 62  and name n )  (resid 62  and name ca)   (resid 62  and name c )   1.0 -70.0 13.0 2
assign (resid  62  and name c )   (resid 63  and name n )  (resid 63  and name ca)   (resid 63  and name c )  1.0 -105.0 55.0 2
assign (resid  63  and name c )   (resid 64  and name n )  (resid 64  and name ca)   (resid 64  and name c )  1.0 -105.0 55.0 2
assign (resid  65  and name c )   (resid 66  and name n )  (resid 66  and name ca)   (resid 66  and name c )  1.0 -105.0 55.0 2
assign (resid  69  and name c )   (resid 70  and name n )  (resid 70  and name ca)   (resid 70  and name c )  1.0 -105.0 55.0 2
assign (resid  71  and name c )   (resid 72  and name n )  (resid 72  and name ca)   (resid 72  and name c )  1.0 -105.0 55.0 2
assign (resid  74  and name c )   (resid 75  and name n )  (resid 75  and name ca)   (resid 75  and name c )   1.0 -105.0 55.0 2
assign (resid  75  and name c )   (resid 76  and name n )  (resid 76  and name ca)   (resid 76  and name c )   1.0 -105.0 55.0 2
assign (resid  77  and name c )   (resid 78  and name n )  (resid 78  and name ca)   (resid 78  and name c )   1.0 -120.0 40.0 2
assign (resid  79  and name c )   (resid 80  and name n )  (resid 80  and name ca)   (resid 80  and name c )  1.0 -75.0 19.0  2
assign (resid  83  and name c )   (resid 84  and name n )  (resid 84  and name ca)   (resid 84  and name c )  1.0 -105.0 55.0 2
assign (resid  85  and name c )   (resid 86  and name n )  (resid 86  and name ca)   (resid 86  and name c )  1.0 -105.0 55.0 2
assign (resid  86  and name c )   (resid 87  and name n )  (resid 87  and name ca)   (resid 87  and name c )  1.0 -105.0 55.0 2
assign (resid  87  and name c )   (resid 88  and name n )  (resid 88  and name ca)   (resid 88  and name c )   1.0 -60.0 30.0 2
assign (resid  88  and name c )   (resid 89  and name n )  (resid 89  and name ca)   (resid 89  and name c )  1.0 -105.0 55.0 2
assign (resid  90  and name c )   (resid 91  and name n )  (resid 91  and name ca)   (resid 91  and name c )  1.0 -105.0 55.0 2
assign (resid  91  and name c )   (resid 92  and name n )  (resid 92  and name ca)   (resid 92  and name c )   1.0 -106.0 29.0 2
assign (resid  92  and name c )   (resid 93  and name n )  (resid 93  and name ca)   (resid 93  and name c )   1.0 -60.0 30.0 2
assign (resid  93  and name c )   (resid 94  and name n )  (resid 94  and name ca)   (resid 94  and name c )  1.0 -105.0 55.0 2
assign (resid  95  and name c )   (resid 96  and name n )  (resid 96  and name ca)   (resid 96  and name c )   1.0 -60.0 30.0 2
assign (resid  97  and name c )   (resid 98  and name n )  (resid 98   and name ca )   (resid 98  and name c ) 1.0 -105.0 55.0 2
assign (resid  98  and name c )   (resid 99  and name n )  (resid 99   and name ca )   (resid 99  and name c ) 1.0 -129.0 25.0 2
assign (resid  99  and name c )   (resid 100 and name n )  (resid 100  and name ca )   (resid 100 and name c ) 1.0 -105.0 55.0 2
assign (resid 100  and name c )   (resid 101 and name n )  (resid 101  and name ca )   (resid 101 and name c ) 1.0 -105.0 55.0 2
assign (resid 103  and name c )   (resid 104 and name n )  (resid 104  and name ca )   (resid 104 and name c ) 1.0 -105.0 55.0 2
assign (resid 104  and name c )   (resid 105 and name n )  (resid 105  and name ca )   (resid 105 and name c ) 1.0 -105.0 55.0 2
assign (resid 106  and name c )   (resid 107 and name n )  (resid 107  and name ca )   (resid 107 and name c ) 1.0 -105.0 55.0 2
assign (resid 108  and name c )   (resid 109 and name n )  (resid 109  and name ca )   (resid 109 and name c ) 1.0 -105.0 55.0 2
assign (resid 109   and name c )   (resid 110 and name n )  (resid 110  and name ca )   (resid 110 and name c ) 1.0 -105.0 55.0 2
assign (resid 110  and name c )   (resid 111 and name n )  (resid 111  and name ca )   (resid 111 and name c ) 1.0 -105.0 55.0 2
assign (resid 111  and name c )   (resid 112 and name n )  (resid 112  and name ca )   (resid 112 and name c ) 1.0 -105.0 55.0 2
assign (resid 112  and name c )   (resid 113 and name n )  (resid 113  and name ca )   (resid 113 and name c )  1.0 -60.0 30.0 2
assign (resid 113  and name c )   (resid 114 and name n )  (resid 114  and name ca )   (resid 114 and name c ) 1.0 -105.0 55.0 2
assign (resid 114  and name c )   (resid 115 and name n )  (resid 115  and name ca )   (resid 115 and name c ) 1.0 -105.0 55.0 2
assign (resid 115  and name c )   (resid 116 and name n )  (resid 116  and name ca )   (resid 116 and name c ) 1.0 -105.0 55.0 2
assign (resid 116  and name c )   (resid 117 and name n )  (resid 117  and name ca )   (resid 117 and name c ) 1.0 -102.0 16.0 2
assign (resid 118  and name c )   (resid 119 and name n )  (resid 119  and name ca )   (resid 119 and name c ) 1.0 -105.0 55.0 2
assign (resid 17  and name n )   (resid 17 and name ca )  (resid 17  and name c )   (resid 18 and name n )   1.0  132.0  23.0 2
assign (resid 22  and name n )   (resid 22 and name ca )  (resid 22  and name c )   (resid 23 and name n )   1.0  119.0 19.0  2
assign (resid 39  and name n )   (resid 39 and name ca )  (resid 39  and name c )   (resid 40 and name n )   1.0  139.0  15.0 2
assign (resid 40  and name n )   (resid 40 and name ca )  (resid 40  and name c )   (resid 41 and name n )   1.0  159.0  19.0 2
assign (resid 47  and name n )   (resid 47 and name ca )  (resid 47  and name c )   (resid 48 and name n ) 1.0 138.0 20.0 2
assign (resid 49  and name n )   (resid 49 and name ca )  (resid 49  and name c )   (resid 50 and name n ) 1.0 -30.0 14.0 2
assign (resid 56  and name n )   (resid 56 and name ca )  (resid 56  and name c )   (resid 57 and name n ) 1.0 129.0 17.0 2
assign (resid 61  and name n )   (resid 61 and name ca )  (resid 61  and name c )   (resid 62 and name n ) 1.0 -33.0 19.0  2
assign (resid 62  and name n )   (resid 62 and name ca )  (resid 62  and name c )   (resid 63 and name n ) 1.0 -31.0 8.0 2
assign (resid 70  and name n )   (resid 70 and name ca )  (resid 70  and name c )   (resid 71 and name n ) 1.0 137.0 23.0 2
assign (resid 99  and name n )   (resid 99 and name ca )  (resid  99 and name c )   (resid 100 and name n ) 1.0 153.0 15.0 2
assign (resid 100  and name n )   (resid 100 and name ca )  (resid 100  and name c )   (resid 101 and name n ) 1.0 135.0 23.0  2
assign (resid 117  and name n )   (resid 117 and name ca )  (resid 117  and name c )   (resid 118 and name n ) 1.0 132.0 18.0 2



end
set message=on echo=on end



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          HT1       ALA   1  24.876  -5.107 -12.756
    2   2H    ALA   1          HT2       ALA   1  23.421  -4.792 -11.939
    3   3H    ALA   1          HT3       ALA   1  24.882  -4.154 -11.354
    4    HA   ALA   1           HA       ALA   1  25.034  -2.950 -13.602
    5   1HB   ALA   1          HB1       ALA   1  22.530  -4.447 -13.662
    6   2HB   ALA   1          HB2       ALA   1  23.390  -3.666 -14.988
    7   3HB   ALA   1          HB3       ALA   1  22.273  -2.734 -13.991
    8    H    ARG   2           HN       ARG   2  22.090  -2.899 -11.552
    9    HA   ARG   2           HA       ARG   2  23.029  -0.308 -10.391
   10   1HB   ARG   2          HB2       ARG   2  20.868   0.681 -10.880
   11   2HB   ARG   2          HB1       ARG   2  21.491  -0.016 -12.376
   12   1HG   ARG   2          HG2       ARG   2  20.153  -2.150 -11.282
   13   2HG   ARG   2          HG1       ARG   2  19.140  -0.794 -10.782
   14   1HD   ARG   2          HD2       ARG   2  19.246   0.003 -13.220
   15   2HD   ARG   2          HD1       ARG   2  19.907  -1.600 -13.600
   16    HE   ARG   2           HE       ARG   2  17.289  -1.247 -12.185
   17   1HH1  ARG   2          HH11      ARG   2  19.404  -3.543 -13.359
   18   2HH1  ARG   2          HH12      ARG   2  18.244  -4.383 -14.333
   19   1HH2  ARG   2          HH21      ARG   2  15.765  -1.997 -13.913
   20   2HH2  ARG   2          HH22      ARG   2  16.185  -3.509 -14.646
   21    H    ILE   3           HN       ILE   3  22.635  -0.204  -8.201
   22    HA   ILE   3           HA       ILE   3  20.515  -1.911  -7.004
   23    HB   ILE   3           HB       ILE   3  22.454  -3.342  -7.016
   24   1HG1  ILE   3          HG12      ILE   3  23.041  -2.656  -4.317
   25   2HG1  ILE   3          HG11      ILE   3  21.338  -2.283  -4.589
   26   1HG2  ILE   3          HG21      ILE   3  24.211  -1.781  -7.486
   27   2HG2  ILE   3          HG22      ILE   3  24.595  -2.499  -5.922
   28   3HG2  ILE   3          HG23      ILE   3  23.896  -0.882  -6.002
   29   1HD1  ILE   3          HD11      ILE   3  21.015  -4.500  -4.200
   30   2HD1  ILE   3          HD12      ILE   3  22.703  -4.897  -4.525
   31   3HD1  ILE   3          HD13      ILE   3  21.571  -4.697  -5.863
   32    H    HIS   4           HN       HIS   4  19.578  -0.865  -5.260
   33    HA   HIS   4           HA       HIS   4  20.296   1.870  -4.668
   34   1HB   HIS   4          HB2       HIS   4  18.266  -0.134  -3.979
   35   2HB   HIS   4          HB1       HIS   4  18.625   0.967  -2.648
   36    HD1  HIS   4           HD1      HIS   4  19.306   3.459  -4.488
   37    HD2  HIS   4           HD2      HIS   4  15.865   1.124  -4.767
   38    HE1  HIS   4           HE1      HIS   4  17.556   4.898  -5.617
   39    H    HIS   5           HN       HIS   5  21.089   2.692  -2.632
   40    HA   HIS   5           HA       HIS   5  23.391   1.678  -1.534
   41   1HB   HIS   5          HB2       HIS   5  22.690   2.972   0.522
   42   2HB   HIS   5          HB1       HIS   5  22.479   3.858  -0.990
   43    HD1  HIS   5           HD1      HIS   5  20.574   2.281   1.806
   44    HD2  HIS   5           HD2      HIS   5  19.743   4.148  -1.827
   45    HE1  HIS   5           HE1      HIS   5  18.089   2.767   1.804
   46    H    HIS   6           HN       HIS   6  23.945   0.210   0.117
   47    HA   HIS   6           HA       HIS   6  21.715  -1.488   1.194
   48   1HB   HIS   6          HB2       HIS   6  23.124  -3.403   0.807
   49   2HB   HIS   6          HB1       HIS   6  23.176  -2.443  -0.672
   50    HD1  HIS   6           HD1      HIS   6  25.168  -2.687   2.582
   51    HD2  HIS   6           HD2      HIS   6  25.763  -1.918  -1.472
   52    HE1  HIS   6           HE1      HIS   6  27.662  -2.380   2.271
   53    H    HIS   7           HN       HIS   7  23.441   0.874   2.258
   54    HA   HIS   7           HA       HIS   7  24.747  -0.501   4.566
   55   1HB   HIS   7          HB2       HIS   7  25.146   1.929   2.960
   56   2HB   HIS   7          HB1       HIS   7  25.300   2.210   4.695
   57    HD1  HIS   7           HD1      HIS   7  27.033   0.586   5.977
   58    HD2  HIS   7           HD2      HIS   7  27.330   0.629   1.819
   59    HE1  HIS   7           HE1      HIS   7  29.284  -0.426   5.408
   60    H    HIS   8           HN       HIS   8  23.457   2.782   4.544
   61    HA   HIS   8           HA       HIS   8  21.890   2.139   6.987
   62   1HB   HIS   8          HB2       HIS   8  23.067   4.554   5.659
   63   2HB   HIS   8          HB1       HIS   8  21.722   4.785   6.776
   64    HD1  HIS   8           HD1      HIS   8  25.325   4.387   6.713
   65    HD2  HIS   8           HD2      HIS   8  22.295   3.470   9.425
   66    HE1  HIS   8           HE1      HIS   8  26.453   4.029   8.952
   67    H    HIS   9           HN       HIS   9  19.669   3.046   7.161
   68    HA   HIS   9           HA       HIS   9  18.243   2.930   4.531
   69   1HB   HIS   9          HB2       HIS   9  17.642   1.217   6.163
   70   2HB   HIS   9          HB1       HIS   9  17.374   2.446   7.400
   71    HD1  HIS   9           HD1      HIS   9  14.885   2.447   7.734
   72    HD2  HIS   9           HD2      HIS   9  15.910   2.458   3.693
   73    HE1  HIS   9           HE1      HIS   9  12.721   2.716   6.447
   74    H    ILE  10           HN       ILE  10  18.687   4.844   7.473
   75    HA   ILE  10           HA       ILE  10  16.848   6.937   6.375
   76    HB   ILE  10           HB       ILE  10  17.946   6.299   9.127
   77   1HG1  ILE  10          HG12      ILE  10  16.027   4.947   8.234
   78   2HG1  ILE  10          HG11      ILE  10  15.606   5.887   9.666
   79   1HG2  ILE  10          HG21      ILE  10  17.562   8.424   9.762
   80   2HG2  ILE  10          HG22      ILE  10  15.906   8.320   9.162
   81   3HG2  ILE  10          HG23      ILE  10  17.202   8.844   8.087
   82   1HD1  ILE  10          HD11      ILE  10  13.959   6.881   8.503
   83   2HD1  ILE  10          HD12      ILE  10  14.432   6.004   7.048
   84   3HD1  ILE  10          HD13      ILE  10  15.167   7.564   7.415
   85    H    GLU  11           HN       GLU  11  19.079   7.063   4.946
   86    HA   GLU  11           HA       GLU  11  21.356   8.382   6.072
   87   1HB   GLU  11          HB2       GLU  11  20.178   8.457   3.274
   88   2HB   GLU  11          HB1       GLU  11  21.842   8.862   3.696
   89   1HG   GLU  11          HG2       GLU  11  22.400   6.691   3.532
   90   2HG   GLU  11          HG1       GLU  11  21.275   6.317   4.839
   91    H    GLY  12           HN       GLY  12  20.001   9.939   7.471
   92   1HA   GLY  12          HA2       GLY  12  19.826  12.523   6.049
   93   2HA   GLY  12          HA1       GLY  12  18.348  11.963   6.833
   94    H    ARG  13           HN       ARG  13  18.508  11.506   9.203
   95    HA   ARG  13           HA       ARG  13  20.494  13.350  10.489
   96   1HB   ARG  13          HB2       ARG  13  17.597  12.837  10.738
   97   2HB   ARG  13          HB1       ARG  13  18.442  12.992  12.279
   98   1HG   ARG  13          HG2       ARG  13  18.880  14.983  10.056
   99   2HG   ARG  13          HG1       ARG  13  17.538  15.160  11.187
  100   1HD   ARG  13          HD2       ARG  13  19.238  14.980  13.074
  101   2HD   ARG  13          HD1       ARG  13  20.501  15.126  11.836
  102    HE   ARG  13           HE       ARG  13  18.685  17.264  12.685
  103   1HH1  ARG  13          HH11      ARG  13  21.632  16.817  11.379
  104   2HH1  ARG  13          HH12      ARG  13  21.483  17.956  10.083
  105   1HH2  ARG  13          HH21      ARG  13  18.067  18.383  10.500
  106   2HH2  ARG  13          HH22      ARG  13  19.465  18.844   9.586
  107    H    ALA  14           HN       ALA  14  20.564  12.644  13.010
  108    HA   ALA  14           HA       ALA  14  21.828  10.020  13.049
  109   1HB   ALA  14          HB1       ALA  14  21.449  12.382  14.783
  110   2HB   ALA  14          HB2       ALA  14  22.882  11.381  14.549
  111   3HB   ALA  14          HB3       ALA  14  21.610  10.856  15.653
  112    HA   PRO  15           HA       PRO  15  18.181   8.899  15.933
  113   1HB   PRO  15          HB2       PRO  15  16.148  10.714  16.207
  114   2HB   PRO  15          HB1       PRO  15  17.579  10.690  17.258
  115   1HG   PRO  15          HG2       PRO  15  16.960  12.453  14.943
  116   2HG   PRO  15          HG1       PRO  15  17.758  12.838  16.475
  117   1HD   PRO  15          HD2       PRO  15  19.099  12.454  14.131
  118   2HD   PRO  15          HD1       PRO  15  19.808  12.148  15.731
  119    H    THR  16           HN       THR  16  16.569  11.171  13.652
  120    HA   THR  16           HA       THR  16  15.664   8.873  12.014
  121    HB   THR  16           HB       THR  16  14.036   9.000  13.829
  122    HG1  THR  16           HG1      THR  16  12.384   8.935  12.509
  123   1HG2  THR  16          HG21      THR  16  14.447  11.862  13.425
  124   2HG2  THR  16          HG22      THR  16  13.822  11.007  14.835
  125   3HG2  THR  16          HG23      THR  16  12.738  11.437  13.512
  126    H    GLU  17           HN       GLU  17  14.752   9.588   9.958
  127    HA   GLU  17           HA       GLU  17  16.011  11.829   8.784
  128   1HB   GLU  17          HB2       GLU  17  14.981   9.698   7.773
  129   2HB   GLU  17          HB1       GLU  17  13.440  10.553   7.849
  130   1HG   GLU  17          HG2       GLU  17  14.868  12.475   6.671
  131   2HG   GLU  17          HG1       GLU  17  15.825  11.094   6.134
  132    H    GLN  18           HN       GLN  18  15.568  13.948   9.275
  133    HA   GLN  18           HA       GLN  18  13.330  14.935  10.654
  134   1HB   GLN  18          HB2       GLN  18  15.589  16.001  10.146
  135   2HB   GLN  18          HB1       GLN  18  14.937  16.413   8.560
  136   1HG   GLN  18          HG2       GLN  18  13.343  17.130  10.992
  137   2HG   GLN  18          HG1       GLN  18  14.741  18.122  10.575
  138   1HE2  GLN  18          HE21      GLN  18  14.767  18.920   8.205
  139   2HE2  GLN  18          HE22      GLN  18  13.272  19.303   7.497
  140    H    SER  19           HN       SER  19  13.926  15.640   7.196
  141    HA   SER  19           HA       SER  19  11.331  16.479   6.529
  142   1HB   SER  19          HB2       SER  19  12.672  16.840   4.735
  143   2HB   SER  19          HB1       SER  19  13.772  15.550   5.212
  144    HG   SER  19           HG       SER  19  12.029  15.528   3.254
  145    HA   PRO  20           HA       PRO  20   8.858  12.859   6.424
  146   1HB   PRO  20          HB2       PRO  20   7.232  13.351   4.280
  147   2HB   PRO  20          HB1       PRO  20   7.086  14.220   5.820
  148   1HG   PRO  20          HG2       PRO  20   8.338  15.088   3.269
  149   2HG   PRO  20          HG1       PRO  20   7.412  16.026   4.450
  150   1HD   PRO  20          HD2       PRO  20  10.149  16.072   4.250
  151   2HD   PRO  20          HD1       PRO  20   9.250  16.459   5.733
  152    H    GLY  21           HN       GLY  21   8.793  10.801   5.424
  153   1HA   GLY  21          HA2       GLY  21  10.562  10.500   3.043
  154   2HA   GLY  21          HA1       GLY  21  10.183   9.215   4.192
  155    H    VAL  22           HN       VAL  22   8.986   7.699   3.139
  156    HA   VAL  22           HA       VAL  22   7.346   8.247   0.832
  157    HB   VAL  22           HB       VAL  22   7.310   5.915   2.778
  158   1HG1  VAL  22          HG11      VAL  22   6.009   6.493   0.208
  159   2HG1  VAL  22          HG12      VAL  22   5.629   5.256   1.406
  160   3HG1  VAL  22          HG13      VAL  22   6.897   4.969   0.214
  161   1HG2  VAL  22          HG21      VAL  22   9.057   6.511   0.371
  162   2HG2  VAL  22          HG22      VAL  22   8.939   4.920   1.122
  163   3HG2  VAL  22          HG23      VAL  22   9.586   6.281   2.037
  164    H    GLN  23           HN       GLN  23   5.168   8.763   0.736
  165    HA   GLN  23           HA       GLN  23   3.396   8.357   3.005
  166   1HB   GLN  23          HB2       GLN  23   4.591  10.387   3.657
  167   2HB   GLN  23          HB1       GLN  23   4.256  11.114   2.085
  168   1HG   GLN  23          HG2       GLN  23   2.462  12.026   3.153
  169   2HG   GLN  23          HG1       GLN  23   1.734  10.442   2.887
  170   1HE2  GLN  23          HE21      GLN  23   2.887   8.813   4.763
  171   2HE2  GLN  23          HE22      GLN  23   2.630   9.406   6.333
  172    H    ASP  24           HN       ASP  24   2.589   7.104   1.031
  173    HA   ASP  24           HA       ASP  24   1.555   8.456  -1.284
  174   1HB   ASP  24          HB2       ASP  24   1.726   5.825  -0.129
  175   2HB   ASP  24          HB1       ASP  24   0.089   6.089  -0.731
  176    H    CYS  25           HN       CYS  25  -1.049   7.619  -1.506
  177    HA   CYS  25           HA       CYS  25  -2.637   8.512   0.785
  178   1HB   CYS  25          HB2       CYS  25  -3.263  10.606  -0.002
  179   2HB   CYS  25          HB1       CYS  25  -1.601  10.524  -0.572
  180    H    TYR  26           HN       TYR  26  -5.074   8.663   0.009
  181    HA   TYR  26           HA       TYR  26  -5.670   6.980  -2.356
  182   1HB   TYR  26          HB2       TYR  26  -6.774   5.265  -1.059
  183   2HB   TYR  26          HB1       TYR  26  -5.159   5.478  -0.386
  184    HD1  TYR  26           HD1      TYR  26  -4.924   5.832   1.895
  185    HD2  TYR  26           HD2      TYR  26  -8.672   6.756   0.042
  186    HE1  TYR  26           HE1      TYR  26  -5.880   6.330   4.119
  187    HE2  TYR  26           HE2      TYR  26  -9.640   7.261   2.269
  188    HH   TYR  26           HH       TYR  26  -8.220   6.347   5.144
  189    H    HIS  27           HN       HIS  27  -7.942   7.083  -2.937
  190    HA   HIS  27           HA       HIS  27  -9.364   9.400  -1.679
  191   1HB   HIS  27          HB2       HIS  27  -8.740   8.586  -4.356
  192   2HB   HIS  27          HB1       HIS  27 -10.494   8.559  -4.172
  193    HD1  HIS  27           HD1      HIS  27  -9.544  10.724  -5.962
  194    HD2  HIS  27           HD2      HIS  27  -9.687  11.250  -1.828
  195    HE1  HIS  27           HE1      HIS  27  -9.612  13.224  -5.560
  196    H    GLY  28           HN       GLY  28 -11.112   8.833  -0.430
  197   1HA   GLY  28          HA2       GLY  28 -13.214   7.745  -0.022
  198   2HA   GLY  28          HA1       GLY  28 -12.814   6.561  -1.269
  199    H    ASP  29           HN       ASP  29 -12.205   4.583  -0.532
  200    HA   ASP  29           HA       ASP  29 -10.895   4.422   2.140
  201   1HB   ASP  29          HB2       ASP  29 -13.469   3.382   1.223
  202   2HB   ASP  29          HB1       ASP  29 -12.438   2.126   1.910
  203    H    GLY  30           HN       GLY  30  -9.303   4.426   0.005
  204   1HA   GLY  30          HA2       GLY  30  -7.597   3.112  -0.955
  205   2HA   GLY  30          HA1       GLY  30  -8.189   1.745  -0.004
  206    H    GLN  31           HN       GLN  31 -10.849   2.992  -1.501
  207    HA   GLN  31           HA       GLN  31 -10.940   0.786  -3.436
  208   1HB   GLN  31          HB2       GLN  31 -12.711   2.649  -2.088
  209   2HB   GLN  31          HB1       GLN  31 -13.092   2.572  -3.809
  210   1HG   GLN  31          HG2       GLN  31 -13.172   0.094  -3.662
  211   2HG   GLN  31          HG1       GLN  31 -12.858   0.203  -1.929
  212   1HE2  GLN  31          HE21      GLN  31 -15.350  -0.665  -3.584
  213   2HE2  GLN  31          HE22      GLN  31 -16.617   0.214  -2.874
  214    H    SER  32           HN       SER  32 -10.584   4.312  -3.540
  215    HA   SER  32           HA       SER  32 -10.609   4.352  -6.491
  216   1HB   SER  32          HB2       SER  32 -11.293   6.091  -4.467
  217   2HB   SER  32          HB1       SER  32  -9.732   6.726  -4.978
  218    HG   SER  32           HG       SER  32 -11.274   7.640  -6.280
  219    H    TYR  33           HN       TYR  33  -8.409   3.054  -4.658
  220    HA   TYR  33           HA       TYR  33  -5.976   4.480  -4.866
  221   1HB   TYR  33          HB2       TYR  33  -6.786   2.113  -3.865
  222   2HB   TYR  33          HB1       TYR  33  -6.001   1.535  -5.335
  223    HD1  TYR  33           HD1      TYR  33  -5.491   3.552  -2.257
  224    HD2  TYR  33           HD2      TYR  33  -3.615   1.532  -5.550
  225    HE1  TYR  33           HE1      TYR  33  -3.280   3.871  -1.189
  226    HE2  TYR  33           HE2      TYR  33  -1.404   1.851  -4.482
  227    HH   TYR  33           HH       TYR  33  -0.547   3.823  -2.576
  228    H    ARG  34           HN       ARG  34  -7.058   1.873  -7.087
  229    HA   ARG  34           HA       ARG  34  -6.558   1.522  -9.372
  230   1HB   ARG  34          HB2       ARG  34  -6.756   4.501  -8.982
  231   2HB   ARG  34          HB1       ARG  34  -6.359   3.846 -10.572
  232   1HG   ARG  34          HG2       ARG  34  -8.506   2.285  -9.634
  233   2HG   ARG  34          HG1       ARG  34  -8.928   3.952  -9.241
  234   1HD   ARG  34          HD2       ARG  34  -7.946   4.271 -11.772
  235   2HD   ARG  34          HD1       ARG  34  -8.679   2.659 -11.890
  236    HE   ARG  34           HE       ARG  34 -10.174   5.062 -11.741
  237   1HH1  ARG  34          HH21      ARG  34 -10.854   1.931 -11.859
  238   2HH1  ARG  34          HH22      ARG  34 -12.102   1.901 -10.658
  239   1HH2  ARG  34          HH11      ARG  34 -11.386   5.073  -9.454
  240   2HH2  ARG  34          HH12      ARG  34 -12.403   3.680  -9.296
  241    H    GLY  35           HN       GLY  35  -4.291   1.764  -7.358
  242   1HA   GLY  35          HA2       GLY  35  -2.147   2.157  -9.380
  243   2HA   GLY  35          HA1       GLY  35  -2.023   3.031  -7.853
  244    H    SER  36           HN       SER  36  -0.262   0.901  -8.941
  245    HA   SER  36           HA       SER  36  -0.760  -1.395  -7.131
  246   1HB   SER  36          HB2       SER  36   0.787  -2.494  -8.512
  247   2HB   SER  36          HB1       SER  36   0.067  -1.337  -9.629
  248    HG   SER  36           HG       SER  36   1.869   0.083  -8.820
  249    H    PHE  37           HN       PHE  37  -0.377   0.614  -5.437
  250    HA   PHE  37           HA       PHE  37   2.415   1.247  -4.891
  251   1HB   PHE  37          HB2       PHE  37   0.370   2.638  -4.364
  252   2HB   PHE  37          HB1       PHE  37  -0.027   1.458  -3.114
  253    HD1  PHE  37           HD1      PHE  37   3.047   3.282  -4.280
  254    HD2  PHE  37           HD2      PHE  37   0.607   2.064  -0.962
  255    HE1  PHE  37           HE1      PHE  37   4.609   4.409  -2.718
  256    HE2  PHE  37           HE2      PHE  37   2.167   3.190   0.598
  257    HZ   PHE  37           HZ       PHE  37   4.169   4.363  -0.277
  258    H    SER  38           HN       SER  38   2.896  -1.257  -4.969
  259    HA   SER  38           HA       SER  38   2.129  -2.966  -2.812
  260   1HB   SER  38          HB2       SER  38   4.030  -4.284  -3.625
  261   2HB   SER  38          HB1       SER  38   3.141  -3.603  -4.986
  262    HG   SER  38           HG       SER  38   4.784  -1.770  -4.567
  263    H    THR  39           HN       THR  39   2.860  -0.413  -1.594
  264    HA   THR  39           HA       THR  39   5.361  -1.176  -0.134
  265    HB   THR  39           HB       THR  39   4.051   1.515  -0.658
  266    HG1  THR  39           HG1      THR  39   6.376   0.235  -1.645
  267   1HG2  THR  39          HG21      THR  39   6.583   2.032   0.223
  268   2HG2  THR  39          HG22      THR  39   6.165   0.625   1.200
  269   3HG2  THR  39          HG23      THR  39   5.153   2.068   1.254
  270    H    THR  40           HN       THR  40   4.961  -1.815   1.958
  271    HA   THR  40           HA       THR  40   2.294  -1.484   3.106
  272    HB   THR  40           HB       THR  40   3.217  -2.898   4.866
  273    HG1  THR  40           HG1      THR  40   5.206  -2.439   5.330
  274   1HG2  THR  40          HG21      THR  40   3.416  -4.765   3.555
  275   2HG2  THR  40          HG22      THR  40   4.617  -4.021   2.498
  276   3HG2  THR  40          HG23      THR  40   2.906  -3.643   2.293
  277    H    VAL  41           HN       VAL  41   1.990  -0.583   5.308
  278    HA   VAL  41           HA       VAL  41   2.834   2.098   5.581
  279    HB   VAL  41           HB       VAL  41   1.527  -0.021   7.216
  280   1HG1  VAL  41          HG11      VAL  41   2.823   2.431   8.421
  281   2HG1  VAL  41          HG12      VAL  41   2.918   0.760   8.978
  282   3HG1  VAL  41          HG13      VAL  41   1.416   1.666   9.161
  283   1HG2  VAL  41          HG21      VAL  41   0.160   2.321   7.565
  284   2HG2  VAL  41          HG22      VAL  41  -0.109   1.214   6.219
  285   3HG2  VAL  41          HG23      VAL  41   0.941   2.615   6.011
  286    H    THR  42           HN       THR  42   4.434  -0.875   6.530
  287    HA   THR  42           HA       THR  42   6.364   0.545   8.267
  288    HB   THR  42           HB       THR  42   6.375  -2.342   7.360
  289    HG1  THR  42           HG1      THR  42   5.106  -2.664   9.280
  290   1HG2  THR  42          HG21      THR  42   8.225  -1.043   8.788
  291   2HG2  THR  42          HG22      THR  42   7.792  -2.716   9.137
  292   3HG2  THR  42          HG23      THR  42   7.102  -1.408  10.097
  293    H    GLY  43           HN       GLY  43   6.017   0.339   5.015
  294   1HA   GLY  43          HA2       GLY  43   7.642   1.048   3.409
  295   2HA   GLY  43          HA1       GLY  43   8.914   0.718   4.585
  296    H    ARG  44           HN       ARG  44   6.903  -1.910   4.646
  297    HA   ARG  44           HA       ARG  44   8.817  -3.628   3.314
  298   1HB   ARG  44          HB2       ARG  44   6.858  -3.885   5.195
  299   2HB   ARG  44          HB1       ARG  44   6.049  -4.569   3.784
  300   1HG   ARG  44          HG2       ARG  44   7.208  -6.373   4.890
  301   2HG   ARG  44          HG1       ARG  44   8.097  -6.001   3.413
  302   1HD   ARG  44          HD2       ARG  44   9.708  -6.225   5.230
  303   2HD   ARG  44          HD1       ARG  44   9.604  -4.505   4.808
  304    HE   ARG  44           HE       ARG  44   7.615  -5.074   6.773
  305   1HH1  ARG  44          HH21      ARG  44   9.977  -6.606   7.880
  306   2HH1  ARG  44          HH22      ARG  44  10.749  -5.399   8.854
  307   1HH2  ARG  44          HH11      ARG  44   9.057  -2.752   7.385
  308   2HH2  ARG  44          HH12      ARG  44  10.228  -3.217   8.574
  309    H    THR  45           HN       THR  45   7.262  -5.382   1.842
  310    HA   THR  45           HA       THR  45   6.218  -3.682  -0.403
  311    HB   THR  45           HB       THR  45   7.762  -6.271  -0.671
  312    HG1  THR  45           HG1      THR  45   9.443  -5.165  -0.132
  313   1HG2  THR  45          HG21      THR  45   6.776  -5.868  -2.728
  314   2HG2  THR  45          HG22      THR  45   8.271  -4.950  -2.913
  315   3HG2  THR  45          HG23      THR  45   6.771  -4.119  -2.499
  316    H    CYS  46           HN       CYS  46   4.271  -4.386  -1.275
  317    HA   CYS  46           HA       CYS  46   2.642  -6.260   0.096
  318   1HB   CYS  46          HB2       CYS  46   1.632  -4.538  -1.192
  319   2HB   CYS  46          HB1       CYS  46   2.598  -4.930  -2.613
  320    H    GLN  47           HN       GLN  47   3.457  -8.385   0.228
  321    HA   GLN  47           HA       GLN  47   4.928  -9.766  -1.758
  322   1HB   GLN  47          HB2       GLN  47   4.841 -10.636   0.440
  323   2HB   GLN  47          HB1       GLN  47   3.084 -10.555   0.501
  324   1HG   GLN  47          HG2       GLN  47   3.582 -12.255  -1.651
  325   2HG   GLN  47          HG1       GLN  47   4.818 -12.697  -0.477
  326   1HE2  GLN  47          HE21      GLN  47   1.348 -12.670  -1.089
  327   2HE2  GLN  47          HE22      GLN  47   0.910 -13.550   0.295
  328    H    SER  48           HN       SER  48   4.244 -11.135  -3.488
  329    HA   SER  48           HA       SER  48   1.986 -10.460  -5.006
  330   1HB   SER  48          HB2       SER  48   3.409 -13.130  -4.729
  331   2HB   SER  48          HB1       SER  48   2.400 -12.658  -6.094
  332    HG   SER  48           HG       SER  48   4.970 -12.161  -5.697
  333    H    TRP  49           HN       TRP  49  -0.202 -10.970  -4.797
  334    HA   TRP  49           HA       TRP  49  -1.261 -12.062  -2.399
  335   1HB   TRP  49          HB2       TRP  49  -2.358 -11.960  -5.231
  336   2HB   TRP  49          HB1       TRP  49  -3.333 -12.281  -3.800
  337    HD1  TRP  49           HD1      TRP  49  -2.088  -9.496  -5.884
  338    HE1  TRP  49           HE1      TRP  49  -2.564  -7.249  -4.736
  339    HE3  TRP  49           HE3      TRP  49  -3.326 -11.102  -1.251
  340    HZ2  TRP  49           HZ2      TRP  49  -3.343  -6.250  -2.195
  341    HZ3  TRP  49           HZ3      TRP  49  -3.932  -9.503   0.546
  342    HH2  TRP  49           HH2      TRP  49  -3.943  -7.066   0.075
  343    H    SER  50           HN       SER  50  -0.473 -13.501  -5.516
  344    HA   SER  50           HA       SER  50  -1.275 -16.210  -4.788
  345   1HB   SER  50          HB2       SER  50  -1.296 -15.104  -7.058
  346   2HB   SER  50          HB1       SER  50   0.464 -15.167  -7.037
  347    HG   SER  50           HG       SER  50  -0.057 -17.037  -7.983
  348    H    SER  51           HN       SER  51   0.852 -14.885  -3.046
  349    HA   SER  51           HA       SER  51   3.291 -16.421  -3.729
  350   1HB   SER  51          HB2       SER  51   3.823 -14.275  -2.990
  351   2HB   SER  51          HB1       SER  51   2.479 -14.228  -1.854
  352    HG   SER  51           HG       SER  51   5.039 -15.097  -1.511
  353    H    MET  52           HN       MET  52   2.900 -18.587  -3.207
  354    HA   MET  52           HA       MET  52   1.682 -19.190  -0.559
  355   1HB   MET  52          HB2       MET  52   2.474 -21.144  -2.722
  356   2HB   MET  52          HB1       MET  52   1.214 -21.311  -1.507
  357   1HG   MET  52          HG2       MET  52   1.167 -19.766  -4.069
  358   2HG   MET  52          HG1       MET  52  -0.059 -20.820  -3.380
  359   1HE   MET  52          HE1       MET  52   0.089 -20.104  -0.641
  360   2HE   MET  52          HE2       MET  52  -1.598 -19.688  -0.878
  361   3HE   MET  52          HE3       MET  52  -0.511 -18.536  -0.108
  362    H    THR  53           HN       THR  53   4.476 -18.159  -0.909
  363    HA   THR  53           HA       THR  53   6.098 -20.526  -0.113
  364    HB   THR  53           HB       THR  53   7.720 -18.265  -0.181
  365    HG1  THR  53           HG1      THR  53   5.822 -18.124  -2.278
  366   1HG2  THR  53          HG21      THR  53   7.455 -20.705  -1.499
  367   2HG2  THR  53          HG22      THR  53   8.776 -19.552  -1.699
  368   3HG2  THR  53          HG23      THR  53   7.395 -19.510  -2.796
  369    HA   PRO  54           HA       PRO  54   6.834 -17.753   3.656
  370   1HB   PRO  54          HB2       PRO  54   5.825 -15.209   3.713
  371   2HB   PRO  54          HB1       PRO  54   7.413 -15.602   3.025
  372   1HG   PRO  54          HG2       PRO  54   4.833 -15.076   1.649
  373   2HG   PRO  54          HG1       PRO  54   6.480 -14.636   1.173
  374   1HD   PRO  54          HD2       PRO  54   5.085 -16.738   0.101
  375   2HD   PRO  54          HD1       PRO  54   6.858 -16.636   0.151
  376    H    HIS  55           HN       HIS  55   4.057 -15.656   3.331
  377    HA   HIS  55           HA       HIS  55   2.565 -17.342   5.261
  378   1HB   HIS  55          HB2       HIS  55   1.446 -14.823   4.107
  379   2HB   HIS  55          HB1       HIS  55   1.455 -15.377   5.778
  380    HD1  HIS  55           HD1      HIS  55   3.570 -13.606   3.231
  381    HD2  HIS  55           HD2      HIS  55   3.760 -14.622   7.268
  382    HE1  HIS  55           HE1      HIS  55   5.555 -12.375   4.183
  383    H    TRP  56           HN       TRP  56   1.234 -18.908   4.427
  384    HA   TRP  56           HA       TRP  56   0.247 -18.683   1.651
  385   1HB   TRP  56          HB2       TRP  56   1.229 -20.750   2.865
  386   2HB   TRP  56          HB1       TRP  56  -0.347 -20.863   3.651
  387    HD1  TRP  56           HD1      TRP  56  -2.435 -20.507   1.626
  388    HE1  TRP  56           HE1      TRP  56  -2.646 -21.859  -0.527
  389    HE3  TRP  56           HE3      TRP  56   2.332 -22.189   1.222
  390    HZ2  TRP  56           HZ2      TRP  56  -1.009 -23.466  -2.218
  391    HZ3  TRP  56           HZ3      TRP  56   2.987 -23.618  -0.679
  392    HH2  TRP  56           HH2      TRP  56   1.332 -24.275  -2.401
  393    H    HIS  57           HN       HIS  57  -1.937 -18.526   1.097
  394    HA   HIS  57           HA       HIS  57  -4.055 -18.618   3.109
  395   1HB   HIS  57          HB2       HIS  57  -4.645 -16.202   2.774
  396   2HB   HIS  57          HB1       HIS  57  -3.065 -16.413   3.531
  397    HD1  HIS  57           HD1      HIS  57  -4.491 -16.009   0.018
  398    HD2  HIS  57           HD2      HIS  57  -1.047 -15.096   2.181
  399    HE1  HIS  57           HE1      HIS  57  -2.980 -14.730  -1.553
  400    H    GLN  58           HN       GLN  58  -6.009 -19.062   2.074
  401    HA   GLN  58           HA       GLN  58  -5.936 -19.448  -0.841
  402   1HB   GLN  58          HB2       GLN  58  -7.661 -20.146   1.490
  403   2HB   GLN  58          HB1       GLN  58  -8.437 -20.105  -0.093
  404   1HG   GLN  58          HG2       GLN  58  -6.802 -21.680  -0.983
  405   2HG   GLN  58          HG1       GLN  58  -5.911 -21.658   0.539
  406   1HE2  GLN  58          HE21      GLN  58  -7.449 -22.225   2.537
  407   2HE2  GLN  58          HE22      GLN  58  -8.497 -23.536   2.287
  408    H    ARG  59           HN       ARG  59  -8.333 -18.826  -1.809
  409    HA   ARG  59           HA       ARG  59  -9.588 -17.013  -2.660
  410   1HB   ARG  59          HB2       ARG  59  -9.718 -17.174   0.181
  411   2HB   ARG  59          HB1       ARG  59  -9.672 -15.462  -0.243
  412   1HG   ARG  59          HG2       ARG  59 -11.981 -16.072  -0.287
  413   2HG   ARG  59          HG1       ARG  59 -11.477 -15.987  -1.976
  414   1HD   ARG  59          HD2       ARG  59 -12.630 -18.046  -1.889
  415   2HD   ARG  59          HD1       ARG  59 -10.944 -18.551  -1.654
  416    HE   ARG  59           HE       ARG  59 -12.853 -18.095   0.610
  417   1HH1  ARG  59          HH11      ARG  59 -11.225 -20.498  -1.003
  418   2HH1  ARG  59          HH12      ARG  59 -10.415 -21.148   0.383
  419   1HH2  ARG  59          HH21      ARG  59 -11.339 -18.544   2.476
  420   2HH2  ARG  59          HH22      ARG  59 -10.480 -20.042   2.352
  421    H    THR  60           HN       THR  60  -7.387 -16.451  -3.756
  422    HA   THR  60           HA       THR  60  -6.157 -13.971  -2.637
  423    HB   THR  60           HB       THR  60  -4.511 -15.522  -3.332
  424    HG1  THR  60           HG1      THR  60  -3.519 -14.415  -4.887
  425   1HG2  THR  60          HG21      THR  60  -6.350 -16.020  -5.669
  426   2HG2  THR  60          HG22      THR  60  -5.783 -17.179  -4.467
  427   3HG2  THR  60          HG23      THR  60  -4.669 -16.552  -5.681
  428    H    THR  61           HN       THR  61  -5.725 -12.215  -4.176
  429    HA   THR  61           HA       THR  61  -8.101 -11.585  -5.777
  430    HB   THR  61           HB       THR  61  -6.284  -9.587  -6.190
  431    HG1  THR  61           HG1      THR  61  -5.629  -9.897  -3.620
  432   1HG2  THR  61          HG21      THR  61  -8.573  -9.461  -5.193
  433   2HG2  THR  61          HG22      THR  61  -7.400  -8.448  -4.353
  434   3HG2  THR  61          HG23      THR  61  -7.892  -9.989  -3.654
  435    H    GLU  62           HN       GLU  62  -5.100 -13.163  -6.247
  436    HA   GLU  62           HA       GLU  62  -4.538 -12.381  -8.941
  437   1HB   GLU  62          HB2       GLU  62  -2.882 -13.472  -7.522
  438   2HB   GLU  62          HB1       GLU  62  -3.944 -14.863  -7.302
  439   1HG   GLU  62          HG2       GLU  62  -2.858 -15.783  -9.060
  440   2HG   GLU  62          HG1       GLU  62  -3.758 -14.642 -10.061
  441    H    TYR  63           HN       TYR  63  -6.712 -14.591  -7.400
  442    HA   TYR  63           HA       TYR  63  -7.516 -15.772  -9.989
  443   1HB   TYR  63          HB2       TYR  63  -7.251 -16.705  -7.369
  444   2HB   TYR  63          HB1       TYR  63  -8.995 -16.558  -7.593
  445    HD1  TYR  63           HD1      TYR  63  -6.767 -19.001  -7.570
  446    HD2  TYR  63           HD2      TYR  63  -9.328 -17.110 -10.455
  447    HE1  TYR  63           HE1      TYR  63  -6.769 -21.076  -8.928
  448    HE2  TYR  63           HE2      TYR  63  -9.330 -19.186 -11.813
  449    HH   TYR  63           HH       TYR  63  -8.756 -21.349 -11.862
  450    H    TYR  64           HN       TYR  64  -8.155 -13.009  -8.289
  451    HA   TYR  64           HA       TYR  64 -10.980 -12.922  -9.310
  452   1HB   TYR  64          HB2       TYR  64  -9.804 -12.361  -6.614
  453   2HB   TYR  64          HB1       TYR  64 -11.175 -11.385  -7.142
  454    HD1  TYR  64           HD1      TYR  64 -10.026 -14.792  -6.308
  455    HD2  TYR  64           HD2      TYR  64 -13.376 -12.366  -7.469
  456    HE1  TYR  64           HE1      TYR  64 -11.568 -16.650  -5.744
  457    HE2  TYR  64           HE2      TYR  64 -14.917 -14.225  -6.905
  458    HH   TYR  64           HH       TYR  64 -13.675 -17.325  -5.649
  459    HA   PRO  65           HA       PRO  65  -8.665  -9.375 -11.013
  460   1HB   PRO  65          HB2       PRO  65 -10.119  -9.253 -13.328
  461   2HB   PRO  65          HB1       PRO  65  -8.737 -10.347 -13.112
  462   1HG   PRO  65          HG2       PRO  65 -11.651 -10.926 -12.957
  463   2HG   PRO  65          HG1       PRO  65 -10.339 -11.906 -13.629
  464   1HD   PRO  65          HD2       PRO  65 -11.464 -12.357 -11.183
  465   2HD   PRO  65          HD1       PRO  65  -9.795 -12.803 -11.597
  466    H    ASN  66           HN       ASN  66 -11.979  -9.967 -10.230
  467    HA   ASN  66           HA       ASN  66 -13.279  -7.572 -10.954
  468   1HB   ASN  66          HB2       ASN  66 -14.072  -9.765  -9.785
  469   2HB   ASN  66          HB1       ASN  66 -13.656  -8.929  -8.288
  470   1HD2  ASN  66          HD21      ASN  66 -16.382  -9.635  -9.028
  471   2HD2  ASN  66          HD22      ASN  66 -17.242  -8.186  -9.234
  472    H    GLY  67           HN       GLY  67 -10.729  -8.068  -8.667
  473   1HA   GLY  67          HA2       GLY  67 -11.309  -5.554  -7.221
  474   2HA   GLY  67          HA1       GLY  67 -10.001  -6.679  -6.851
  475    H    GLY  68           HN       GLY  68  -8.845  -6.902  -9.411
  476   1HA   GLY  68          HA2       GLY  68  -7.695  -5.615 -11.080
  477   2HA   GLY  68          HA1       GLY  68  -8.184  -4.139 -10.244
  478    H    LEU  69           HN       LEU  69  -7.026  -6.541  -8.131
  479    HA   LEU  69           HA       LEU  69  -4.347  -5.192  -8.039
  480   1HB   LEU  69          HB2       LEU  69  -4.492  -5.396  -5.634
  481   2HB   LEU  69          HB1       LEU  69  -6.009  -4.699  -6.201
  482    HG   LEU  69           HG       LEU  69  -6.367  -7.493  -6.309
  483   1HD1  LEU  69          HD11      LEU  69  -4.923  -8.292  -4.755
  484   2HD1  LEU  69          HD12      LEU  69  -5.953  -7.497  -3.566
  485   3HD1  LEU  69          HD13      LEU  69  -4.520  -6.674  -4.184
  486   1HD2  LEU  69          HD21      LEU  69  -8.301  -6.793  -5.387
  487   2HD2  LEU  69          HD22      LEU  69  -7.605  -5.176  -5.281
  488   3HD2  LEU  69          HD23      LEU  69  -7.464  -6.287  -3.919
  489    H    THR  70           HN       THR  70  -3.832  -7.047  -9.598
  490    HA   THR  70           HA       THR  70  -3.604  -9.702  -8.277
  491    HB   THR  70           HB       THR  70  -4.558  -9.376 -10.582
  492    HG1  THR  70           HG1      THR  70  -3.863 -11.349 -10.610
  493   1HG2  THR  70          HG21      THR  70  -1.706  -8.542 -11.171
  494   2HG2  THR  70          HG22      THR  70  -3.151  -7.544 -11.335
  495   3HG2  THR  70          HG23      THR  70  -2.906  -8.925 -12.405
  496    H    ARG  71           HN       ARG  71  -1.516 -10.838  -8.404
  497    HA   ARG  71           HA       ARG  71   0.848 -10.987  -8.327
  498   1HB   ARG  71          HB2       ARG  71   0.393  -9.226 -10.279
  499   2HB   ARG  71          HB1       ARG  71   1.090  -8.108  -9.106
  500   1HG   ARG  71          HG2       ARG  71   2.894 -10.072  -8.882
  501   2HG   ARG  71          HG1       ARG  71   2.366 -10.397 -10.534
  502   1HD   ARG  71          HD2       ARG  71   2.896  -8.107 -11.206
  503   2HD   ARG  71          HD1       ARG  71   3.318  -7.688  -9.534
  504    HE   ARG  71           HE       ARG  71   4.865  -9.933 -10.094
  505   1HH1  ARG  71          HH21      ARG  71   4.727  -8.706 -12.908
  506   2HH1  ARG  71          HH22      ARG  71   6.174  -7.754 -12.913
  507   1HH2  ARG  71          HH11      ARG  71   6.596  -7.890  -9.475
  508   2HH2  ARG  71          HH12      ARG  71   7.232  -7.292 -10.970
  509    H    ASN  72           HN       ASN  72   2.427  -8.491  -7.657
  510    HA   ASN  72           HA       ASN  72   2.012  -8.626  -4.735
  511   1HB   ASN  72          HB2       ASN  72   4.243  -7.825  -4.668
  512   2HB   ASN  72          HB1       ASN  72   4.202  -8.825  -6.118
  513   1HD2  ASN  72          HD21      ASN  72   3.629  -5.397  -5.155
  514   2HD2  ASN  72          HD22      ASN  72   4.277  -4.727  -6.572
  515    H    TYR  73           HN       TYR  73   0.334  -6.930  -6.832
  516    HA   TYR  73           HA       TYR  73   0.834  -4.157  -6.152
  517   1HB   TYR  73          HB2       TYR  73  -1.560  -5.686  -7.236
  518   2HB   TYR  73          HB1       TYR  73  -1.489  -3.928  -7.150
  519    HD1  TYR  73           HD1      TYR  73   1.807  -4.863  -7.643
  520    HD2  TYR  73           HD2      TYR  73  -1.932  -4.721  -9.757
  521    HE1  TYR  73           HE1      TYR  73   3.027  -4.803  -9.801
  522    HE2  TYR  73           HE2      TYR  73  -0.710  -4.662 -11.913
  523    HH   TYR  73           HH       TYR  73   2.305  -5.558 -12.344
  524    H    CYS  74           HN       CYS  74  -0.056  -2.922  -4.517
  525    HA   CYS  74           HA       CYS  74  -1.408  -4.366  -2.300
  526   1HB   CYS  74          HB2       CYS  74   0.549  -2.987  -1.816
  527   2HB   CYS  74          HB1       CYS  74  -0.190  -1.601  -2.618
  528    H    ARG  75           HN       ARG  75  -3.612  -4.211  -2.088
  529    HA   ARG  75           HA       ARG  75  -4.984  -1.739  -3.022
  530   1HB   ARG  75          HB2       ARG  75  -5.146  -4.510  -4.128
  531   2HB   ARG  75          HB1       ARG  75  -6.638  -3.570  -4.067
  532   1HG   ARG  75          HG2       ARG  75  -4.458  -1.929  -5.035
  533   2HG   ARG  75          HG1       ARG  75  -4.602  -3.392  -6.010
  534   1HD   ARG  75          HD2       ARG  75  -7.229  -2.722  -5.789
  535   2HD   ARG  75          HD1       ARG  75  -6.484  -1.111  -5.756
  536    HE   ARG  75           HE       ARG  75  -5.554  -3.024  -7.832
  537   1HH1  ARG  75          HH11      ARG  75  -8.211  -1.059  -7.431
  538   2HH1  ARG  75          HH12      ARG  75  -7.894  -0.031  -8.788
  539   1HH2  ARG  75          HH21      ARG  75  -4.730  -1.327  -9.367
  540   2HH2  ARG  75          HH22      ARG  75  -5.922  -0.182  -9.884
  541    H    ASN  76           HN       ASN  76  -7.473  -2.060  -2.469
  542    HA   ASN  76           HA       ASN  76  -7.629  -3.280   0.264
  543   1HB   ASN  76          HB2       ASN  76  -7.758  -0.722  -0.205
  544   2HB   ASN  76          HB1       ASN  76  -9.369  -1.072  -0.834
  545   1HD2  ASN  76          HD21      ASN  76  -9.368   0.536   1.372
  546   2HD2  ASN  76          HD22      ASN  76  -9.832  -0.320   2.763
  547    HA   PRO  77           HA       PRO  77 -10.615  -5.623  -2.304
  548   1HB   PRO  77          HB2       PRO  77 -10.229  -8.004  -1.012
  549   2HB   PRO  77          HB1       PRO  77  -9.193  -7.451  -2.344
  550   1HG   PRO  77          HG2       PRO  77  -8.695  -7.410   0.584
  551   2HG   PRO  77          HG1       PRO  77  -7.570  -7.702  -0.750
  552   1HD   PRO  77          HD2       PRO  77  -7.771  -5.326   0.618
  553   2HD   PRO  77          HD1       PRO  77  -7.144  -5.480  -1.038
  554    H    ASP  78           HN       ASP  78 -10.465  -4.474   0.802
  555    HA   ASP  78           HA       ASP  78 -13.095  -5.710   1.556
  556   1HB   ASP  78          HB2       ASP  78 -10.552  -5.375   2.902
  557   2HB   ASP  78          HB1       ASP  78 -11.832  -4.566   3.807
  558    H    ALA  79           HN       ALA  79 -11.671  -2.899   0.438
  559    HA   ALA  79           HA       ALA  79 -12.457  -0.674   0.306
  560   1HB   ALA  79          HB1       ALA  79 -14.687  -0.755  -0.082
  561   2HB   ALA  79          HB2       ALA  79 -15.017  -1.160   1.602
  562   3HB   ALA  79          HB3       ALA  79 -14.641  -2.437   0.445
  563    H    GLU  80           HN       GLU  80 -11.297  -1.922   2.896
  564    HA   GLU  80           HA       GLU  80 -12.520  -0.593   5.141
  565   1HB   GLU  80          HB2       GLU  80 -10.527  -2.466   4.634
  566   2HB   GLU  80          HB1       GLU  80  -9.636  -1.092   5.290
  567   1HG   GLU  80          HG2       GLU  80 -10.529  -1.346   7.363
  568   2HG   GLU  80          HG1       GLU  80 -12.135  -1.706   6.727
  569    H    ILE  81           HN       ILE  81 -10.708   0.885   6.441
  570    HA   ILE  81           HA       ILE  81 -10.797   3.473   5.451
  571    HB   ILE  81           HB       ILE  81  -8.650   3.730   6.881
  572   1HG1  ILE  81          HG12      ILE  81  -8.983   1.196   8.189
  573   2HG1  ILE  81          HG11      ILE  81  -8.670   0.903   6.479
  574   1HG2  ILE  81          HG21      ILE  81  -9.912   3.341   8.947
  575   2HG2  ILE  81          HG22      ILE  81 -11.058   2.323   8.075
  576   3HG2  ILE  81          HG23      ILE  81 -10.967   4.048   7.723
  577   1HD1  ILE  81          HD11      ILE  81  -6.600   1.102   7.950
  578   2HD1  ILE  81          HD12      ILE  81  -7.005   2.808   8.137
  579   3HD1  ILE  81          HD13      ILE  81  -6.634   2.160   6.539
  580    H    SER  82           HN       SER  82  -8.451   0.950   4.630
  581    HA   SER  82           HA       SER  82  -7.660   2.415   2.214
  582   1HB   SER  82          HB2       SER  82  -5.406   1.772   4.062
  583   2HB   SER  82          HB1       SER  82  -5.560   3.086   2.901
  584    HG   SER  82           HG       SER  82  -5.812   3.386   5.382
  585    HA   PRO  83           HA       PRO  83  -6.595  -1.647   0.958
  586   1HB   PRO  83          HB2       PRO  83  -4.444  -1.268  -0.679
  587   2HB   PRO  83          HB1       PRO  83  -6.088  -0.766  -1.118
  588   1HG   PRO  83          HG2       PRO  83  -3.803   0.858  -0.189
  589   2HG   PRO  83          HG1       PRO  83  -5.116   1.281  -1.294
  590   1HD   PRO  83          HD2       PRO  83  -4.947   2.043   1.378
  591   2HD   PRO  83          HD1       PRO  83  -6.417   2.071   0.386
  592    H    TRP  84           HN       TRP  84  -4.974  -3.370   1.091
  593    HA   TRP  84           HA       TRP  84  -2.514  -2.835   2.658
  594   1HB   TRP  84          HB2       TRP  84  -3.288  -4.551   4.351
  595   2HB   TRP  84          HB1       TRP  84  -4.235  -3.063   4.362
  596    HD1  TRP  84           HD1      TRP  84  -6.734  -3.185   3.646
  597    HE1  TRP  84           HE1      TRP  84  -8.330  -5.131   3.088
  598    HE3  TRP  84           HE3      TRP  84  -3.365  -7.001   3.244
  599    HZ2  TRP  84           HZ2      TRP  84  -8.195  -7.936   2.541
  600    HZ3  TRP  84           HZ3      TRP  84  -4.124  -9.297   2.705
  601    HH2  TRP  84           HH2      TRP  84  -6.532  -9.769   2.354
  602    H    CYS  85           HN       CYS  85  -1.551  -5.282   3.108
  603    HA   CYS  85           HA       CYS  85  -2.282  -7.333   1.231
  604   1HB   CYS  85          HB2       CYS  85  -1.672  -5.786  -0.472
  605   2HB   CYS  85          HB1       CYS  85  -0.235  -5.268   0.408
  606    H    TYR  86           HN       TYR  86  -0.682  -9.069   1.134
  607    HA   TYR  86           HA       TYR  86   0.673  -9.564   3.613
  608   1HB   TYR  86          HB2       TYR  86   1.158 -10.851   0.907
  609   2HB   TYR  86          HB1       TYR  86   1.310 -11.605   2.495
  610    HD1  TYR  86           HD1      TYR  86  -0.611 -11.986  -0.192
  611    HD2  TYR  86           HD2      TYR  86  -1.102 -10.698   3.878
  612    HE1  TYR  86           HE1      TYR  86  -2.998 -12.654  -0.261
  613    HE2  TYR  86           HE2      TYR  86  -3.486 -11.366   3.805
  614    HH   TYR  86           HH       TYR  86  -4.766 -13.382   1.706
  615    H    THR  87           HN       THR  87   3.063  -9.778   3.870
  616    HA   THR  87           HA       THR  87   4.517  -7.779   2.174
  617    HB   THR  87           HB       THR  87   5.792  -7.307   4.092
  618    HG1  THR  87           HG1      THR  87   6.538  -8.993   5.058
  619   1HG2  THR  87          HG21      THR  87   4.214  -6.644   5.615
  620   2HG2  THR  87          HG22      THR  87   3.424  -8.220   5.643
  621   3HG2  THR  87          HG23      THR  87   3.123  -7.106   4.311
  622    H    MET  88           HN       MET  88   6.505  -8.360   1.243
  623    HA   MET  88           HA       MET  88   6.953 -11.116   0.580
  624   1HB   MET  88          HB2       MET  88   8.118  -8.463   0.127
  625   2HB   MET  88          HB1       MET  88   9.333  -9.742   0.165
  626   1HG   MET  88          HG2       MET  88   8.639 -10.604  -1.809
  627   2HG   MET  88          HG1       MET  88   6.939 -10.491  -1.351
  628   1HE   MET  88          HE1       MET  88   7.496  -9.847  -4.412
  629   2HE   MET  88          HE2       MET  88   6.314  -8.539  -4.404
  630   3HE   MET  88          HE3       MET  88   6.052  -9.960  -3.395
  631    H    ASP  89           HN       ASP  89   7.525  -9.511   3.508
  632    HA   ASP  89           HA       ASP  89   9.923 -11.135   4.171
  633   1HB   ASP  89          HB2       ASP  89   8.938  -8.514   4.750
  634   2HB   ASP  89          HB1       ASP  89   9.026  -9.403   6.271
  635    HA   PRO  90           HA       PRO  90   7.190 -13.933   6.261
  636   1HB   PRO  90          HB2       PRO  90   9.140 -15.344   7.579
  637   2HB   PRO  90          HB1       PRO  90   8.772 -15.572   5.858
  638   1HG   PRO  90          HG2       PRO  90  10.966 -14.010   7.133
  639   2HG   PRO  90          HG1       PRO  90  11.001 -15.032   5.687
  640   1HD   PRO  90          HD2       PRO  90  10.884 -12.319   5.572
  641   2HD   PRO  90          HD1       PRO  90  10.171 -13.370   4.328
  642    H    ASN  91           HN       ASN  91   9.126 -11.515   7.612
  643    HA   ASN  91           HA       ASN  91   8.455 -12.118  10.430
  644   1HB   ASN  91          HB2       ASN  91   9.731  -9.631   9.265
  645   2HB   ASN  91          HB1       ASN  91   9.935 -10.297  10.886
  646   1HD2  ASN  91          HD21      ASN  91  12.222  -9.795   9.298
  647   2HD2  ASN  91          HD22      ASN  91  12.916 -11.273   8.836
  648    H    VAL  92           HN       VAL  92   6.975 -10.639   7.766
  649    HA   VAL  92           HA       VAL  92   5.169  -9.070   9.569
  650    HB   VAL  92           HB       VAL  92   6.160  -8.362   6.782
  651   1HG1  VAL  92          HG11      VAL  92   4.611  -6.763   8.850
  652   2HG1  VAL  92          HG12      VAL  92   3.933  -7.445   7.372
  653   3HG1  VAL  92          HG13      VAL  92   5.146  -6.168   7.278
  654   1HG2  VAL  92          HG21      VAL  92   7.864  -8.331   8.713
  655   2HG2  VAL  92          HG22      VAL  92   6.905  -7.011   9.383
  656   3HG2  VAL  92          HG23      VAL  92   7.668  -6.832   7.804
  657    H    ARG  93           HN       ARG  93   3.654 -10.893   9.492
  658    HA   ARG  93           HA       ARG  93   2.731 -12.400   7.394
  659   1HB   ARG  93          HB2       ARG  93   1.596 -11.180   9.834
  660   2HB   ARG  93          HB1       ARG  93   0.395 -11.686   8.645
  661   1HG   ARG  93          HG2       ARG  93   2.651 -13.512   9.473
  662   2HG   ARG  93          HG1       ARG  93   1.144 -13.439  10.387
  663   1HD   ARG  93          HD2       ARG  93  -0.137 -14.263   8.580
  664   2HD   ARG  93          HD1       ARG  93   1.121 -13.861   7.393
  665    HE   ARG  93           HE       ARG  93   2.379 -15.611   9.144
  666   1HH1  ARG  93          HH21      ARG  93  -0.854 -16.008   8.380
  667   2HH1  ARG  93          HH22      ARG  93  -0.670 -17.549   7.611
  668   1HH2  ARG  93          HH11      ARG  93   2.795 -17.452   7.646
  669   2HH2  ARG  93          HH12      ARG  93   1.394 -18.366   7.195
  670    H    TRP  94           HN       TRP  94   1.238  -9.257   8.236
  671    HA   TRP  94           HA       TRP  94   1.037  -8.485   5.399
  672   1HB   TRP  94          HB2       TRP  94  -1.383  -8.575   5.353
  673   2HB   TRP  94          HB1       TRP  94  -0.819 -10.146   5.925
  674    HD1  TRP  94           HD1      TRP  94  -1.261 -10.787   8.438
  675    HE1  TRP  94           HE1      TRP  94  -2.746  -9.750  10.276
  676    HE3  TRP  94           HE3      TRP  94  -2.332  -6.291   6.274
  677    HZ2  TRP  94           HZ2      TRP  94  -4.192  -7.326  10.764
  678    HZ3  TRP  94           HZ3      TRP  94  -3.758  -4.640   7.442
  679    HH2  TRP  94           HH2      TRP  94  -4.687  -5.146   9.681
  680    H    GLU  95           HN       GLU  95  -0.257  -6.294   5.325
  681    HA   GLU  95           HA       GLU  95  -0.657  -4.803   7.759
  682   1HB   GLU  95          HB2       GLU  95   1.856  -5.218   7.692
  683   2HB   GLU  95          HB1       GLU  95   1.905  -4.176   6.270
  684   1HG   GLU  95          HG2       GLU  95   1.764  -2.316   7.534
  685   2HG   GLU  95          HG1       GLU  95   0.371  -2.950   8.410
  686    H    TYR  96           HN       TYR  96  -1.126  -2.505   7.304
  687    HA   TYR  96           HA       TYR  96  -2.394  -2.128   4.698
  688   1HB   TYR  96          HB2       TYR  96  -2.077  -0.670   7.298
  689   2HB   TYR  96          HB1       TYR  96  -2.585   0.260   5.890
  690    HD1  TYR  96           HD1      TYR  96  -3.381  -2.843   7.815
  691    HD2  TYR  96           HD2      TYR  96  -4.828   0.239   5.199
  692    HE1  TYR  96           HE1      TYR  96  -5.693  -3.696   8.091
  693    HE2  TYR  96           HE2      TYR  96  -7.141  -0.613   5.473
  694    HH   TYR  96           HH       TYR  96  -7.912  -3.531   6.511
  695    H    CYS  97           HN       CYS  97  -1.653  -0.728   3.037
  696    HA   CYS  97           HA       CYS  97   1.209  -0.159   3.015
  697   1HB   CYS  97          HB2       CYS  97  -1.110   0.330   1.131
  698   2HB   CYS  97          HB1       CYS  97   0.532   0.846   0.754
  699    H    ASN  98           HN       ASN  98   1.879   2.140   2.296
  700    HA   ASN  98           HA       ASN  98   1.086   4.006   4.360
  701   1HB   ASN  98          HB2       ASN  98   2.993   3.753   2.162
  702   2HB   ASN  98          HB1       ASN  98   2.421   5.409   2.359
  703   1HD2  ASN  98          HD21      ASN  98   5.028   3.804   3.192
  704   2HD2  ASN  98          HD22      ASN  98   5.273   4.318   4.791
  705    H    LEU  99           HN       LEU  99  -1.409   3.700   3.455
  706    HA   LEU  99           HA       LEU  99  -1.860   5.734   1.321
  707   1HB   LEU  99          HB2       LEU  99  -4.001   4.028   2.553
  708   2HB   LEU  99          HB1       LEU  99  -3.896   4.655   0.916
  709    HG   LEU  99           HG       LEU  99  -3.386   2.487   0.494
  710   1HD1  LEU  99          HD11      LEU  99  -0.605   2.839   1.411
  711   2HD1  LEU  99          HD12      LEU  99  -1.224   4.082   0.328
  712   3HD1  LEU  99          HD13      LEU  99  -1.222   2.393  -0.177
  713   1HD2  LEU  99          HD21      LEU  99  -2.758   2.458   3.361
  714   2HD2  LEU  99          HD22      LEU  99  -1.828   1.319   2.399
  715   3HD2  LEU  99          HD23      LEU  99  -3.581   1.254   2.376
  716    H    THR 100           HN       THR 100  -3.552   7.313   1.684
  717    HA   THR 100           HA       THR 100  -4.646   7.775   4.350
  718    HB   THR 100           HB       THR 100  -3.423  10.183   3.992
  719    HG1  THR 100           HG1      THR 100  -1.546   9.951   3.030
  720   1HG2  THR 100          HG21      THR 100  -1.895   9.490   5.771
  721   2HG2  THR 100          HG22      THR 100  -2.205   7.794   5.400
  722   3HG2  THR 100          HG23      THR 100  -3.494   8.803   6.056
  723    H    GLN 101           HN       GLN 101  -6.187   9.634   4.238
  724    HA   GLN 101           HA       GLN 101  -7.598   9.767   1.748
  725   1HB   GLN 101          HB2       GLN 101  -7.603  11.173   4.386
  726   2HB   GLN 101          HB1       GLN 101  -8.485  11.932   3.059
  727   1HG   GLN 101          HG2       GLN 101  -9.568   9.647   2.660
  728   2HG   GLN 101          HG1       GLN 101  -8.903   9.173   4.224
  729   1HE2  GLN 101          HE21      GLN 101 -11.330   9.000   4.788
  730   2HE2  GLN 101          HE22      GLN 101 -12.113  10.413   5.311
  731    H    CYS 102           HN       CYS 102  -6.318  10.448   0.015
  732    HA   CYS 102           HA       CYS 102  -4.248  12.210  -0.209
  733   1HB   CYS 102          HB2       CYS 102  -6.697  12.149  -1.999
  734   2HB   CYS 102          HB1       CYS 102  -5.086  12.682  -2.475
  735    HA   PRO 103           HA       PRO 103  -6.379  15.871   1.427
  736   1HB   PRO 103          HB2       PRO 103  -4.189  16.898   2.693
  737   2HB   PRO 103          HB1       PRO 103  -5.213  15.643   3.414
  738   1HG   PRO 103          HG2       PRO 103  -2.529  15.424   2.215
  739   2HG   PRO 103          HG1       PRO 103  -3.292  14.441   3.471
  740   1HD   PRO 103          HD2       PRO 103  -2.989  13.762   0.758
  741   2HD   PRO 103          HD1       PRO 103  -3.986  12.916   1.959
  742    H    VAL 104           HN       VAL 104  -5.991  16.054  -1.183
  743    HA   VAL 104           HA       VAL 104  -3.765  17.849  -1.894
  744    HB   VAL 104           HB       VAL 104  -6.147  16.767  -3.434
  745   1HG1  VAL 104          HG11      VAL 104  -5.373  18.626  -4.666
  746   2HG1  VAL 104          HG12      VAL 104  -4.512  17.264  -5.383
  747   3HG1  VAL 104          HG13      VAL 104  -3.690  18.322  -4.236
  748   1HG2  VAL 104          HG21      VAL 104  -3.567  15.690  -4.158
  749   2HG2  VAL 104          HG22      VAL 104  -4.999  14.833  -3.588
  750   3HG2  VAL 104          HG23      VAL 104  -3.836  15.476  -2.428
  751    H    THR 105           HN       THR 105  -4.380  19.853  -3.238
  752    HA   THR 105           HA       THR 105  -6.574  21.331  -1.835
  753    HB   THR 105           HB       THR 105  -4.147  22.044  -1.653
  754    HG1  THR 105           HG1      THR 105  -5.232  23.795  -1.287
  755   1HG2  THR 105          HG21      THR 105  -4.581  22.591  -4.600
  756   2HG2  THR 105          HG22      THR 105  -3.410  21.476  -3.896
  757   3HG2  THR 105          HG23      THR 105  -3.222  23.214  -3.663
  758    H    GLU 106           HN       GLU 106  -5.228  20.493  -4.997
  759    HA   GLU 106           HA       GLU 106  -6.594  22.160  -6.745
  760   1HB   GLU 106          HB2       GLU 106  -5.352  19.541  -6.727
  761   2HB   GLU 106          HB1       GLU 106  -6.733  19.559  -7.825
  762   1HG   GLU 106          HG2       GLU 106  -4.674  21.766  -7.853
  763   2HG   GLU 106          HG1       GLU 106  -4.452  20.288  -8.790
  764    H    SER 107           HN       SER 107  -8.521  21.245  -8.204
  765    HA   SER 107           HA       SER 107 -10.881  21.161  -6.550
  766   1HB   SER 107          HB2       SER 107 -11.438  22.003  -8.592
  767   2HB   SER 107          HB1       SER 107 -10.106  21.172  -9.391
  768    HG   SER 107           HG       SER 107 -12.681  20.526  -9.360
  769    H    SER 108           HN       SER 108  -9.597  18.685  -8.813
  770    HA   SER 108           HA       SER 108  -9.723  16.329  -8.728
  771   1HB   SER 108          HB2       SER 108  -8.623  16.122  -6.731
  772   2HB   SER 108          HB1       SER 108  -9.630  17.330  -5.941
  773    HG   SER 108           HG       SER 108 -10.578  15.664  -5.080
  774    H    VAL 109           HN       VAL 109 -12.034  17.148  -6.130
  775    HA   VAL 109           HA       VAL 109 -14.044  15.319  -6.834
  776    HB   VAL 109           HB       VAL 109 -14.121  18.075  -5.573
  777   1HG1  VAL 109          HG11      VAL 109 -16.344  17.272  -6.567
  778   2HG1  VAL 109          HG12      VAL 109 -16.350  17.647  -4.843
  779   3HG1  VAL 109          HG13      VAL 109 -16.282  15.969  -5.381
  780   1HG2  VAL 109          HG21      VAL 109 -13.599  17.012  -3.631
  781   2HG2  VAL 109          HG22      VAL 109 -13.030  15.714  -4.680
  782   3HG2  VAL 109          HG23      VAL 109 -14.652  15.645  -3.992
  783    H    LEU 110           HN       LEU 110 -15.139  15.161  -8.754
  784    HA   LEU 110           HA       LEU 110 -15.408  17.535 -10.506
  785   1HB   LEU 110          HB2       LEU 110 -14.891  14.874 -10.903
  786   2HB   LEU 110          HB1       LEU 110 -16.618  14.942 -11.251
  787    HG   LEU 110           HG       LEU 110 -14.606  16.853 -12.460
  788   1HD1  LEU 110          HD11      LEU 110 -15.404  14.094 -13.211
  789   2HD1  LEU 110          HD12      LEU 110 -13.921  14.976 -13.575
  790   3HD1  LEU 110          HD13      LEU 110 -15.379  15.273 -14.522
  791   1HD2  LEU 110          HD21      LEU 110 -16.841  17.739 -12.498
  792   2HD2  LEU 110          HD22      LEU 110 -17.513  16.185 -12.992
  793   3HD2  LEU 110          HD23      LEU 110 -16.521  17.115 -14.116
  794    H    ALA 111           HN       ALA 111 -17.163  16.177  -7.997
  795    HA   ALA 111           HA       ALA 111 -19.833  16.729  -9.184
  796   1HB   ALA 111          HB1       ALA 111 -19.424  15.886  -6.350
  797   2HB   ALA 111          HB2       ALA 111 -18.928  14.748  -7.604
  798   3HB   ALA 111          HB3       ALA 111 -20.599  15.308  -7.532
  799    H    THR 112           HN       THR 112 -21.101  18.471  -8.502
  800    HA   THR 112           HA       THR 112 -20.006  20.210  -6.322
  801    HB   THR 112           HB       THR 112 -21.076  21.965  -8.152
  802    HG1  THR 112           HG1      THR 112 -21.275  20.157  -9.604
  803   1HG2  THR 112          HG21      THR 112 -18.396  21.716  -8.896
  804   2HG2  THR 112          HG22      THR 112 -18.446  21.115  -7.238
  805   3HG2  THR 112          HG23      THR 112 -19.030  22.738  -7.607
  806    H    SER 113           HN       SER 113 -22.293  18.260  -6.458
  807    HA   SER 113           HA       SER 113 -24.799  19.617  -6.701
  808   1HB   SER 113          HB2       SER 113 -23.697  17.124  -5.531
  809   2HB   SER 113          HB1       SER 113 -25.240  17.652  -4.867
  810    HG   SER 113           HG       SER 113 -25.627  16.379  -6.665
  811    H    THR 114           HN       THR 114 -23.435  18.498  -3.595
  812    HA   THR 114           HA       THR 114 -24.543  20.973  -2.322
  813    HB   THR 114           HB       THR 114 -25.513  18.912  -1.512
  814    HG1  THR 114           HG1      THR 114 -24.921  19.059   0.631
  815   1HG2  THR 114          HG21      THR 114 -24.284  17.049  -1.868
  816   2HG2  THR 114          HG22      THR 114 -23.470  17.439  -0.353
  817   3HG2  THR 114          HG23      THR 114 -22.773  17.958  -1.888
  818    H    ALA 115           HN       ALA 115 -23.204  22.001  -0.666
  819    HA   ALA 115           HA       ALA 115 -20.274  21.448  -1.016
  820   1HB   ALA 115          HB1       ALA 115 -20.497  23.561  -1.892
  821   2HB   ALA 115          HB2       ALA 115 -20.407  24.026  -0.193
  822   3HB   ALA 115          HB3       ALA 115 -21.976  23.887  -0.987
  823    H    VAL 116           HN       VAL 116 -19.101  21.107   0.856
  824    HA   VAL 116           HA       VAL 116 -20.555  21.428   3.462
  825    HB   VAL 116           HB       VAL 116 -18.430  19.485   2.504
  826   1HG1  VAL 116          HG11      VAL 116 -19.069  18.444   4.839
  827   2HG1  VAL 116          HG12      VAL 116 -19.516  20.103   5.234
  828   3HG1  VAL 116          HG13      VAL 116 -17.862  19.727   4.753
  829   1HG2  VAL 116          HG21      VAL 116 -20.966  18.520   3.653
  830   2HG2  VAL 116          HG22      VAL 116 -20.129  18.006   2.188
  831   3HG2  VAL 116          HG23      VAL 116 -21.161  19.435   2.158
  832    H    SER 117           HN       SER 117 -19.651  22.896   4.857
  833    HA   SER 117           HA       SER 117 -16.819  23.756   4.351
  834   1HB   SER 117          HB2       SER 117 -19.380  25.141   4.965
  835   2HB   SER 117          HB1       SER 117 -17.935  25.802   5.724
  836    HG   SER 117           HG       SER 117 -18.374  25.320   2.957
  837    H    GLU 118           HN       GLU 118 -15.421  23.734   6.114
  838    HA   GLU 118           HA       GLU 118 -14.638  23.188   8.275
  839   1HB   GLU 118          HB2       GLU 118 -17.254  24.588   8.541
  840   2HB   GLU 118          HB1       GLU 118 -16.630  23.800   9.991
  841   1HG   GLU 118          HG2       GLU 118 -15.673  25.940  10.118
  842   2HG   GLU 118          HG1       GLU 118 -14.388  24.983   9.381
  843    H    GLN 119           HN       GLN 119 -15.989  21.079   6.697
  844    HA   GLN 119           HA       GLN 119 -16.633  19.254   8.957
  845   1HB   GLN 119          HB2       GLN 119 -18.506  20.443   7.081
  846   2HB   GLN 119          HB1       GLN 119 -18.516  18.684   6.943
  847   1HG   GLN 119          HG2       GLN 119 -19.584  18.461   8.915
  848   2HG   GLN 119          HG1       GLN 119 -18.415  19.504   9.726
  849   1HE2  GLN 119          HE21      GLN 119 -21.621  19.330   9.369
  850   2HE2  GLN 119          HE22      GLN 119 -22.028  20.972   9.230
  Start of MODEL    2
    1   1H    ALA   1          HT1       ALA   1  14.669   1.051  16.176
    2   2H    ALA   1          HT2       ALA   1  12.982   1.226  16.268
    3   3H    ALA   1          HT3       ALA   1  13.867   0.763  17.642
    4    HA   ALA   1           HA       ALA   1  13.688   3.421  16.366
    5   1HB   ALA   1          HB1       ALA   1  12.151   2.798  18.162
    6   2HB   ALA   1          HB2       ALA   1  13.312   3.971  18.784
    7   3HB   ALA   1          HB3       ALA   1  13.498   2.259  19.165
    8    H    ARG   2           HN       ARG   2  16.019   2.946  15.545
    9    HA   ARG   2           HA       ARG   2  17.922   4.393  17.074
   10   1HB   ARG   2          HB2       ARG   2  17.431   1.681  17.924
   11   2HB   ARG   2          HB1       ARG   2  19.091   1.819  17.345
   12   1HG   ARG   2          HG2       ARG   2  18.828   4.127  18.806
   13   2HG   ARG   2          HG1       ARG   2  17.832   3.004  19.733
   14   1HD   ARG   2          HD2       ARG   2  19.708   1.405  19.849
   15   2HD   ARG   2          HD1       ARG   2  20.715   2.515  18.897
   16    HE   ARG   2           HE       ARG   2  19.664   4.018  21.043
   17   1HH1  ARG   2          HH21      ARG   2  21.126   0.947  21.050
   18   2HH1  ARG   2          HH22      ARG   2  22.329   1.351  22.229
   19   1HH2  ARG   2          HH11      ARG   2  21.469   4.708  22.346
   20   2HH2  ARG   2          HH12      ARG   2  22.522   3.479  22.963
   21    H    ILE   3           HN       ILE   3  17.742   4.835  14.574
   22    HA   ILE   3           HA       ILE   3  18.733   4.708  12.430
   23    HB   ILE   3           HB       ILE   3  20.939   3.593  14.193
   24   1HG1  ILE   3          HG12      ILE   3  20.030   5.771  14.962
   25   2HG1  ILE   3          HG11      ILE   3  21.674   5.939  14.346
   26   1HG2  ILE   3          HG21      ILE   3  21.207   5.119  11.595
   27   2HG2  ILE   3          HG22      ILE   3  21.169   3.357  11.654
   28   3HG2  ILE   3          HG23      ILE   3  22.460   4.239  12.469
   29   1HD1  ILE   3          HD11      ILE   3  20.964   7.431  12.820
   30   2HD1  ILE   3          HD12      ILE   3  19.326   7.292  13.459
   31   3HD1  ILE   3          HD13      ILE   3  19.856   6.233  12.152
   32    H    HIS   4           HN       HIS   4  17.072   2.821  12.145
   33    HA   HIS   4           HA       HIS   4  18.609   0.400  11.307
   34   1HB   HIS   4          HB2       HIS   4  16.332   0.658  13.245
   35   2HB   HIS   4          HB1       HIS   4  16.445  -0.802  12.262
   36    HD1  HIS   4           HD1      HIS   4  17.531   0.446  15.412
   37    HD2  HIS   4           HD2      HIS   4  19.350  -1.845  12.442
   38    HE1  HIS   4           HE1      HIS   4  19.494  -0.720  16.508
   39    H    HIS   5           HN       HIS   5  17.378   2.682   9.822
   40    HA   HIS   5           HA       HIS   5  15.349   1.132   8.241
   41   1HB   HIS   5          HB2       HIS   5  15.532   4.118   8.762
   42   2HB   HIS   5          HB1       HIS   5  14.266   3.309   7.839
   43    HD1  HIS   5           HD1      HIS   5  13.849   0.865   9.741
   44    HD2  HIS   5           HD2      HIS   5  14.020   4.833  11.005
   45    HE1  HIS   5           HE1      HIS   5  12.627   0.964  11.958
   46    H    HIS   6           HN       HIS   6  15.244   3.218   6.213
   47    HA   HIS   6           HA       HIS   6  18.016   3.342   5.140
   48   1HB   HIS   6          HB2       HIS   6  15.893   1.505   4.350
   49   2HB   HIS   6          HB1       HIS   6  16.441   2.485   2.990
   50    HD1  HIS   6           HD1      HIS   6  18.848   2.134   2.152
   51    HD2  HIS   6           HD2      HIS   6  17.922  -0.186   5.489
   52    HE1  HIS   6           HE1      HIS   6  20.741   0.472   2.418
   53    H    HIS   7           HN       HIS   7  15.703   5.200   6.028
   54    HA   HIS   7           HA       HIS   7  14.862   6.574   3.587
   55   1HB   HIS   7          HB2       HIS   7  14.682   7.036   6.566
   56   2HB   HIS   7          HB1       HIS   7  14.116   8.253   5.424
   57    HD1  HIS   7           HD1      HIS   7  13.729   4.729   4.356
   58    HD2  HIS   7           HD2      HIS   7  11.412   7.603   6.293
   59    HE1  HIS   7           HE1      HIS   7  11.346   3.871   4.321
   60    H    HIS   8           HN       HIS   8  16.022   8.161   2.550
   61    HA   HIS   8           HA       HIS   8  18.690   8.869   3.254
   62   1HB   HIS   8          HB2       HIS   8  16.590  10.260   1.558
   63   2HB   HIS   8          HB1       HIS   8  18.315  10.630   1.514
   64    HD1  HIS   8           HD1      HIS   8  19.316   7.648   1.753
   65    HD2  HIS   8           HD2      HIS   8  16.451   8.999  -0.957
   66    HE1  HIS   8           HE1      HIS   8  19.300   5.988  -0.161
   67    H    HIS   9           HN       HIS   9  19.435  10.314   4.766
   68    HA   HIS   9           HA       HIS   9  17.449  12.151   6.044
   69   1HB   HIS   9          HB2       HIS   9  18.870  11.992   7.974
   70   2HB   HIS   9          HB1       HIS   9  18.740  10.357   7.328
   71    HD1  HIS   9           HD1      HIS   9  20.884   9.219   6.657
   72    HD2  HIS   9           HD2      HIS   9  21.390  13.323   7.187
   73    HE1  HIS   9           HE1      HIS   9  23.368   9.666   6.455
   74    H    ILE  10           HN       ILE  10  19.148  12.551   3.482
   75    HA   ILE  10           HA       ILE  10  20.740  14.929   4.349
   76    HB   ILE  10           HB       ILE  10  21.724  13.031   2.980
   77   1HG1  ILE  10          HG12      ILE  10  21.634  15.814   1.772
   78   2HG1  ILE  10          HG11      ILE  10  22.788  15.224   2.968
   79   1HG2  ILE  10          HG21      ILE  10  21.030  12.663   0.762
   80   2HG2  ILE  10          HG22      ILE  10  20.186  14.210   0.672
   81   3HG2  ILE  10          HG23      ILE  10  19.507  12.888   1.621
   82   1HD1  ILE  10          HD11      ILE  10  23.097  15.137   0.189
   83   2HD1  ILE  10          HD12      ILE  10  22.691  13.481   0.640
   84   3HD1  ILE  10          HD13      ILE  10  24.079  14.281   1.377
   85    H    GLU  11           HN       GLU  11  20.420  16.947   3.203
   86    HA   GLU  11           HA       GLU  11  17.646  17.502   2.525
   87   1HB   GLU  11          HB2       GLU  11  20.140  18.884   3.093
   88   2HB   GLU  11          HB1       GLU  11  19.296  19.638   1.740
   89   1HG   GLU  11          HG2       GLU  11  18.477  20.674   3.757
   90   2HG   GLU  11          HG1       GLU  11  17.200  19.618   3.153
   91    H    GLY  12           HN       GLY  12  20.338  18.633   0.531
   92   1HA   GLY  12          HA2       GLY  12  20.750  17.568  -1.718
   93   2HA   GLY  12          HA1       GLY  12  18.999  17.387  -1.838
   94    H    ARG  13           HN       ARG  13  19.838  18.691  -3.919
   95    HA   ARG  13           HA       ARG  13  20.140  21.581  -3.432
   96   1HB   ARG  13          HB2       ARG  13  20.278  19.645  -5.690
   97   2HB   ARG  13          HB1       ARG  13  19.847  21.304  -6.107
   98   1HG   ARG  13          HG2       ARG  13  21.873  21.946  -4.583
   99   2HG   ARG  13          HG1       ARG  13  22.372  20.274  -4.838
  100   1HD   ARG  13          HD2       ARG  13  21.608  21.277  -7.385
  101   2HD   ARG  13          HD1       ARG  13  22.654  22.502  -6.639
  102    HE   ARG  13           HE       ARG  13  23.935  20.128  -6.045
  103   1HH1  ARG  13          HH11      ARG  13  24.759  22.281  -8.129
  104   2HH1  ARG  13          HH12      ARG  13  25.047  21.274  -9.509
  105   1HH2  ARG  13          HH21      ARG  13  23.428  18.516  -8.164
  106   2HH2  ARG  13          HH22      ARG  13  24.293  19.141  -9.528
  107    H    ALA  14           HN       ALA  14  17.540  19.694  -3.108
  108    HA   ALA  14           HA       ALA  14  15.667  21.852  -3.843
  109   1HB   ALA  14          HB1       ALA  14  14.499  20.600  -5.487
  110   2HB   ALA  14          HB2       ALA  14  15.265  19.089  -4.996
  111   3HB   ALA  14          HB3       ALA  14  16.199  20.311  -5.859
  112    HA   PRO  15           HA       PRO  15  13.943  19.991  -0.192
  113   1HB   PRO  15          HB2       PRO  15  11.777  21.649   0.016
  114   2HB   PRO  15          HB1       PRO  15  13.418  22.139   0.485
  115   1HG   PRO  15          HG2       PRO  15  11.888  22.768  -1.985
  116   2HG   PRO  15          HG1       PRO  15  12.999  23.784  -1.055
  117   1HD   PRO  15          HD2       PRO  15  13.672  22.527  -3.391
  118   2HD   PRO  15          HD1       PRO  15  14.843  22.974  -2.131
  119    H    THR  16           HN       THR  16  11.412  19.469   0.373
  120    HA   THR  16           HA       THR  16  10.384  17.954  -1.998
  121    HB   THR  16           HB       THR  16   9.770  17.527   0.935
  122    HG1  THR  16           HG1      THR  16  11.927  16.613  -0.647
  123   1HG2  THR  16          HG21      THR  16   8.528  15.824   0.161
  124   2HG2  THR  16          HG22      THR  16   9.926  15.164  -0.687
  125   3HG2  THR  16          HG23      THR  16   8.883  16.341  -1.487
  126    H    GLU  17           HN       GLU  17   8.910  19.433  -2.913
  127    HA   GLU  17           HA       GLU  17   7.248  21.237  -1.508
  128   1HB   GLU  17          HB2       GLU  17   7.430  19.999  -4.200
  129   2HB   GLU  17          HB1       GLU  17   5.881  20.734  -3.787
  130   1HG   GLU  17          HG2       GLU  17   7.908  22.522  -2.906
  131   2HG   GLU  17          HG1       GLU  17   8.324  22.037  -4.551
  132    H    GLN  18           HN       GLN  18   4.985  21.069  -0.959
  133    HA   GLN  18           HA       GLN  18   4.129  18.718   0.315
  134   1HB   GLN  18          HB2       GLN  18   2.397  20.868  -0.928
  135   2HB   GLN  18          HB1       GLN  18   2.020  19.890   0.491
  136   1HG   GLN  18          HG2       GLN  18   4.350  20.928   1.326
  137   2HG   GLN  18          HG1       GLN  18   3.859  22.220   0.231
  138   1HE2  GLN  18          HE21      GLN  18   3.620  21.300   3.418
  139   2HE2  GLN  18          HE22      GLN  18   2.167  22.077   3.826
  140    H    SER  19           HN       SER  19   3.508  19.842  -3.002
  141    HA   SER  19           HA       SER  19   1.519  18.038  -3.814
  142   1HB   SER  19          HB2       SER  19   3.281  18.276  -5.967
  143   2HB   SER  19          HB1       SER  19   1.969  19.383  -5.576
  144    HG   SER  19           HG       SER  19   3.959  20.476  -5.710
  145    HA   PRO  20           HA       PRO  20   4.799  14.792  -5.053
  146   1HB   PRO  20          HB2       PRO  20   7.423  15.299  -4.457
  147   2HB   PRO  20          HB1       PRO  20   6.660  15.808  -5.977
  148   1HG   PRO  20          HG2       PRO  20   7.222  17.394  -3.518
  149   2HG   PRO  20          HG1       PRO  20   7.378  17.858  -5.220
  150   1HD   PRO  20          HD2       PRO  20   5.284  18.616  -3.666
  151   2HD   PRO  20          HD1       PRO  20   5.153  18.374  -5.422
  152    H    GLY  21           HN       GLY  21   5.098  12.998  -3.720
  153   1HA   GLY  21          HA2       GLY  21   6.360  12.317  -1.544
  154   2HA   GLY  21          HA1       GLY  21   5.344  13.552  -0.799
  155    H    VAL  22           HN       VAL  22   5.428  10.308  -2.045
  156    HA   VAL  22           HA       VAL  22   2.722   9.845  -0.892
  157    HB   VAL  22           HB       VAL  22   2.467  10.407  -3.295
  158   1HG1  VAL  22          HG11      VAL  22   3.737   9.468  -4.948
  159   2HG1  VAL  22          HG12      VAL  22   3.795   7.897  -4.149
  160   3HG1  VAL  22          HG13      VAL  22   4.874   9.191  -3.629
  161   1HG2  VAL  22          HG21      VAL  22   0.741   8.967  -3.017
  162   2HG2  VAL  22          HG22      VAL  22   1.722   7.866  -2.049
  163   3HG2  VAL  22          HG23      VAL  22   1.759   7.765  -3.809
  164    H    GLN  23           HN       GLN  23   2.855   8.022   0.364
  165    HA   GLN  23           HA       GLN  23   4.257   5.645  -0.492
  166   1HB   GLN  23          HB2       GLN  23   5.784   7.594   0.671
  167   2HB   GLN  23          HB1       GLN  23   5.284   6.659   2.082
  168   1HG   GLN  23          HG2       GLN  23   5.951   4.619   0.479
  169   2HG   GLN  23          HG1       GLN  23   7.008   5.851  -0.213
  170   1HE2  GLN  23          HE21      GLN  23   8.818   6.561   1.045
  171   2HE2  GLN  23          HE22      GLN  23   9.210   5.892   2.555
  172    H    ASP  24           HN       ASP  24   4.588   4.879   2.305
  173    HA   ASP  24           HA       ASP  24   2.437   3.390   2.984
  174   1HB   ASP  24          HB2       ASP  24   3.097   3.809   5.324
  175   2HB   ASP  24          HB1       ASP  24   4.512   3.691   4.278
  176    H    CYS  25           HN       CYS  25   0.405   4.288   2.279
  177    HA   CYS  25           HA       CYS  25  -0.875   6.073   4.242
  178   1HB   CYS  25          HB2       CYS  25   0.479   7.227   2.174
  179   2HB   CYS  25          HB1       CYS  25  -1.135   7.075   1.486
  180    H    TYR  26           HN       TYR  26  -3.167   6.110   3.998
  181    HA   TYR  26           HA       TYR  26  -4.455   4.709   1.764
  182   1HB   TYR  26          HB2       TYR  26  -5.205   2.817   2.989
  183   2HB   TYR  26          HB1       TYR  26  -3.509   2.979   3.429
  184    HD1  TYR  26           HD1      TYR  26  -6.958   3.926   4.542
  185    HD2  TYR  26           HD2      TYR  26  -2.880   3.223   5.671
  186    HE1  TYR  26           HE1      TYR  26  -7.587   4.117   6.935
  187    HE2  TYR  26           HE2      TYR  26  -3.502   3.415   8.063
  188    HH   TYR  26           HH       TYR  26  -5.242   4.367   9.438
  189    H    HIS  27           HN       HIS  27  -6.820   4.928   1.902
  190    HA   HIS  27           HA       HIS  27  -7.615   7.128   3.775
  191   1HB   HIS  27          HB2       HIS  27  -7.635   7.709   1.402
  192   2HB   HIS  27          HB1       HIS  27  -8.611   6.287   1.032
  193    HD1  HIS  27           HD1      HIS  27  -8.916   9.805   1.857
  194    HD2  HIS  27           HD2      HIS  27 -11.266   6.413   2.450
  195    HE1  HIS  27           HE1      HIS  27 -11.248  10.634   2.398
  196    H    GLY  28           HN       GLY  28  -8.849   6.331   5.436
  197   1HA   GLY  28          HA2       GLY  28 -10.574   5.177   6.534
  198   2HA   GLY  28          HA1       GLY  28 -11.273   4.863   4.946
  199    H    ASP  29           HN       ASP  29 -10.113   3.102   3.652
  200    HA   ASP  29           HA       ASP  29  -8.981   1.001   5.448
  201   1HB   ASP  29          HB2       ASP  29 -10.978   0.507   3.247
  202   2HB   ASP  29          HB1       ASP  29 -10.505  -0.595   4.540
  203    H    GLY  30           HN       GLY  30  -8.059   2.925   3.141
  204   1HA   GLY  30          HA2       GLY  30  -6.588   2.770   1.319
  205   2HA   GLY  30          HA1       GLY  30  -6.005   1.296   2.095
  206    H    GLN  31           HN       GLN  31  -9.349   1.151   1.503
  207    HA   GLN  31           HA       GLN  31  -9.132  -1.040  -0.324
  208   1HB   GLN  31          HB2       GLN  31 -11.030  -0.272   1.253
  209   2HB   GLN  31          HB1       GLN  31 -11.494   0.825  -0.048
  210   1HG   GLN  31          HG2       GLN  31 -12.189  -0.879  -1.427
  211   2HG   GLN  31          HG1       GLN  31 -11.000  -2.017  -0.792
  212   1HE2  GLN  31          HE21      GLN  31 -13.871  -0.192   0.439
  213   2HE2  GLN  31          HE22      GLN  31 -14.479  -1.487   1.353
  214    H    SER  32           HN       SER  32  -9.363   2.438  -0.817
  215    HA   SER  32           HA       SER  32  -9.822   2.154  -3.721
  216   1HB   SER  32          HB2       SER  32 -10.514   3.989  -1.837
  217   2HB   SER  32          HB1       SER  32  -9.060   4.745  -2.485
  218    HG   SER  32           HG       SER  32 -11.405   4.875  -3.519
  219    H    TYR  33           HN       TYR  33  -7.198   1.576  -1.902
  220    HA   TYR  33           HA       TYR  33  -5.117   3.227  -2.939
  221   1HB   TYR  33          HB2       TYR  33  -5.165   1.490  -1.016
  222   2HB   TYR  33          HB1       TYR  33  -4.847   0.291  -2.271
  223    HD1  TYR  33           HD1      TYR  33  -2.787   0.548  -3.737
  224    HD2  TYR  33           HD2      TYR  33  -3.451   2.924  -0.219
  225    HE1  TYR  33           HE1      TYR  33  -0.390   1.189  -3.713
  226    HE2  TYR  33           HE2      TYR  33  -1.057   3.562  -0.195
  227    HH   TYR  33           HH       TYR  33   0.820   3.701  -2.206
  228    H    ARG  34           HN       ARG  34  -5.567   3.466  -5.234
  229    HA   ARG  34           HA       ARG  34  -5.544   1.073  -6.954
  230   1HB   ARG  34          HB2       ARG  34  -6.323   3.857  -7.052
  231   2HB   ARG  34          HB1       ARG  34  -5.311   3.468  -8.444
  232   1HG   ARG  34          HG2       ARG  34  -7.554   2.964  -9.103
  233   2HG   ARG  34          HG1       ARG  34  -6.784   1.411  -8.774
  234   1HD   ARG  34          HD2       ARG  34  -7.872   1.205  -6.652
  235   2HD   ARG  34          HD1       ARG  34  -8.392   2.902  -6.679
  236    HE   ARG  34           HE       ARG  34  -9.450   0.782  -8.502
  237   1HH1  ARG  34          HH11      ARG  34  -9.266   4.062  -8.579
  238   2HH1  ARG  34          HH12      ARG  34 -10.967   4.371  -8.486
  239   1HH2  ARG  34          HH21      ARG  34 -11.789   1.092  -7.711
  240   2HH2  ARG  34          HH22      ARG  34 -12.396   2.689  -7.995
  241    H    GLY  35           HN       GLY  35  -3.212   0.728  -5.852
  242   1HA   GLY  35          HA2       GLY  35  -1.267   1.595  -7.900
  243   2HA   GLY  35          HA1       GLY  35  -0.907   2.060  -6.238
  244    H    SER  36           HN       SER  36   1.041   0.640  -6.749
  245    HA   SER  36           HA       SER  36   0.387  -2.240  -6.201
  246   1HB   SER  36          HB2       SER  36   1.288  -2.120  -8.381
  247   2HB   SER  36          HB1       SER  36   2.420  -0.845  -7.938
  248    HG   SER  36           HG       SER  36   3.501  -2.818  -8.088
  249    H    PHE  37           HN       PHE  37   0.527  -1.031  -3.903
  250    HA   PHE  37           HA       PHE  37   3.311  -0.641  -2.984
  251   1HB   PHE  37          HB2       PHE  37   1.425   0.848  -2.341
  252   2HB   PHE  37          HB1       PHE  37   0.644  -0.517  -1.544
  253    HD1  PHE  37           HD1      PHE  37   3.791   1.496  -1.571
  254    HD2  PHE  37           HD2      PHE  37   1.210  -1.105   0.672
  255    HE1  PHE  37           HE1      PHE  37   5.142   1.912   0.466
  256    HE2  PHE  37           HE2      PHE  37   2.562  -0.688   2.710
  257    HZ   PHE  37           HZ       PHE  37   4.528   0.821   2.607
  258    H    SER  38           HN       SER  38   3.572  -3.128  -3.574
  259    HA   SER  38           HA       SER  38   2.402  -5.096  -1.813
  260   1HB   SER  38          HB2       SER  38   3.567  -6.514  -3.175
  261   2HB   SER  38          HB1       SER  38   3.731  -5.066  -4.163
  262    HG   SER  38           HG       SER  38   5.788  -5.159  -3.797
  263    H    THR  39           HN       THR  39   3.628  -2.922  -0.206
  264    HA   THR  39           HA       THR  39   6.002  -4.292   0.968
  265    HB   THR  39           HB       THR  39   4.894  -1.602   1.762
  266    HG1  THR  39           HG1      THR  39   6.456  -2.211  -0.524
  267   1HG2  THR  39          HG21      THR  39   7.039  -1.184   2.524
  268   2HG2  THR  39          HG22      THR  39   7.781  -2.262   1.341
  269   3HG2  THR  39          HG23      THR  39   6.964  -2.931   2.755
  270    H    THR  40           HN       THR  40   5.602  -5.546   2.759
  271    HA   THR  40           HA       THR  40   2.974  -5.463   4.057
  272    HB   THR  40           HB       THR  40   3.910  -7.394   5.281
  273    HG1  THR  40           HG1      THR  40   5.997  -7.750   5.322
  274   1HG2  THR  40          HG21      THR  40   3.253  -8.430   3.389
  275   2HG2  THR  40          HG22      THR  40   4.947  -8.396   2.902
  276   3HG2  THR  40          HG23      THR  40   3.853  -7.116   2.377
  277    H    VAL  41           HN       VAL  41   2.957  -5.509   6.544
  278    HA   VAL  41           HA       VAL  41   3.798  -3.045   7.635
  279    HB   VAL  41           HB       VAL  41   3.071  -5.746   8.789
  280   1HG1  VAL  41          HG11      VAL  41   3.967  -3.239  10.166
  281   2HG1  VAL  41          HG12      VAL  41   4.248  -4.922  10.614
  282   3HG1  VAL  41          HG13      VAL  41   2.671  -4.185  10.898
  283   1HG2  VAL  41          HG21      VAL  41   0.929  -4.878   8.955
  284   2HG2  VAL  41          HG22      VAL  41   1.496  -4.008   7.530
  285   3HG2  VAL  41          HG23      VAL  41   1.501  -3.217   9.106
  286    H    THR  42           HN       THR  42   5.368  -6.252   7.810
  287    HA   THR  42           HA       THR  42   7.554  -5.451   9.499
  288    HB   THR  42           HB       THR  42   8.294  -7.560   7.713
  289    HG1  THR  42           HG1      THR  42   5.808  -8.181   8.770
  290   1HG2  THR  42          HG21      THR  42   7.051  -7.761  10.465
  291   2HG2  THR  42          HG22      THR  42   8.735  -7.319  10.183
  292   3HG2  THR  42          HG23      THR  42   8.149  -8.911   9.702
  293    H    GLY  43           HN       GLY  43   6.835  -4.760   6.219
  294   1HA   GLY  43          HA2       GLY  43   8.136  -3.144   4.958
  295   2HA   GLY  43          HA1       GLY  43   9.567  -3.638   5.864
  296    H    ARG  44           HN       ARG  44   7.871  -6.394   5.060
  297    HA   ARG  44           HA       ARG  44   9.862  -7.171   3.065
  298   1HB   ARG  44          HB2       ARG  44   7.916  -8.355   4.837
  299   2HB   ARG  44          HB1       ARG  44   7.720  -9.023   3.216
  300   1HG   ARG  44          HG2       ARG  44   9.486 -10.355   3.646
  301   2HG   ARG  44          HG1       ARG  44  10.493  -8.908   3.612
  302   1HD   ARG  44          HD2       ARG  44  10.968  -9.345   5.793
  303   2HD   ARG  44          HD1       ARG  44   9.296  -8.871   6.154
  304    HE   ARG  44           HE       ARG  44   8.692 -11.298   5.670
  305   1HH1  ARG  44          HH11      ARG  44  10.147 -11.017   8.294
  306   2HH1  ARG  44          HH12      ARG  44  11.347 -12.260   8.168
  307   1HH2  ARG  44          HH21      ARG  44  10.992 -12.620   4.736
  308   2HH2  ARG  44          HH22      ARG  44  11.826 -13.167   6.153
  309    H    THR  45           HN       THR  45   8.529  -8.621   1.201
  310    HA   THR  45           HA       THR  45   6.935  -6.549  -0.260
  311    HB   THR  45           HB       THR  45   8.740  -8.832  -1.090
  312    HG1  THR  45           HG1      THR  45  10.056  -7.257  -1.581
  313   1HG2  THR  45          HG21      THR  45   6.899  -7.137  -2.796
  314   2HG2  THR  45          HG22      THR  45   6.840  -8.889  -2.595
  315   3HG2  THR  45          HG23      THR  45   8.199  -8.143  -3.437
  316    H    CYS  46           HN       CYS  46   4.883  -7.104  -1.021
  317    HA   CYS  46           HA       CYS  46   3.550  -9.372   0.131
  318   1HB   CYS  46          HB2       CYS  46   2.046  -7.684  -0.174
  319   2HB   CYS  46          HB1       CYS  46   2.986  -6.972  -1.475
  320    H    GLN  47           HN       GLN  47   2.833 -11.283  -0.945
  321    HA   GLN  47           HA       GLN  47   4.423 -12.025  -3.331
  322   1HB   GLN  47          HB2       GLN  47   4.391 -13.600  -1.541
  323   2HB   GLN  47          HB1       GLN  47   2.645 -13.469  -1.355
  324   1HG   GLN  47          HG2       GLN  47   3.267 -14.231  -4.063
  325   2HG   GLN  47          HG1       GLN  47   4.072 -15.329  -2.944
  326   1HE2  GLN  47          HE21      GLN  47   2.697 -17.144  -2.949
  327   2HE2  GLN  47          HE22      GLN  47   1.037 -17.080  -2.596
  328    H    SER  48           HN       SER  48   3.417 -12.729  -5.307
  329    HA   SER  48           HA       SER  48   1.123 -11.376  -6.236
  330   1HB   SER  48          HB2       SER  48   3.009 -13.352  -7.105
  331   2HB   SER  48          HB1       SER  48   1.395 -13.889  -7.561
  332    HG   SER  48           HG       SER  48   2.681 -11.434  -8.167
  333    H    TRP  49           HN       TRP  49  -1.087 -12.028  -6.397
  334    HA   TRP  49           HA       TRP  49  -2.088 -13.717  -4.275
  335   1HB   TRP  49          HB2       TRP  49  -3.392 -12.687  -6.817
  336   2HB   TRP  49          HB1       TRP  49  -4.241 -13.251  -5.379
  337    HD1  TRP  49           HD1      TRP  49  -2.192 -10.322  -6.697
  338    HE1  TRP  49           HE1      TRP  49  -2.450  -8.350  -5.078
  339    HE3  TRP  49           HE3      TRP  49  -4.668 -12.590  -2.908
  340    HZ2  TRP  49           HZ2      TRP  49  -3.539  -7.793  -2.514
  341    HZ3  TRP  49           HZ3      TRP  49  -5.317 -11.338  -0.868
  342    HH2  TRP  49           HH2      TRP  49  -4.751  -8.930  -0.667
  343    H    SER  50           HN       SER  50  -1.667 -14.095  -7.776
  344    HA   SER  50           HA       SER  50  -2.658 -16.845  -7.839
  345   1HB   SER  50          HB2       SER  50  -2.883 -15.252  -9.697
  346   2HB   SER  50          HB1       SER  50  -1.131 -15.103  -9.797
  347    HG   SER  50           HG       SER  50  -2.813 -17.225 -10.522
  348    H    SER  51           HN       SER  51  -0.211 -16.168  -6.083
  349    HA   SER  51           HA       SER  51   1.950 -17.650  -7.458
  350   1HB   SER  51          HB2       SER  51   1.596 -15.917  -5.053
  351   2HB   SER  51          HB1       SER  51   2.912 -17.088  -5.011
  352    HG   SER  51           HG       SER  51   3.591 -16.211  -7.042
  353    H    MET  52           HN       MET  52   1.018 -19.784  -7.494
  354    HA   MET  52           HA       MET  52   0.181 -21.005  -4.937
  355   1HB   MET  52          HB2       MET  52   0.499 -22.349  -7.621
  356   2HB   MET  52          HB1       MET  52  -0.630 -22.739  -6.332
  357   1HG   MET  52          HG2       MET  52  -0.778 -20.555  -8.373
  358   2HG   MET  52          HG1       MET  52  -2.037 -21.649  -7.818
  359   1HE   MET  52          HE1       MET  52  -3.161 -21.016  -4.849
  360   2HE   MET  52          HE2       MET  52  -1.737 -20.354  -4.050
  361   3HE   MET  52          HE3       MET  52  -1.580 -21.760  -5.088
  362    H    THR  53           HN       THR  53   2.949 -20.175  -5.109
  363    HA   THR  53           HA       THR  53   4.415 -22.756  -5.384
  364    HB   THR  53           HB       THR  53   6.245 -20.725  -4.932
  365    HG1  THR  53           HG1      THR  53   4.205 -19.714  -6.610
  366   1HG2  THR  53          HG21      THR  53   5.579 -22.531  -6.926
  367   2HG2  THR  53          HG22      THR  53   6.959 -21.434  -6.953
  368   3HG2  THR  53          HG23      THR  53   5.448 -20.970  -7.734
  369    HA   PRO  54           HA       PRO  54   5.790 -21.465  -1.040
  370   1HB   PRO  54          HB2       PRO  54   5.064 -19.031  -0.028
  371   2HB   PRO  54          HB1       PRO  54   6.518 -19.269  -1.015
  372   1HG   PRO  54          HG2       PRO  54   3.868 -18.167  -1.792
  373   2HG   PRO  54          HG1       PRO  54   5.490 -17.675  -2.302
  374   1HD   PRO  54          HD2       PRO  54   3.813 -19.208  -3.822
  375   2HD   PRO  54          HD1       PRO  54   5.583 -19.238  -3.956
  376    H    HIS  55           HN       HIS  55   3.239 -19.209  -0.264
  377    HA   HIS  55           HA       HIS  55   1.775 -21.371   1.149
  378   1HB   HIS  55          HB2       HIS  55   0.818 -18.547   1.164
  379   2HB   HIS  55          HB1       HIS  55   1.014 -19.667   2.508
  380    HD1  HIS  55           HD1      HIS  55   2.923 -17.221   0.387
  381    HD2  HIS  55           HD2      HIS  55   3.558 -19.576   3.765
  382    HE1  HIS  55           HE1      HIS  55   5.130 -16.485   1.364
  383    H    TRP  56           HN       TRP  56   0.311 -22.455  -0.147
  384    HA   TRP  56           HA       TRP  56  -0.949 -21.178  -2.451
  385   1HB   TRP  56          HB2       TRP  56  -0.258 -23.646  -2.049
  386   2HB   TRP  56          HB1       TRP  56  -1.765 -23.771  -1.138
  387    HD1  TRP  56           HD1      TRP  56  -3.894 -22.475  -2.667
  388    HE1  TRP  56           HE1      TRP  56  -4.514 -23.003  -5.081
  389    HE3  TRP  56           HE3      TRP  56   0.438 -24.633  -4.187
  390    HZ2  TRP  56           HZ2      TRP  56  -3.335 -24.207  -7.386
  391    HZ3  TRP  56           HZ3      TRP  56   0.671 -25.450  -6.504
  392    HH2  TRP  56           HH2      TRP  56  -1.203 -25.256  -8.112
  393    H    HIS  57           HN       HIS  57  -3.133 -20.529  -2.619
  394    HA   HIS  57           HA       HIS  57  -5.011 -20.950  -0.420
  395   1HB   HIS  57          HB2       HIS  57  -5.130 -18.521   0.140
  396   2HB   HIS  57          HB1       HIS  57  -3.532 -19.192   0.470
  397    HD1  HIS  57           HD1      HIS  57  -5.259 -17.601  -2.554
  398    HD2  HIS  57           HD2      HIS  57  -1.567 -17.597  -0.618
  399    HE1  HIS  57           HE1      HIS  57  -3.770 -16.026  -3.858
  400    H    GLN  58           HN       GLN  58  -6.966 -19.297  -0.847
  401    HA   GLN  58           HA       GLN  58  -7.670 -19.616  -3.719
  402   1HB   GLN  58          HB2       GLN  58  -9.271 -18.871  -1.246
  403   2HB   GLN  58          HB1       GLN  58  -9.954 -19.206  -2.837
  404   1HG   GLN  58          HG2       GLN  58  -8.138 -21.298  -1.817
  405   2HG   GLN  58          HG1       GLN  58  -9.621 -21.094  -0.884
  406   1HE2  GLN  58          HE21      GLN  58  -9.604 -20.301  -4.315
  407   2HE2  GLN  58          HE22      GLN  58 -10.534 -21.629  -4.817
  408    H    ARG  59           HN       ARG  59  -9.680 -17.491  -3.586
  409    HA   ARG  59           HA       ARG  59  -9.749 -15.229  -4.314
  410   1HB   ARG  59          HB2       ARG  59  -8.619 -15.562  -1.630
  411   2HB   ARG  59          HB1       ARG  59  -8.174 -14.023  -2.369
  412   1HG   ARG  59          HG2       ARG  59 -10.288 -13.781  -1.151
  413   2HG   ARG  59          HG1       ARG  59 -10.566 -13.600  -2.884
  414   1HD   ARG  59          HD2       ARG  59 -10.766 -16.397  -2.089
  415   2HD   ARG  59          HD1       ARG  59 -11.907 -15.381  -1.185
  416    HE   ARG  59           HE       ARG  59 -11.853 -14.631  -3.974
  417   1HH1  ARG  59          HH21      ARG  59 -12.309 -17.723  -2.972
  418   2HH1  ARG  59          HH22      ARG  59 -13.990 -17.832  -3.372
  419   1HH2  ARG  59          HH11      ARG  59 -14.341 -14.434  -3.967
  420   2HH2  ARG  59          HH12      ARG  59 -15.141 -15.970  -3.937
  421    H    THR  60           HN       THR  60  -8.403 -15.665  -6.260
  422    HA   THR  60           HA       THR  60  -5.647 -14.486  -6.021
  423    HB   THR  60           HB       THR  60  -5.171 -16.670  -6.640
  424    HG1  THR  60           HG1      THR  60  -4.383 -16.123  -8.479
  425   1HG2  THR  60          HG21      THR  60  -7.479 -17.482  -6.528
  426   2HG2  THR  60          HG22      THR  60  -6.707 -18.082  -7.996
  427   3HG2  THR  60          HG23      THR  60  -7.835 -16.729  -8.083
  428    H    THR  61           HN       THR  61  -4.917 -13.495  -8.105
  429    HA   THR  61           HA       THR  61  -6.915 -11.688  -9.150
  430    HB   THR  61           HB       THR  61  -4.794 -11.542 -10.858
  431    HG1  THR  61           HG1      THR  61  -3.006 -11.919  -9.262
  432   1HG2  THR  61          HG21      THR  61  -5.175 -10.487  -8.060
  433   2HG2  THR  61          HG22      THR  61  -5.520  -9.674  -9.587
  434   3HG2  THR  61          HG23      THR  61  -3.849  -9.951  -9.092
  435    H    GLU  62           HN       GLU  62  -6.051 -14.925  -9.842
  436    HA   GLU  62           HA       GLU  62  -6.694 -14.919 -12.648
  437   1HB   GLU  62          HB2       GLU  62  -5.628 -16.667 -10.712
  438   2HB   GLU  62          HB1       GLU  62  -7.115 -17.439 -11.266
  439   1HG   GLU  62          HG2       GLU  62  -6.217 -17.937 -13.277
  440   2HG   GLU  62          HG1       GLU  62  -5.581 -16.303 -13.475
  441    H    TYR  63           HN       TYR  63  -8.389 -15.203  -9.641
  442    HA   TYR  63           HA       TYR  63 -10.938 -15.770 -11.057
  443   1HB   TYR  63          HB2       TYR  63  -9.743 -16.375  -8.478
  444   2HB   TYR  63          HB1       TYR  63 -11.321 -15.614  -8.270
  445    HD1  TYR  63           HD1      TYR  63  -9.564 -18.628  -9.181
  446    HD2  TYR  63           HD2      TYR  63 -13.311 -16.562  -9.568
  447    HE1  TYR  63           HE1      TYR  63 -10.674 -20.756  -9.805
  448    HE2  TYR  63           HE2      TYR  63 -14.420 -18.691 -10.192
  449    HH   TYR  63           HH       TYR  63 -14.028 -21.135  -9.850
  450    H    TYR  64           HN       TYR  64  -9.068 -13.159 -10.270
  451    HA   TYR  64           HA       TYR  64 -11.482 -11.396 -10.071
  452   1HB   TYR  64          HB2       TYR  64  -9.140 -11.634  -8.187
  453   2HB   TYR  64          HB1       TYR  64 -10.030 -10.117  -8.320
  454    HD1  TYR  64           HD1      TYR  64 -10.209 -13.652  -7.303
  455    HD2  TYR  64           HD2      TYR  64 -12.362  -9.947  -7.612
  456    HE1  TYR  64           HE1      TYR  64 -11.989 -14.563  -5.837
  457    HE2  TYR  64           HE2      TYR  64 -14.141 -10.859  -6.144
  458    HH   TYR  64           HH       TYR  64 -14.719 -12.545  -4.792
  459    HA   PRO  65           HA       PRO  65  -8.437  -9.854 -13.137
  460   1HB   PRO  65          HB2       PRO  65 -10.312  -9.117 -14.988
  461   2HB   PRO  65          HB1       PRO  65  -9.664 -10.765 -14.876
  462   1HG   PRO  65          HG2       PRO  65 -12.256  -9.682 -13.910
  463   2HG   PRO  65          HG1       PRO  65 -11.881 -11.266 -14.606
  464   1HD   PRO  65          HD2       PRO  65 -12.225 -10.802 -11.922
  465   2HD   PRO  65          HD1       PRO  65 -11.276 -12.147 -12.591
  466    H    ASN  66           HN       ASN  66 -10.843  -8.557 -11.177
  467    HA   ASN  66           HA       ASN  66 -10.115  -5.762 -11.993
  468   1HB   ASN  66          HB2       ASN  66 -12.446  -5.216 -11.190
  469   2HB   ASN  66          HB1       ASN  66 -12.407  -6.275 -12.599
  470   1HD2  ASN  66          HD21      ASN  66 -13.823  -5.945  -9.568
  471   2HD2  ASN  66          HD22      ASN  66 -14.244  -7.567  -9.298
  472    H    GLY  67           HN       GLY  67  -9.295  -7.882  -9.765
  473   1HA   GLY  67          HA2       GLY  67 -10.051  -6.814  -7.238
  474   2HA   GLY  67          HA1       GLY  67  -8.566  -7.720  -7.536
  475    H    GLY  68           HN       GLY  68  -7.675  -5.764  -9.590
  476   1HA   GLY  68          HA2       GLY  68  -6.656  -3.625  -9.713
  477   2HA   GLY  68          HA1       GLY  68  -7.344  -3.240  -8.133
  478    H    LEU  69           HN       LEU  69  -6.057  -6.215  -7.746
  479    HA   LEU  69           HA       LEU  69  -3.448  -5.094  -6.830
  480   1HB   LEU  69          HB2       LEU  69  -3.669  -7.077  -5.193
  481   2HB   LEU  69          HB1       LEU  69  -4.741  -5.718  -4.965
  482    HG   LEU  69           HG       LEU  69  -6.548  -6.885  -6.110
  483   1HD1  LEU  69          HD11      LEU  69  -4.447  -9.034  -6.467
  484   2HD1  LEU  69          HD12      LEU  69  -5.340  -8.194  -7.733
  485   3HD1  LEU  69          HD13      LEU  69  -6.171  -9.329  -6.672
  486   1HD2  LEU  69          HD21      LEU  69  -7.078  -7.917  -4.173
  487   2HD2  LEU  69          HD22      LEU  69  -5.448  -7.526  -3.622
  488   3HD2  LEU  69          HD23      LEU  69  -5.775  -9.090  -4.369
  489    H    THR  70           HN       THR  70  -3.694  -5.912  -9.426
  490    HA   THR  70           HA       THR  70  -3.246  -8.558 -10.186
  491    HB   THR  70           HB       THR  70  -1.971  -7.519 -12.069
  492    HG1  THR  70           HG1      THR  70  -2.389  -5.014 -10.930
  493   1HG2  THR  70          HG21      THR  70  -4.460  -6.078 -11.122
  494   2HG2  THR  70          HG22      THR  70  -4.384  -7.473 -12.197
  495   3HG2  THR  70          HG23      THR  70  -3.782  -5.908 -12.741
  496    H    ARG  71           HN       ARG  71  -1.218  -9.702 -10.670
  497    HA   ARG  71           HA       ARG  71   0.814 -10.634  -9.901
  498   1HB   ARG  71          HB2       ARG  71   1.377  -7.650  -9.813
  499   2HB   ARG  71          HB1       ARG  71   2.604  -8.916  -9.885
  500   1HG   ARG  71          HG2       ARG  71   2.409  -8.997 -12.122
  501   2HG   ARG  71          HG1       ARG  71   0.697  -9.397 -11.965
  502   1HD   ARG  71          HD2       ARG  71   0.517  -6.767 -11.466
  503   2HD   ARG  71          HD1       ARG  71   1.979  -6.747 -12.473
  504    HE   ARG  71           HE       ARG  71   0.266  -8.444 -13.836
  505   1HH1  ARG  71          HH21      ARG  71   0.190  -5.203 -12.647
  506   2HH1  ARG  71          HH22      ARG  71  -0.954  -4.661 -13.827
  507   1HH2  ARG  71          HH11      ARG  71  -1.263  -7.760 -15.349
  508   2HH2  ARG  71          HH12      ARG  71  -1.776  -6.106 -15.356
  509    H    ASN  72           HN       ASN  72   2.435  -8.652  -8.032
  510    HA   ASN  72           HA       ASN  72   1.292  -9.750  -5.513
  511   1HB   ASN  72          HB2       ASN  72   3.523  -9.248  -4.661
  512   2HB   ASN  72          HB1       ASN  72   3.671 -10.107  -6.192
  513   1HD2  ASN  72          HD21      ASN  72   3.433  -6.702  -5.012
  514   2HD2  ASN  72          HD22      ASN  72   4.537  -6.076  -6.128
  515    H    TYR  73           HN       TYR  73   0.010  -7.400  -6.837
  516    HA   TYR  73           HA       TYR  73   0.898  -5.008  -5.415
  517   1HB   TYR  73          HB2       TYR  73  -1.599  -5.768  -6.965
  518   2HB   TYR  73          HB1       TYR  73  -1.294  -4.145  -6.359
  519    HD1  TYR  73           HD1      TYR  73   1.831  -5.572  -7.078
  520    HD2  TYR  73           HD2      TYR  73  -1.610  -3.891  -9.030
  521    HE1  TYR  73           HE1      TYR  73   3.205  -5.082  -9.082
  522    HE2  TYR  73           HE2      TYR  73  -0.233  -3.402 -11.033
  523    HH   TYR  73           HH       TYR  73   1.748  -3.795 -12.042
  524    H    CYS  74           HN       CYS  74   0.257  -4.327  -3.443
  525    HA   CYS  74           HA       CYS  74  -1.258  -6.056  -1.668
  526   1HB   CYS  74          HB2       CYS  74   0.710  -4.420  -1.225
  527   2HB   CYS  74          HB1       CYS  74  -0.526  -3.162  -1.204
  528    H    ARG  75           HN       ARG  75  -3.373  -5.734  -0.889
  529    HA   ARG  75           HA       ARG  75  -4.903  -3.332  -1.641
  530   1HB   ARG  75          HB2       ARG  75  -4.783  -5.733  -3.234
  531   2HB   ARG  75          HB1       ARG  75  -6.430  -5.487  -2.657
  532   1HG   ARG  75          HG2       ARG  75  -5.575  -2.929  -3.411
  533   2HG   ARG  75          HG1       ARG  75  -4.957  -3.982  -4.679
  534   1HD   ARG  75          HD2       ARG  75  -7.260  -4.989  -4.880
  535   2HD   ARG  75          HD1       ARG  75  -7.839  -3.752  -3.746
  536    HE   ARG  75           HE       ARG  75  -6.553  -3.110  -6.374
  537   1HH1  ARG  75          HH11      ARG  75  -7.270  -1.450  -3.656
  538   2HH1  ARG  75          HH12      ARG  75  -8.471  -0.409  -4.342
  539   1HH2  ARG  75          HH21      ARG  75  -8.701  -2.188  -7.310
  540   2HH2  ARG  75          HH22      ARG  75  -9.280  -0.826  -6.411
  541    H    ASN  76           HN       ASN  76  -7.320  -3.736  -0.933
  542    HA   ASN  76           HA       ASN  76  -7.356  -5.492   1.501
  543   1HB   ASN  76          HB2       ASN  76  -7.090  -2.862   1.642
  544   2HB   ASN  76          HB1       ASN  76  -8.827  -2.882   1.344
  545   1HD2  ASN  76          HD21      ASN  76  -8.868  -1.984   3.673
  546   2HD2  ASN  76          HD22      ASN  76  -8.860  -3.109   4.944
  547    HA   PRO  77           HA       PRO  77 -10.981  -6.485  -1.147
  548   1HB   PRO  77          HB2       PRO  77 -10.863  -9.184  -0.720
  549   2HB   PRO  77          HB1       PRO  77  -9.928  -8.366  -1.988
  550   1HG   PRO  77          HG2       PRO  77  -9.053  -9.332   0.683
  551   2HG   PRO  77          HG1       PRO  77  -8.186  -9.333  -0.859
  552   1HD   PRO  77          HD2       PRO  77  -7.753  -7.513   1.144
  553   2HD   PRO  77          HD1       PRO  77  -7.419  -7.203  -0.574
  554    H    ASP  78           HN       ASP  78 -10.212  -6.499   2.099
  555    HA   ASP  78           HA       ASP  78 -12.904  -7.564   2.892
  556   1HB   ASP  78          HB2       ASP  78 -10.306  -8.223   3.705
  557   2HB   ASP  78          HB1       ASP  78 -10.937  -7.224   5.015
  558    H    ALA  79           HN       ALA  79 -11.147  -4.727   2.479
  559    HA   ALA  79           HA       ALA  79 -11.590  -2.501   3.146
  560   1HB   ALA  79          HB1       ALA  79 -13.926  -3.524   2.687
  561   2HB   ALA  79          HB2       ALA  79 -13.864  -2.063   3.673
  562   3HB   ALA  79          HB3       ALA  79 -14.073  -3.637   4.441
  563    H    GLU  80           HN       GLU  80 -10.578  -4.815   5.100
  564    HA   GLU  80           HA       GLU  80 -11.238  -4.104   7.769
  565   1HB   GLU  80          HB2       GLU  80  -9.708  -5.964   6.503
  566   2HB   GLU  80          HB1       GLU  80  -8.448  -4.913   7.151
  567   1HG   GLU  80          HG2       GLU  80  -8.853  -5.550   9.288
  568   2HG   GLU  80          HG1       GLU  80 -10.602  -5.483   9.068
  569    H    ILE  81           HN       ILE  81  -8.690  -3.474   8.923
  570    HA   ILE  81           HA       ILE  81  -8.691  -0.677   9.046
  571    HB   ILE  81           HB       ILE  81  -6.299  -1.023   9.825
  572   1HG1  ILE  81          HG12      ILE  81  -6.118  -3.763  10.031
  573   2HG1  ILE  81          HG11      ILE  81  -6.790  -3.553   8.414
  574   1HG2  ILE  81          HG21      ILE  81  -7.552  -3.206  11.232
  575   2HG2  ILE  81          HG22      ILE  81  -8.728  -1.924  10.936
  576   3HG2  ILE  81          HG23      ILE  81  -7.229  -1.566  11.794
  577   1HD1  ILE  81          HD11      ILE  81  -4.825  -2.798   7.621
  578   2HD1  ILE  81          HD12      ILE  81  -4.105  -3.253   9.165
  579   3HD1  ILE  81          HD13      ILE  81  -4.700  -1.612   8.920
  580    H    SER  82           HN       SER  82  -7.009  -2.791   6.747
  581    HA   SER  82           HA       SER  82  -6.857  -0.735   4.731
  582   1HB   SER  82          HB2       SER  82  -4.906  -0.706   6.800
  583   2HB   SER  82          HB1       SER  82  -4.096  -1.260   5.338
  584    HG   SER  82           HG       SER  82  -5.419   0.618   4.396
  585    HA   PRO  83           HA       PRO  83  -5.804  -4.114   2.152
  586   1HB   PRO  83          HB2       PRO  83  -3.745  -3.241   0.576
  587   2HB   PRO  83          HB1       PRO  83  -5.414  -2.660   0.409
  588   1HG   PRO  83          HG2       PRO  83  -3.085  -1.367   1.722
  589   2HG   PRO  83          HG1       PRO  83  -4.392  -0.644   0.775
  590   1HD   PRO  83          HD2       PRO  83  -4.271  -0.578   3.506
  591   2HD   PRO  83          HD1       PRO  83  -5.781  -0.483   2.578
  592    H    TRP  84           HN       TRP  84  -4.551  -5.959   2.057
  593    HA   TRP  84           HA       TRP  84  -1.831  -5.950   3.299
  594   1HB   TRP  84          HB2       TRP  84  -2.615  -8.065   4.498
  595   2HB   TRP  84          HB1       TRP  84  -3.363  -6.570   5.062
  596    HD1  TRP  84           HD1      TRP  84  -5.908  -6.221   4.637
  597    HE1  TRP  84           HE1      TRP  84  -7.786  -7.752   3.756
  598    HE3  TRP  84           HE3      TRP  84  -3.111 -10.072   2.779
  599    HZ2  TRP  84           HZ2      TRP  84  -8.065 -10.273   2.438
  600    HZ3  TRP  84           HZ3      TRP  84  -4.209 -12.023   1.717
  601    HH2  TRP  84           HH2      TRP  84  -6.680 -12.129   1.544
  602    H    CYS  85           HN       CYS  85  -1.251  -8.652   3.060
  603    HA   CYS  85           HA       CYS  85  -2.202  -9.926   0.674
  604   1HB   CYS  85          HB2       CYS  85  -1.339  -8.036  -0.510
  605   2HB   CYS  85          HB1       CYS  85   0.147  -8.033   0.440
  606    H    TYR  86           HN       TYR  86  -0.748 -11.727  -0.009
  607    HA   TYR  86           HA       TYR  86   0.447 -13.103   2.225
  608   1HB   TYR  86          HB2       TYR  86   0.913 -13.629  -0.720
  609   2HB   TYR  86          HB1       TYR  86   0.828 -14.806   0.589
  610    HD1  TYR  86           HD1      TYR  86  -1.505 -14.503   2.022
  611    HD2  TYR  86           HD2      TYR  86  -0.931 -13.603  -2.140
  612    HE1  TYR  86           HE1      TYR  86  -3.938 -14.770   1.631
  613    HE2  TYR  86           HE2      TYR  86  -3.365 -13.871  -2.531
  614    HH   TYR  86           HH       TYR  86  -5.347 -14.232  -1.599
  615    H    THR  87           HN       THR  87   2.812 -13.817   2.187
  616    HA   THR  87           HA       THR  87   4.542 -11.501   1.421
  617    HB   THR  87           HB       THR  87   6.088 -13.137   2.930
  618    HG1  THR  87           HG1      THR  87   4.796 -14.704   3.501
  619   1HG2  THR  87          HG21      THR  87   4.100 -11.618   4.507
  620   2HG2  THR  87          HG22      THR  87   4.928 -10.711   3.240
  621   3HG2  THR  87          HG23      THR  87   5.860 -11.512   4.505
  622    H    MET  88           HN       MET  88   6.150 -11.765  -0.115
  623    HA   MET  88           HA       MET  88   6.152 -14.089  -1.829
  624   1HB   MET  88          HB2       MET  88   7.880 -12.868  -2.985
  625   2HB   MET  88          HB1       MET  88   6.729 -11.676  -2.382
  626   1HG   MET  88          HG2       MET  88   8.559 -10.664  -1.497
  627   2HG   MET  88          HG1       MET  88   8.448 -11.912  -0.255
  628   1HE   MET  88          HE1       MET  88  11.251 -10.447  -0.932
  629   2HE   MET  88          HE2       MET  88  12.203 -11.901  -0.642
  630   3HE   MET  88          HE3       MET  88  10.775 -11.581   0.340
  631    H    ASP  89           HN       ASP  89   7.376 -13.759   1.276
  632    HA   ASP  89           HA       ASP  89   9.693 -15.551   0.728
  633   1HB   ASP  89          HB2       ASP  89   9.406 -13.208   2.200
  634   2HB   ASP  89          HB1       ASP  89   9.343 -14.470   3.431
  635    HA   PRO  90           HA       PRO  90   7.315 -18.815   2.478
  636   1HB   PRO  90          HB2       PRO  90   9.394 -20.506   3.063
  637   2HB   PRO  90          HB1       PRO  90   8.786 -20.252   1.415
  638   1HG   PRO  90          HG2       PRO  90  11.173 -19.074   2.753
  639   2HG   PRO  90          HG1       PRO  90  10.982 -19.650   1.090
  640   1HD   PRO  90          HD2       PRO  90  10.914 -17.012   1.763
  641   2HD   PRO  90          HD1       PRO  90  10.025 -17.684   0.378
  642    H    ASN  91           HN       ASN  91   9.347 -16.751   4.160
  643    HA   ASN  91           HA       ASN  91   9.213 -18.166   6.752
  644   1HB   ASN  91          HB2       ASN  91  10.820 -16.189   5.475
  645   2HB   ASN  91          HB1       ASN  91  10.089 -15.429   6.889
  646   1HD2  ASN  91          HD21      ASN  91  11.956 -18.347   5.920
  647   2HD2  ASN  91          HD22      ASN  91  12.690 -18.563   7.434
  648    H    VAL  92           HN       VAL  92   7.220 -16.111   4.904
  649    HA   VAL  92           HA       VAL  92   5.697 -15.344   7.370
  650    HB   VAL  92           HB       VAL  92   6.301 -13.720   4.870
  651   1HG1  VAL  92          HG11      VAL  92   4.077 -13.174   5.644
  652   2HG1  VAL  92          HG12      VAL  92   5.151 -11.897   6.215
  653   3HG1  VAL  92          HG13      VAL  92   4.605 -13.153   7.326
  654   1HG2  VAL  92          HG21      VAL  92   8.224 -13.758   6.309
  655   2HG2  VAL  92          HG22      VAL  92   7.230 -13.588   7.756
  656   3HG2  VAL  92          HG23      VAL  92   7.401 -12.233   6.640
  657    H    ARG  93           HN       ARG  93   3.455 -15.572   7.178
  658    HA   ARG  93           HA       ARG  93   2.451 -17.060   4.876
  659   1HB   ARG  93          HB2       ARG  93   2.011 -17.183   7.529
  660   2HB   ARG  93          HB1       ARG  93   0.699 -16.093   7.081
  661   1HG   ARG  93          HG2       ARG  93   0.398 -17.937   5.142
  662   2HG   ARG  93          HG1       ARG  93   1.096 -18.962   6.397
  663   1HD   ARG  93          HD2       ARG  93  -0.756 -17.498   7.827
  664   2HD   ARG  93          HD1       ARG  93  -1.577 -17.738   6.272
  665    HE   ARG  93           HE       ARG  93  -0.967 -19.830   8.179
  666   1HH1  ARG  93          HH11      ARG  93  -1.199 -19.018   4.830
  667   2HH1  ARG  93          HH12      ARG  93  -1.504 -20.646   4.325
  668   1HH2  ARG  93          HH21      ARG  93  -1.342 -21.959   7.527
  669   2HH2  ARG  93          HH22      ARG  93  -1.585 -22.308   5.848
  670    H    TRP  94           HN       TRP  94   1.415 -14.136   6.640
  671    HA   TRP  94           HA       TRP  94   0.928 -12.666   4.143
  672   1HB   TRP  94          HB2       TRP  94  -1.468 -12.549   4.412
  673   2HB   TRP  94          HB1       TRP  94  -1.031 -14.253   4.525
  674    HD1  TRP  94           HD1      TRP  94  -1.526 -15.489   6.737
  675    HE1  TRP  94           HE1      TRP  94  -2.595 -14.804   8.982
  676    HE3  TRP  94           HE3      TRP  94  -1.707 -10.424   6.118
  677    HZ2  TRP  94           HZ2      TRP  94  -3.415 -12.422  10.335
  678    HZ3  TRP  94           HZ3      TRP  94  -2.635  -8.971   7.898
  679    HH2  TRP  94           HH2      TRP  94  -3.489  -9.963  10.004
  680    H    GLU  95           HN       GLU  95   0.129 -10.388   4.711
  681    HA   GLU  95           HA       GLU  95   0.148  -9.555   7.503
  682   1HB   GLU  95          HB2       GLU  95   2.576 -10.194   6.739
  683   2HB   GLU  95          HB1       GLU  95   2.526  -8.643   5.901
  684   1HG   GLU  95          HG2       GLU  95   3.169  -7.730   7.867
  685   2HG   GLU  95          HG1       GLU  95   1.518  -8.032   8.410
  686    H    TYR  96           HN       TYR  96  -0.075  -7.180   7.691
  687    HA   TYR  96           HA       TYR  96  -1.590  -6.041   5.469
  688   1HB   TYR  96          HB2       TYR  96  -0.767  -5.278   8.255
  689   2HB   TYR  96          HB1       TYR  96  -1.391  -4.023   7.182
  690    HD1  TYR  96           HD1      TYR  96  -3.694  -4.095   6.352
  691    HD2  TYR  96           HD2      TYR  96  -2.184  -7.125   8.996
  692    HE1  TYR  96           HE1      TYR  96  -6.008  -4.884   6.770
  693    HE2  TYR  96           HE2      TYR  96  -4.498  -7.914   9.414
  694    HH   TYR  96           HH       TYR  96  -6.847  -6.861   9.296
  695    H    CYS  97           HN       CYS  97  -0.957  -3.695   4.763
  696    HA   CYS  97           HA       CYS  97   1.958  -3.735   4.129
  697   1HB   CYS  97          HB2       CYS  97  -0.549  -2.786   2.802
  698   2HB   CYS  97          HB1       CYS  97   0.970  -1.998   2.378
  699    H    ASN  98           HN       ASN  98   3.239  -1.896   4.486
  700    HA   ASN  98           HA       ASN  98   2.747  -0.226   6.701
  701   1HB   ASN  98          HB2       ASN  98   4.481  -0.103   4.245
  702   2HB   ASN  98          HB1       ASN  98   4.480   1.249   5.378
  703   1HD2  ASN  98          HD21      ASN  98   6.889   0.074   5.312
  704   2HD2  ASN  98          HD22      ASN  98   7.137  -0.977   6.622
  705    H    LEU  99           HN       LEU  99   0.502   0.541   6.393
  706    HA   LEU  99           HA       LEU  99   0.390   2.857   4.491
  707   1HB   LEU  99          HB2       LEU  99  -1.725   0.780   5.132
  708   2HB   LEU  99          HB1       LEU  99  -1.975   2.183   4.093
  709    HG   LEU  99           HG       LEU  99   0.395   0.536   3.438
  710   1HD1  LEU  99          HD11      LEU  99  -1.171  -1.050   2.148
  711   2HD1  LEU  99          HD12      LEU  99  -2.433  -0.497   3.248
  712   3HD1  LEU  99          HD13      LEU  99  -1.009  -1.320   3.884
  713   1HD2  LEU  99          HD21      LEU  99  -0.944   2.566   2.237
  714   2HD2  LEU  99          HD22      LEU  99  -1.739   1.187   1.478
  715   3HD2  LEU  99          HD23      LEU  99   0.009   1.380   1.344
  716    H    THR 100           HN       THR 100  -0.413   4.720   5.360
  717    HA   THR 100           HA       THR 100  -1.434   4.639   8.169
  718    HB   THR 100           HB       THR 100  -0.448   6.819   8.373
  719    HG1  THR 100           HG1      THR 100   0.688   7.542   6.324
  720   1HG2  THR 100          HG21      THR 100   1.857   6.308   8.036
  721   2HG2  THR 100          HG22      THR 100   1.491   5.240   6.680
  722   3HG2  THR 100          HG23      THR 100   1.062   4.760   8.322
  723    H    GLN 101           HN       GLN 101  -3.166   6.213   8.644
  724    HA   GLN 101           HA       GLN 101  -5.231   6.287   6.625
  725   1HB   GLN 101          HB2       GLN 101  -5.052   6.521   9.347
  726   2HB   GLN 101          HB1       GLN 101  -5.342   8.198   8.882
  727   1HG   GLN 101          HG2       GLN 101  -7.294   7.428   7.515
  728   2HG   GLN 101          HG1       GLN 101  -7.043   5.799   8.144
  729   1HE2  GLN 101          HE21      GLN 101  -7.013   9.067   9.692
  730   2HE2  GLN 101          HE22      GLN 101  -8.104   8.651  10.924
  731    H    CYS 102           HN       CYS 102  -4.112   7.395   4.813
  732    HA   CYS 102           HA       CYS 102  -2.783   9.770   4.726
  733   1HB   CYS 102          HB2       CYS 102  -4.386   8.169   3.003
  734   2HB   CYS 102          HB1       CYS 102  -4.806   9.857   2.707
  735    HA   PRO 103           HA       PRO 103  -6.780  12.377   4.929
  736   1HB   PRO 103          HB2       PRO 103  -9.100  11.130   5.671
  737   2HB   PRO 103          HB1       PRO 103  -8.571  11.269   3.982
  738   1HG   PRO 103          HG2       PRO 103  -8.393   8.952   5.835
  739   2HG   PRO 103          HG1       PRO 103  -8.730   8.988   4.098
  740   1HD   PRO 103          HD2       PRO 103  -6.300   8.324   5.169
  741   2HD   PRO 103          HD1       PRO 103  -6.515   8.995   3.538
  742    H    VAL 104           HN       VAL 104  -6.194  13.448   6.786
  743    HA   VAL 104           HA       VAL 104  -7.088  12.302   9.400
  744    HB   VAL 104           HB       VAL 104  -4.349  13.370   8.642
  745   1HG1  VAL 104          HG11      VAL 104  -3.743  13.025  10.999
  746   2HG1  VAL 104          HG12      VAL 104  -5.398  12.537  11.365
  747   3HG1  VAL 104          HG13      VAL 104  -5.056  14.195  10.872
  748   1HG2  VAL 104          HG21      VAL 104  -5.387  10.814   8.472
  749   2HG2  VAL 104          HG22      VAL 104  -4.613  10.806  10.056
  750   3HG2  VAL 104          HG23      VAL 104  -3.674  11.203   8.617
  751    H    THR 105           HN       THR 105  -5.042  15.127   8.803
  752    HA   THR 105           HA       THR 105  -7.285  16.863   9.779
  753    HB   THR 105           HB       THR 105  -5.157  16.460  11.159
  754    HG1  THR 105           HG1      THR 105  -6.030  18.215  11.900
  755   1HG2  THR 105          HG21      THR 105  -3.129  17.469  10.483
  756   2HG2  THR 105          HG22      THR 105  -3.920  18.408   9.216
  757   3HG2  THR 105          HG23      THR 105  -3.718  16.665   9.028
  758    H    GLU 106           HN       GLU 106  -7.161  19.147   8.925
  759    HA   GLU 106           HA       GLU 106  -5.603  20.013   6.762
  760   1HB   GLU 106          HB2       GLU 106  -7.302  17.855   6.085
  761   2HB   GLU 106          HB1       GLU 106  -8.025  19.289   5.358
  762   1HG   GLU 106          HG2       GLU 106  -5.303  19.605   4.867
  763   2HG   GLU 106          HG1       GLU 106  -5.577  17.879   4.621
  764    H    SER 107           HN       SER 107  -5.958  22.133   7.415
  765    HA   SER 107           HA       SER 107  -8.693  23.072   8.015
  766   1HB   SER 107          HB2       SER 107  -5.955  24.381   7.992
  767   2HB   SER 107          HB1       SER 107  -7.427  25.180   8.536
  768    HG   SER 107           HG       SER 107  -6.731  22.666   9.579
  769    H    SER 108           HN       SER 108  -6.149  23.657   5.572
  770    HA   SER 108           HA       SER 108  -8.265  24.802   3.787
  771   1HB   SER 108          HB2       SER 108  -5.665  25.955   4.739
  772   2HB   SER 108          HB1       SER 108  -6.226  26.366   3.120
  773    HG   SER 108           HG       SER 108  -7.880  27.431   3.954
  774    H    VAL 109           HN       VAL 109  -8.072  24.119   1.651
  775    HA   VAL 109           HA       VAL 109  -6.106  22.013   1.058
  776    HB   VAL 109           HB       VAL 109  -8.549  22.002   0.426
  777   1HG1  VAL 109          HG11      VAL 109  -9.455  23.704  -0.746
  778   2HG1  VAL 109          HG12      VAL 109  -8.175  23.632  -1.956
  779   3HG1  VAL 109          HG13      VAL 109  -7.947  24.580  -0.487
  780   1HG2  VAL 109          HG21      VAL 109  -7.312  20.460  -0.821
  781   2HG2  VAL 109          HG22      VAL 109  -6.332  21.712  -1.584
  782   3HG2  VAL 109          HG23      VAL 109  -8.002  21.467  -2.094
  783    H    LEU 110           HN       LEU 110  -4.358  22.229  -0.356
  784    HA   LEU 110           HA       LEU 110  -3.205  24.811  -0.804
  785   1HB   LEU 110          HB2       LEU 110  -1.688  23.432  -2.309
  786   2HB   LEU 110          HB1       LEU 110  -1.863  22.814  -0.666
  787    HG   LEU 110           HG       LEU 110  -3.979  21.648  -2.078
  788   1HD1  LEU 110          HD11      LEU 110  -1.504  21.939  -3.758
  789   2HD1  LEU 110          HD12      LEU 110  -3.195  22.055  -4.243
  790   3HD1  LEU 110          HD13      LEU 110  -2.485  20.480  -3.890
  791   1HD2  LEU 110          HD21      LEU 110  -3.086  20.063  -0.738
  792   2HD2  LEU 110          HD22      LEU 110  -1.525  20.883  -0.704
  793   3HD2  LEU 110          HD23      LEU 110  -1.908  19.769  -2.017
  794    H    ALA 111           HN       ALA 111  -5.283  22.763  -2.812
  795    HA   ALA 111           HA       ALA 111  -4.911  24.288  -5.256
  796   1HB   ALA 111          HB1       ALA 111  -5.609  22.006  -5.385
  797   2HB   ALA 111          HB2       ALA 111  -7.023  22.951  -5.852
  798   3HB   ALA 111          HB3       ALA 111  -6.916  22.267  -4.230
  799    H    THR 112           HN       THR 112  -6.605  25.634  -6.249
  800    HA   THR 112           HA       THR 112  -8.078  27.244  -4.214
  801    HB   THR 112           HB       THR 112  -7.754  27.898  -7.135
  802    HG1  THR 112           HG1      THR 112  -5.740  28.926  -6.361
  803   1HG2  THR 112          HG21      THR 112  -7.421  29.775  -4.822
  804   2HG2  THR 112          HG22      THR 112  -9.042  29.245  -5.269
  805   3HG2  THR 112          HG23      THR 112  -8.038  30.098  -6.442
  806    H    SER 113           HN       SER 113  -9.891  25.745  -3.977
  807    HA   SER 113           HA       SER 113 -11.448  24.899  -6.294
  808   1HB   SER 113          HB2       SER 113 -12.787  23.831  -4.636
  809   2HB   SER 113          HB1       SER 113 -11.148  23.789  -3.991
  810    HG   SER 113           HG       SER 113 -12.124  24.699  -2.342
  811    H    THR 114           HN       THR 114 -12.877  26.203  -7.355
  812    HA   THR 114           HA       THR 114 -14.378  28.265  -5.799
  813    HB   THR 114           HB       THR 114 -13.858  29.547  -8.155
  814    HG1  THR 114           HG1      THR 114 -12.034  28.897  -8.978
  815   1HG2  THR 114          HG21      THR 114 -13.411  30.042  -5.564
  816   2HG2  THR 114          HG22      THR 114 -12.668  31.010  -6.836
  817   3HG2  THR 114          HG23      THR 114 -11.748  29.724  -6.056
  818    H    ALA 115           HN       ALA 115 -16.456  27.495  -6.095
  819    HA   ALA 115           HA       ALA 115 -17.234  26.409  -8.758
  820   1HB   ALA 115          HB1       ALA 115 -19.099  25.474  -7.521
  821   2HB   ALA 115          HB2       ALA 115 -18.747  26.502  -6.132
  822   3HB   ALA 115          HB3       ALA 115 -17.637  25.205  -6.572
  823    H    VAL 116           HN       VAL 116 -16.997  29.403  -7.635
  824    HA   VAL 116           HA       VAL 116 -19.502  30.659  -7.613
  825    HB   VAL 116           HB       VAL 116 -17.167  31.610  -7.266
  826   1HG1  VAL 116          HG11      VAL 116 -15.895  32.318  -9.156
  827   2HG1  VAL 116          HG12      VAL 116 -17.228  31.999 -10.265
  828   3HG1  VAL 116          HG13      VAL 116 -16.370  30.656  -9.508
  829   1HG2  VAL 116          HG21      VAL 116 -18.097  33.674  -7.445
  830   2HG2  VAL 116          HG22      VAL 116 -19.529  32.830  -8.034
  831   3HG2  VAL 116          HG23      VAL 116 -18.364  33.492  -9.179
  832    H    SER 117           HN       SER 117 -17.843  29.152 -10.287
  833    HA   SER 117           HA       SER 117 -19.696  30.393 -12.266
  834   1HB   SER 117          HB2       SER 117 -17.098  28.882 -12.316
  835   2HB   SER 117          HB1       SER 117 -18.080  28.961 -13.776
  836    HG   SER 117           HG       SER 117 -17.484  31.276 -12.276
  837    H    GLU 118           HN       GLU 118 -21.243  29.144 -13.348
  838    HA   GLU 118           HA       GLU 118 -21.330  26.213 -12.752
  839   1HB   GLU 118          HB2       GLU 118 -22.880  28.148 -11.520
  840   2HB   GLU 118          HB1       GLU 118 -23.928  27.586 -12.823
  841   1HG   GLU 118          HG2       GLU 118 -24.449  25.839 -11.494
  842   2HG   GLU 118          HG1       GLU 118 -22.814  25.244 -11.791
  843    H    GLN 119           HN       GLN 119 -21.520  25.119 -14.661
  844    HA   GLN 119           HA       GLN 119 -22.543  26.578 -17.059
  845   1HB   GLN 119          HB2       GLN 119 -21.072  23.933 -16.843
  846   2HB   GLN 119          HB1       GLN 119 -21.271  24.924 -18.289
  847   1HG   GLN 119          HG2       GLN 119 -20.102  26.777 -16.828
  848   2HG   GLN 119          HG1       GLN 119 -19.519  25.398 -15.897
  849   1HE2  GLN 119          HE21      GLN 119 -17.884  24.069 -16.842
  850   2HE2  GLN 119          HE22      GLN 119 -17.194  24.388 -18.360
  Start of MODEL    3
    1   1H    ALA   1          HT1       ALA   1  23.894  -0.096  -0.088
    2   2H    ALA   1          HT2       ALA   1  24.580   1.302  -0.767
    3   3H    ALA   1          HT3       ALA   1  23.644   1.411   0.646
    4    HA   ALA   1           HA       ALA   1  25.354  -0.063   1.754
    5   1HB   ALA   1          HB1       ALA   1  27.541  -0.022   0.482
    6   2HB   ALA   1          HB2       ALA   1  26.660   0.656  -0.888
    7   3HB   ALA   1          HB3       ALA   1  26.271  -0.962  -0.301
    8    H    ARG   2           HN       ARG   2  26.009   2.806  -0.301
    9    HA   ARG   2           HA       ARG   2  27.054   4.203   2.135
   10   1HB   ARG   2          HB2       ARG   2  28.063   3.801  -0.446
   11   2HB   ARG   2          HB1       ARG   2  27.508   5.475  -0.449
   12   1HG   ARG   2          HG2       ARG   2  28.784   5.867   1.657
   13   2HG   ARG   2          HG1       ARG   2  29.405   4.219   1.555
   14   1HD   ARG   2          HD2       ARG   2  29.815   5.465  -0.993
   15   2HD   ARG   2          HD1       ARG   2  30.445   6.546   0.267
   16    HE   ARG   2           HE       ARG   2  31.115   3.661   0.477
   17   1HH1  ARG   2          HH21      ARG   2  32.695   4.737  -1.753
   18   2HH1  ARG   2          HH22      ARG   2  34.090   5.397  -0.968
   19   1HH2  ARG   2          HH11      ARG   2  32.622   5.453   2.175
   20   2HH2  ARG   2          HH12      ARG   2  34.049   5.802   1.258
   21    H    ILE   3           HN       ILE   3  25.050   5.023   2.941
   22    HA   ILE   3           HA       ILE   3  23.120   6.406   2.974
   23    HB   ILE   3           HB       ILE   3  25.190   7.900   1.340
   24   1HG1  ILE   3          HG12      ILE   3  24.371   8.507   4.164
   25   2HG1  ILE   3          HG11      ILE   3  25.450   7.145   3.860
   26   1HG2  ILE   3          HG21      ILE   3  23.919   9.895   1.613
   27   2HG2  ILE   3          HG22      ILE   3  22.815   9.127   2.753
   28   3HG2  ILE   3          HG23      ILE   3  22.764   8.690   1.045
   29   1HD1  ILE   3          HD11      ILE   3  26.108   9.922   3.949
   30   2HD1  ILE   3          HD12      ILE   3  26.359   9.358   2.297
   31   3HD1  ILE   3          HD13      ILE   3  27.182   8.559   3.636
   32    H    HIS   4           HN       HIS   4  21.615   5.144   1.732
   33    HA   HIS   4           HA       HIS   4  20.151   4.763  -0.085
   34   1HB   HIS   4          HB2       HIS   4  21.107   7.528  -0.167
   35   2HB   HIS   4          HB1       HIS   4  20.627   6.938  -1.758
   36    HD1  HIS   4           HD1      HIS   4  19.111   8.879   0.553
   37    HD2  HIS   4           HD2      HIS   4  18.015   5.133  -0.911
   38    HE1  HIS   4           HE1      HIS   4  16.627   8.643   0.980
   39    H    HIS   5           HN       HIS   5  20.186   4.270  -2.462
   40    HA   HIS   5           HA       HIS   5  22.758   4.269  -3.864
   41   1HB   HIS   5          HB2       HIS   5  22.916   1.782  -3.879
   42   2HB   HIS   5          HB1       HIS   5  23.047   2.440  -2.248
   43    HD1  HIS   5           HD1      HIS   5  20.974   0.228  -4.361
   44    HD2  HIS   5           HD2      HIS   5  20.600   2.138  -0.674
   45    HE1  HIS   5           HE1      HIS   5  19.007  -0.855  -3.190
   46    H    HIS   6           HN       HIS   6  20.308   5.345  -4.650
   47    HA   HIS   6           HA       HIS   6  18.764   5.310  -6.441
   48   1HB   HIS   6          HB2       HIS   6  21.174   3.748  -7.196
   49   2HB   HIS   6          HB1       HIS   6  19.761   3.514  -8.226
   50    HD1  HIS   6           HD1      HIS   6  19.013   5.476  -9.696
   51    HD2  HIS   6           HD2      HIS   6  22.190   6.449  -7.177
   52    HE1  HIS   6           HE1      HIS   6  19.860   7.741 -10.451
   53    H    HIS   7           HN       HIS   7  17.072   4.295  -5.121
   54    HA   HIS   7           HA       HIS   7  16.842   1.340  -5.245
   55   1HB   HIS   7          HB2       HIS   7  16.183   3.374  -3.429
   56   2HB   HIS   7          HB1       HIS   7  14.632   2.819  -4.058
   57    HD1  HIS   7           HD1      HIS   7  16.935   2.064  -1.456
   58    HD2  HIS   7           HD2      HIS   7  14.656  -0.273  -4.049
   59    HE1  HIS   7           HE1      HIS   7  16.787  -0.235  -0.405
   60    H    HIS   8           HN       HIS   8  13.896   1.491  -5.171
   61    HA   HIS   8           HA       HIS   8  13.411   2.004  -8.084
   62   1HB   HIS   8          HB2       HIS   8  12.554  -0.046  -6.081
   63   2HB   HIS   8          HB1       HIS   8  11.434   0.346  -7.385
   64    HD1  HIS   8           HD1      HIS   8  12.505   0.171  -9.886
   65    HD2  HIS   8           HD2      HIS   8  14.597  -1.766  -6.844
   66    HE1  HIS   8           HE1      HIS   8  14.075  -1.460 -11.021
   67    H    HIS   9           HN       HIS   9  13.210   4.201  -6.323
   68    HA   HIS   9           HA       HIS   9  11.682   5.954  -5.876
   69   1HB   HIS   9          HB2       HIS   9  10.612   4.328  -7.960
   70   2HB   HIS   9          HB1       HIS   9   9.280   4.737  -6.879
   71    HD1  HIS   9           HD1      HIS   9   9.454   7.479  -6.121
   72    HD2  HIS   9           HD2      HIS   9  10.979   6.321  -9.824
   73    HE1  HIS   9           HE1      HIS   9   9.593   9.580  -7.527
   74    H    ILE  10           HN       ILE  10  11.762   3.072  -4.415
   75    HA   ILE  10           HA       ILE  10   9.219   3.142  -2.941
   76    HB   ILE  10           HB       ILE  10  10.265   1.193  -1.798
   77   1HG1  ILE  10          HG12      ILE  10  12.576   0.737  -3.289
   78   2HG1  ILE  10          HG11      ILE  10  12.661   2.455  -2.900
   79   1HG2  ILE  10          HG21      ILE  10  10.554   1.282  -4.816
   80   2HG2  ILE  10          HG22      ILE  10   9.127   0.783  -3.907
   81   3HG2  ILE  10          HG23      ILE  10  10.591  -0.200  -3.860
   82   1HD1  ILE  10          HD11      ILE  10  13.552   1.696  -0.941
   83   2HD1  ILE  10          HD12      ILE  10  12.810   0.105  -1.104
   84   3HD1  ILE  10          HD13      ILE  10  11.859   1.464  -0.504
   85    H    GLU  11           HN       GLU  11   8.924   4.397  -1.145
   86    HA   GLU  11           HA       GLU  11  11.294   5.058   0.557
   87   1HB   GLU  11          HB2       GLU  11  10.481   7.394   0.625
   88   2HB   GLU  11          HB1       GLU  11  10.821   6.898  -1.033
   89   1HG   GLU  11          HG2       GLU  11   8.271   6.166  -0.982
   90   2HG   GLU  11          HG1       GLU  11   8.183   7.376   0.298
   91    H    GLY  12           HN       GLY  12   8.935   3.184   0.809
   92   1HA   GLY  12          HA2       GLY  12   6.884   4.074   2.465
   93   2HA   GLY  12          HA1       GLY  12   7.610   2.475   2.622
   94    H    ARG  13           HN       ARG  13  10.274   3.637   3.276
   95    HA   ARG  13           HA       ARG  13   9.777   4.033   6.165
   96   1HB   ARG  13          HB2       ARG  13  11.707   2.798   4.535
   97   2HB   ARG  13          HB1       ARG  13  12.536   4.174   5.263
   98   1HG   ARG  13          HG2       ARG  13  11.428   3.365   7.482
   99   2HG   ARG  13          HG1       ARG  13  11.214   1.838   6.623
  100   1HD   ARG  13          HD2       ARG  13  13.779   2.185   6.022
  101   2HD   ARG  13          HD1       ARG  13  13.753   3.175   7.495
  102    HE   ARG  13           HE       ARG  13  13.015   0.284   7.371
  103   1HH1  ARG  13          HH11      ARG  13  11.518   1.706   9.506
  104   2HH1  ARG  13          HH12      ARG  13  12.587   1.583  10.863
  105   1HH2  ARG  13          HH21      ARG  13  15.355   0.759   8.946
  106   2HH2  ARG  13          HH22      ARG  13  14.759   1.050  10.546
  107    H    ALA  14           HN       ALA  14  10.790   5.842   7.319
  108    HA   ALA  14           HA       ALA  14  11.356   8.235   5.603
  109   1HB   ALA  14          HB1       ALA  14   9.552   7.906   8.014
  110   2HB   ALA  14          HB2       ALA  14   9.093   8.424   6.392
  111   3HB   ALA  14          HB3       ALA  14  10.060   9.485   7.417
  112    HA   PRO  15           HA       PRO  15  14.796   8.849   8.261
  113   1HB   PRO  15          HB2       PRO  15  14.959  11.577   8.350
  114   2HB   PRO  15          HB1       PRO  15  15.384  10.631   6.910
  115   1HG   PRO  15          HG2       PRO  15  12.916  12.176   7.498
  116   2HG   PRO  15          HG1       PRO  15  13.780  11.964   5.968
  117   1HD   PRO  15          HD2       PRO  15  11.486  10.617   6.641
  118   2HD   PRO  15          HD1       PRO  15  12.687  10.024   5.474
  119    H    THR  16           HN       THR  16  13.403  11.866   9.338
  120    HA   THR  16           HA       THR  16  12.569  10.609  11.920
  121    HB   THR  16           HB       THR  16  13.753  12.805  12.833
  122    HG1  THR  16           HG1      THR  16  14.486  13.770  11.075
  123   1HG2  THR  16          HG21      THR  16  15.773  10.823  11.975
  124   2HG2  THR  16          HG22      THR  16  14.376  10.155  12.818
  125   3HG2  THR  16          HG23      THR  16  15.369  11.389  13.595
  126    H    GLU  17           HN       GLU  17  12.532  13.503   9.842
  127    HA   GLU  17           HA       GLU  17  10.591  15.006  11.242
  128   1HB   GLU  17          HB2       GLU  17  11.923  15.991   9.518
  129   2HB   GLU  17          HB1       GLU  17  11.412  14.781   8.342
  130   1HG   GLU  17          HG2       GLU  17   9.039  15.659   8.661
  131   2HG   GLU  17          HG1       GLU  17   9.755  17.009   9.543
  132    H    GLN  18           HN       GLN  18   8.356  14.850  11.323
  133    HA   GLN  18           HA       GLN  18   6.941  12.516  10.724
  134   1HB   GLN  18          HB2       GLN  18   6.118  15.423  10.946
  135   2HB   GLN  18          HB1       GLN  18   4.948  14.105  10.861
  136   1HG   GLN  18          HG2       GLN  18   5.158  14.150  13.139
  137   2HG   GLN  18          HG1       GLN  18   6.575  13.152  12.807
  138   1HE2  GLN  18          HE21      GLN  18   5.665  16.636  13.092
  139   2HE2  GLN  18          HE22      GLN  18   7.146  17.116  13.768
  140    H    SER  19           HN       SER  19   7.593  11.871   8.556
  141    HA   SER  19           HA       SER  19   7.160  13.546   6.240
  142   1HB   SER  19          HB2       SER  19   8.682  11.889   5.815
  143   2HB   SER  19          HB1       SER  19   7.920  10.767   6.937
  144    HG   SER  19           HG       SER  19   6.482  10.198   5.405
  145    HA   PRO  20           HA       PRO  20   2.894  12.860   5.491
  146   1HB   PRO  20          HB2       PRO  20   2.838  12.799   2.755
  147   2HB   PRO  20          HB1       PRO  20   3.100  14.288   3.684
  148   1HG   PRO  20          HG2       PRO  20   5.071  12.564   2.276
  149   2HG   PRO  20          HG1       PRO  20   5.021  14.326   2.436
  150   1HD   PRO  20          HD2       PRO  20   6.662  12.703   3.908
  151   2HD   PRO  20          HD1       PRO  20   6.103  14.302   4.446
  152    H    GLY  21           HN       GLY  21   1.399  11.338   4.087
  153   1HA   GLY  21          HA2       GLY  21   1.223   9.165   2.938
  154   2HA   GLY  21          HA1       GLY  21   2.694   8.665   3.773
  155    H    VAL  22           HN       VAL  22  -0.210  10.272   5.089
  156    HA   VAL  22           HA       VAL  22  -0.548   7.901   6.898
  157    HB   VAL  22           HB       VAL  22  -1.488   9.743   8.448
  158   1HG1  VAL  22          HG11      VAL  22   1.371  10.363   7.977
  159   2HG1  VAL  22          HG12      VAL  22   0.990   8.655   8.193
  160   3HG1  VAL  22          HG13      VAL  22   0.564   9.819   9.448
  161   1HG2  VAL  22          HG21      VAL  22  -1.030  11.993   7.952
  162   2HG2  VAL  22          HG22      VAL  22  -1.529  11.354   6.387
  163   3HG2  VAL  22          HG23      VAL  22   0.184  11.578   6.742
  164    H    GLN  23           HN       GLN  23  -2.624   7.053   7.015
  165    HA   GLN  23           HA       GLN  23  -5.068   8.361   6.651
  166   1HB   GLN  23          HB2       GLN  23  -3.519   7.968   4.212
  167   2HB   GLN  23          HB1       GLN  23  -5.107   7.209   4.100
  168   1HG   GLN  23          HG2       GLN  23  -4.957   9.966   5.245
  169   2HG   GLN  23          HG1       GLN  23  -4.762   9.785   3.502
  170   1HE2  GLN  23          HE21      GLN  23  -7.055   9.504   6.161
  171   2HE2  GLN  23          HE22      GLN  23  -8.420   9.202   5.198
  172    H    ASP  24           HN       ASP  24  -4.407   6.288   8.266
  173    HA   ASP  24           HA       ASP  24  -4.966   3.668   7.148
  174   1HB   ASP  24          HB2       ASP  24  -4.979   3.036   9.535
  175   2HB   ASP  24          HB1       ASP  24  -3.628   4.118   9.192
  176    H    CYS  25           HN       CYS  25  -7.009   4.508   5.996
  177    HA   CYS  25           HA       CYS  25  -9.347   3.723   7.565
  178   1HB   CYS  25          HB2       CYS  25 -10.355   5.795   7.783
  179   2HB   CYS  25          HB1       CYS  25  -8.665   6.250   7.944
  180    H    TYR  26           HN       TYR  26 -11.374   3.898   6.102
  181    HA   TYR  26           HA       TYR  26 -10.792   3.981   3.203
  182   1HB   TYR  26          HB2       TYR  26 -11.540   1.660   2.888
  183   2HB   TYR  26          HB1       TYR  26 -10.153   1.710   3.974
  184    HD1  TYR  26           HD1      TYR  26 -13.890   1.594   3.933
  185    HD2  TYR  26           HD2      TYR  26 -10.297   0.826   6.151
  186    HE1  TYR  26           HE1      TYR  26 -15.216   0.444   5.681
  187    HE2  TYR  26           HE2      TYR  26 -11.621  -0.338   7.892
  188    HH   TYR  26           HH       TYR  26 -13.756  -0.612   8.699
  189    H    HIS  27           HN       HIS  27 -13.091   2.926   2.199
  190    HA   HIS  27           HA       HIS  27 -15.270   4.403   3.649
  191   1HB   HIS  27          HB2       HIS  27 -14.611   5.709   1.766
  192   2HB   HIS  27          HB1       HIS  27 -14.473   4.285   0.734
  193    HD1  HIS  27           HD1      HIS  27 -17.336   5.471   2.967
  194    HD2  HIS  27           HD2      HIS  27 -16.607   4.442  -1.006
  195    HE1  HIS  27           HE1      HIS  27 -19.566   5.597   1.774
  196    H    GLY  28           HN       GLY  28 -15.838   2.216   4.547
  197   1HA   GLY  28          HA2       GLY  28 -17.789   0.744   4.292
  198   2HA   GLY  28          HA1       GLY  28 -17.458   0.685   2.562
  199    H    ASP  29           HN       ASP  29 -15.419  -0.431   1.909
  200    HA   ASP  29           HA       ASP  29 -14.458  -2.427   3.896
  201   1HB   ASP  29          HB2       ASP  29 -16.204  -2.821   1.630
  202   2HB   ASP  29          HB1       ASP  29 -14.715  -3.744   1.427
  203    H    GLY  30           HN       GLY  30 -13.348   0.021   2.458
  204   1HA   GLY  30          HA2       GLY  30 -11.337   0.604   1.386
  205   2HA   GLY  30          HA1       GLY  30 -10.702  -0.907   2.045
  206    H    GLN  31           HN       GLN  31 -13.495  -1.411   0.174
  207    HA   GLN  31           HA       GLN  31 -12.115  -2.981  -1.792
  208   1HB   GLN  31          HB2       GLN  31 -14.818  -2.125  -1.085
  209   2HB   GLN  31          HB1       GLN  31 -14.608  -2.274  -2.830
  210   1HG   GLN  31          HG2       GLN  31 -13.312  -4.499  -1.581
  211   2HG   GLN  31          HG1       GLN  31 -14.943  -4.368  -0.922
  212   1HE2  GLN  31          HE21      GLN  31 -13.491  -6.105  -3.178
  213   2HE2  GLN  31          HE22      GLN  31 -14.646  -6.097  -4.422
  214    H    SER  32           HN       SER  32 -13.476   0.320  -1.927
  215    HA   SER  32           HA       SER  32 -12.506   0.680  -4.695
  216   1HB   SER  32          HB2       SER  32 -13.767   2.661  -2.779
  217   2HB   SER  32          HB1       SER  32 -13.720   2.764  -4.536
  218    HG   SER  32           HG       SER  32 -15.670   1.907  -4.130
  219    H    TYR  33           HN       TYR  33 -10.685   0.347  -2.218
  220    HA   TYR  33           HA       TYR  33  -9.390   2.862  -1.698
  221   1HB   TYR  33          HB2       TYR  33  -9.346   0.544  -0.497
  222   2HB   TYR  33          HB1       TYR  33  -8.050   0.162  -1.631
  223    HD1  TYR  33           HD1      TYR  33  -9.059   2.228   1.227
  224    HD2  TYR  33           HD2      TYR  33  -5.909   1.384  -1.569
  225    HE1  TYR  33           HE1      TYR  33  -7.467   3.494   2.643
  226    HE2  TYR  33           HE2      TYR  33  -4.316   2.652  -0.151
  227    HH   TYR  33           HH       TYR  33  -5.319   4.004   2.981
  228    H    ARG  34           HN       ARG  34  -8.351   4.044  -3.259
  229    HA   ARG  34           HA       ARG  34  -6.819   2.557  -5.371
  230   1HB   ARG  34          HB2       ARG  34  -8.543   5.022  -5.358
  231   2HB   ARG  34          HB1       ARG  34  -7.279   4.854  -6.577
  232   1HG   ARG  34          HG2       ARG  34  -8.237   2.850  -7.441
  233   2HG   ARG  34          HG1       ARG  34  -9.306   2.674  -6.048
  234   1HD   ARG  34          HD2       ARG  34 -10.879   3.741  -7.297
  235   2HD   ARG  34          HD1       ARG  34  -9.915   5.214  -7.067
  236    HE   ARG  34           HE       ARG  34  -8.845   3.528  -9.179
  237   1HH1  ARG  34          HH21      ARG  34 -11.696   5.299  -8.597
  238   2HH1  ARG  34          HH22      ARG  34 -11.637   6.178 -10.088
  239   1HH2  ARG  34          HH11      ARG  34  -8.540   4.918 -11.012
  240   2HH2  ARG  34          HH12      ARG  34  -9.849   5.963 -11.456
  241    H    GLY  35           HN       GLY  35  -4.951   2.639  -3.838
  242   1HA   GLY  35          HA2       GLY  35  -3.308   4.983  -4.316
  243   2HA   GLY  35          HA1       GLY  35  -3.831   4.878  -2.634
  244    H    SER  36           HN       SER  36  -1.495   4.589  -2.163
  245    HA   SER  36           HA       SER  36  -0.616   1.761  -2.654
  246   1HB   SER  36          HB2       SER  36   0.909   4.373  -2.502
  247   2HB   SER  36          HB1       SER  36   1.699   2.798  -2.499
  248    HG   SER  36           HG       SER  36   1.577   3.504  -4.608
  249    H    PHE  37           HN       PHE  37  -2.190   2.203  -0.437
  250    HA   PHE  37           HA       PHE  37  -0.505   2.837   1.896
  251   1HB   PHE  37          HB2       PHE  37  -2.955   3.415   1.569
  252   2HB   PHE  37          HB1       PHE  37  -3.305   1.696   1.757
  253    HD1  PHE  37           HD1      PHE  37  -4.063   1.137   3.878
  254    HD2  PHE  37           HD2      PHE  37  -1.059   4.178   3.469
  255    HE1  PHE  37           HE1      PHE  37  -3.976   1.381   6.344
  256    HE2  PHE  37           HE2      PHE  37  -0.970   4.424   5.935
  257    HZ   PHE  37           HZ       PHE  37  -2.429   3.025   7.373
  258    H    SER  38           HN       SER  38   0.914   0.895   0.949
  259    HA   SER  38           HA       SER  38   0.047  -1.806   1.426
  260   1HB   SER  38          HB2       SER  38   2.373  -2.285   1.011
  261   2HB   SER  38          HB1       SER  38   1.910  -0.947  -0.037
  262    HG   SER  38           HG       SER  38   3.189   0.337   1.051
  263    H    THR  39           HN       THR  39  -0.616  -0.330   3.818
  264    HA   THR  39           HA       THR  39   1.473  -1.177   5.770
  265    HB   THR  39           HB       THR  39  -0.946   0.647   5.837
  266    HG1  THR  39           HG1      THR  39   1.267   1.231   5.057
  267   1HG2  THR  39          HG21      THR  39   0.502  -0.690   8.057
  268   2HG2  THR  39          HG22      THR  39  -1.150  -0.076   7.997
  269   3HG2  THR  39          HG23      THR  39   0.194   1.036   8.256
  270    H    THR  40           HN       THR  40   1.147  -3.131   6.768
  271    HA   THR  40           HA       THR  40  -1.361  -4.576   6.424
  272    HB   THR  40           HB       THR  40  -0.128  -6.335   7.626
  273    HG1  THR  40           HG1      THR  40   1.355  -5.777   8.976
  274   1HG2  THR  40          HG21      THR  40   0.441  -6.208   5.317
  275   2HG2  THR  40          HG22      THR  40   1.984  -6.299   6.168
  276   3HG2  THR  40          HG23      THR  40   1.404  -4.750   5.557
  277    H    VAL  41           HN       VAL  41  -2.663  -5.378   8.232
  278    HA   VAL  41           HA       VAL  41  -3.554  -3.451  10.070
  279    HB   VAL  41           HB       VAL  41  -3.647  -6.449   9.860
  280   1HG1  VAL  41          HG11      VAL  41  -3.695  -6.245  12.224
  281   2HG1  VAL  41          HG12      VAL  41  -5.393  -6.294  11.751
  282   3HG1  VAL  41          HG13      VAL  41  -4.635  -4.755  12.158
  283   1HG2  VAL  41          HG21      VAL  41  -5.015  -4.886   8.415
  284   2HG2  VAL  41          HG22      VAL  41  -5.837  -4.354   9.882
  285   3HG2  VAL  41          HG23      VAL  41  -5.971  -6.032   9.356
  286    H    THR  42           HN       THR  42  -0.836  -5.671  10.334
  287    HA   THR  42           HA       THR  42  -0.498  -5.226  13.223
  288    HB   THR  42           HB       THR  42   1.248  -6.542  11.115
  289    HG1  THR  42           HG1      THR  42  -0.595  -7.634  12.974
  290   1HG2  THR  42          HG21      THR  42   1.580  -6.024  13.973
  291   2HG2  THR  42          HG22      THR  42   2.765  -6.570  12.786
  292   3HG2  THR  42          HG23      THR  42   1.705  -7.738  13.575
  293    H    GLY  43           HN       GLY  43   0.149  -3.388  10.503
  294   1HA   GLY  43          HA2       GLY  43   1.233  -1.236  10.603
  295   2HA   GLY  43          HA1       GLY  43   2.162  -1.797  11.993
  296    H    ARG  44           HN       ARG  44   2.240  -4.293   9.852
  297    HA   ARG  44           HA       ARG  44   5.015  -3.860   9.147
  298   1HB   ARG  44          HB2       ARG  44   3.184  -5.954   9.307
  299   2HB   ARG  44          HB1       ARG  44   3.548  -5.838   7.584
  300   1HG   ARG  44          HG2       ARG  44   5.646  -6.630   7.873
  301   2HG   ARG  44          HG1       ARG  44   5.937  -5.566   9.250
  302   1HD   ARG  44          HD2       ARG  44   5.930  -8.115   9.719
  303   2HD   ARG  44          HD1       ARG  44   4.921  -7.109  10.779
  304    HE   ARG  44           HE       ARG  44   3.762  -8.387   8.337
  305   1HH1  ARG  44          HH11      ARG  44   4.142  -9.046  11.577
  306   2HH1  ARG  44          HH12      ARG  44   2.453  -9.159  11.946
  307   1HH2  ARG  44          HH21      ARG  44   1.424  -7.953   8.864
  308   2HH2  ARG  44          HH22      ARG  44   0.917  -8.540  10.413
  309    H    THR  45           HN       THR  45   4.997  -4.836   6.499
  310    HA   THR  45           HA       THR  45   3.664  -2.649   4.942
  311    HB   THR  45           HB       THR  45   6.570  -3.518   4.960
  312    HG1  THR  45           HG1      THR  45   6.459  -1.930   6.351
  313   1HG2  THR  45          HG21      THR  45   6.704  -2.940   2.794
  314   2HG2  THR  45          HG22      THR  45   6.160  -1.317   3.219
  315   3HG2  THR  45          HG23      THR  45   4.984  -2.552   2.767
  316    H    CYS  46           HN       CYS  46   2.516  -3.596   3.294
  317    HA   CYS  46           HA       CYS  46   2.652  -6.368   2.706
  318   1HB   CYS  46          HB2       CYS  46   1.321  -3.930   1.688
  319   2HB   CYS  46          HB1       CYS  46   1.410  -5.279   0.553
  320    H    GLN  47           HN       GLN  47   3.742  -7.493   1.090
  321    HA   GLN  47           HA       GLN  47   6.014  -6.105  -0.187
  322   1HB   GLN  47          HB2       GLN  47   6.234  -8.255   1.011
  323   2HB   GLN  47          HB1       GLN  47   5.126  -9.004  -0.132
  324   1HG   GLN  47          HG2       GLN  47   7.549  -9.405  -0.669
  325   2HG   GLN  47          HG1       GLN  47   6.657  -8.608  -1.966
  326   1HE2  GLN  47          HE21      GLN  47   9.341  -8.282   0.209
  327   2HE2  GLN  47          HE22      GLN  47   9.765  -6.695  -0.219
  328    H    SER  48           HN       SER  48   6.392  -6.241  -2.503
  329    HA   SER  48           HA       SER  48   4.304  -5.690  -4.277
  330   1HB   SER  48          HB2       SER  48   7.012  -6.984  -4.574
  331   2HB   SER  48          HB1       SER  48   6.003  -6.643  -5.977
  332    HG   SER  48           HG       SER  48   7.609  -4.992  -4.804
  333    H    TRP  49           HN       TRP  49   2.865  -6.995  -5.488
  334    HA   TRP  49           HA       TRP  49   2.276  -9.648  -4.530
  335   1HB   TRP  49          HB2       TRP  49   1.561  -8.202  -7.106
  336   2HB   TRP  49          HB1       TRP  49   0.764  -9.657  -6.515
  337    HD1  TRP  49           HD1      TRP  49   0.980  -5.917  -5.941
  338    HE1  TRP  49           HE1      TRP  49  -0.870  -5.218  -4.311
  339    HE3  TRP  49           HE3      TRP  49  -0.668 -10.467  -4.462
  340    HZ2  TRP  49           HZ2      TRP  49  -2.789  -6.410  -2.593
  341    HZ3  TRP  49           HZ3      TRP  49  -2.515 -10.690  -2.821
  342    HH2  TRP  49           HH2      TRP  49  -3.582  -8.656  -1.881
  343    H    SER  50           HN       SER  50   3.915  -8.381  -7.403
  344    HA   SER  50           HA       SER  50   4.618 -11.006  -8.471
  345   1HB   SER  50          HB2       SER  50   4.148  -8.904  -9.754
  346   2HB   SER  50          HB1       SER  50   5.630  -8.218  -9.094
  347    HG   SER  50           HG       SER  50   6.034  -9.156 -11.112
  348    H    SER  51           HN       SER  51   5.662 -10.032  -5.678
  349    HA   SER  51           HA       SER  51   8.527  -9.707  -5.981
  350   1HB   SER  51          HB2       SER  51   8.478  -9.765  -3.576
  351   2HB   SER  51          HB1       SER  51   6.994  -8.960  -4.081
  352    HG   SER  51           HG       SER  51   7.297 -11.207  -2.662
  353    H    MET  52           HN       MET  52   9.974 -11.336  -6.377
  354    HA   MET  52           HA       MET  52   9.042 -14.144  -5.977
  355   1HB   MET  52          HB2       MET  52  11.386 -13.152  -7.618
  356   2HB   MET  52          HB1       MET  52  10.558 -14.700  -7.752
  357   1HG   MET  52          HG2       MET  52   8.839 -12.311  -8.110
  358   2HG   MET  52          HG1       MET  52  10.028 -12.594  -9.377
  359   1HE   MET  52          HE1       MET  52   6.725 -15.335  -7.904
  360   2HE   MET  52          HE2       MET  52   7.287 -13.807  -7.234
  361   3HE   MET  52          HE3       MET  52   8.271 -15.246  -7.066
  362    H    THR  53           HN       THR  53  10.478 -12.075  -4.082
  363    HA   THR  53           HA       THR  53  12.920 -13.638  -3.439
  364    HB   THR  53           HB       THR  53  12.603 -11.567  -1.597
  365    HG1  THR  53           HG1      THR  53  12.041 -10.397  -4.051
  366   1HG2  THR  53          HG21      THR  53  14.253 -12.263  -3.866
  367   2HG2  THR  53          HG22      THR  53  14.684 -11.355  -2.416
  368   3HG2  THR  53          HG23      THR  53  13.994 -10.519  -3.808
  369    HA   PRO  54           HA       PRO  54  10.614 -14.138   0.672
  370   1HB   PRO  54          HB2       PRO  54   8.228 -12.864   1.066
  371   2HB   PRO  54          HB1       PRO  54   9.792 -12.099   1.410
  372   1HG   PRO  54          HG2       PRO  54   7.988 -11.750  -0.926
  373   2HG   PRO  54          HG1       PRO  54   8.979 -10.555  -0.076
  374   1HD   PRO  54          HD2       PRO  54   9.665 -11.693  -2.470
  375   2HD   PRO  54          HD1       PRO  54  10.834 -11.033  -1.307
  376    H    HIS  55           HN       HIS  55   7.385 -13.483  -0.479
  377    HA   HIS  55           HA       HIS  55   6.860 -16.392  -0.704
  378   1HB   HIS  55          HB2       HIS  55   4.860 -14.174  -1.131
  379   2HB   HIS  55          HB1       HIS  55   4.607 -15.763  -0.410
  380    HD1  HIS  55           HD1      HIS  55   6.125 -12.388   0.347
  381    HD2  HIS  55           HD2      HIS  55   5.100 -15.887   2.365
  382    HE1  HIS  55           HE1      HIS  55   6.461 -11.916   2.799
  383    H    TRP  56           HN       TRP  56   7.043 -17.354  -2.695
  384    HA   TRP  56           HA       TRP  56   6.970 -15.672  -5.144
  385   1HB   TRP  56          HB2       TRP  56   8.735 -17.447  -4.481
  386   2HB   TRP  56          HB1       TRP  56   7.512 -18.636  -4.927
  387    HD1  TRP  56           HD1      TRP  56   6.317 -17.750  -7.492
  388    HE1  TRP  56           HE1      TRP  56   7.638 -17.333  -9.636
  389    HE3  TRP  56           HE3      TRP  56  10.898 -16.944  -5.494
  390    HZ2  TRP  56           HZ2      TRP  56  10.309 -16.716 -10.416
  391    HZ3  TRP  56           HZ3      TRP  56  12.805 -16.406  -6.952
  392    HH2  TRP  56           HH2      TRP  56  12.542 -16.298  -9.410
  393    H    HIS  57           HN       HIS  57   5.402 -15.940  -6.751
  394    HA   HIS  57           HA       HIS  57   3.558 -18.182  -6.786
  395   1HB   HIS  57          HB2       HIS  57   1.669 -17.174  -5.832
  396   2HB   HIS  57          HB1       HIS  57   2.961 -16.542  -4.816
  397    HD1  HIS  57           HD1      HIS  57   3.917 -14.519  -7.206
  398    HD2  HIS  57           HD2      HIS  57   0.138 -14.777  -5.466
  399    HE1  HIS  57           HE1      HIS  57   2.784 -12.292  -7.621
  400    H    GLN  58           HN       GLN  58   1.824 -17.796  -8.501
  401    HA   GLN  58           HA       GLN  58   2.680 -15.738 -10.504
  402   1HB   GLN  58          HB2       GLN  58   2.452 -17.498 -12.224
  403   2HB   GLN  58          HB1       GLN  58   3.631 -17.976 -11.001
  404   1HG   GLN  58          HG2       GLN  58   2.349 -19.700 -10.266
  405   2HG   GLN  58          HG1       GLN  58   0.862 -18.756 -10.366
  406   1HE2  GLN  58          HE21      GLN  58   3.217 -19.506 -12.978
  407   2HE2  GLN  58          HE22      GLN  58   2.093 -20.304 -13.968
  408    H    ARG  59           HN       ARG  59   0.371 -15.998  -8.545
  409    HA   ARG  59           HA       ARG  59  -1.837 -15.749 -10.560
  410   1HB   ARG  59          HB2       ARG  59  -3.237 -16.797  -8.658
  411   2HB   ARG  59          HB1       ARG  59  -2.134 -17.872  -9.518
  412   1HG   ARG  59          HG2       ARG  59  -0.482 -17.695  -7.763
  413   2HG   ARG  59          HG1       ARG  59  -1.416 -16.441  -6.946
  414   1HD   ARG  59          HD2       ARG  59  -3.194 -18.614  -7.274
  415   2HD   ARG  59          HD1       ARG  59  -1.665 -19.309  -6.698
  416    HE   ARG  59           HE       ARG  59  -1.736 -17.718  -4.808
  417   1HH1  ARG  59          HH11      ARG  59  -4.471 -19.283  -5.267
  418   2HH1  ARG  59          HH12      ARG  59  -5.571 -18.044  -4.763
  419   1HH2  ARG  59          HH21      ARG  59  -3.178 -15.534  -4.812
  420   2HH2  ARG  59          HH22      ARG  59  -4.838 -15.919  -4.505
  421    H    THR  60           HN       THR  60  -0.560 -13.466  -9.793
  422    HA   THR  60           HA       THR  60  -1.734 -12.309  -7.357
  423    HB   THR  60           HB       THR  60   0.499 -11.681  -8.101
  424    HG1  THR  60           HG1      THR  60   0.118  -9.394  -8.362
  425   1HG2  THR  60          HG21      THR  60  -0.947 -11.162 -10.671
  426   2HG2  THR  60          HG22      THR  60   0.569 -12.023 -10.408
  427   3HG2  THR  60          HG23      THR  60   0.525 -10.263 -10.305
  428    H    THR  61           HN       THR  61  -2.760 -10.106  -7.616
  429    HA   THR  61           HA       THR  61  -5.063 -10.305  -9.426
  430    HB   THR  61           HB       THR  61  -5.199  -7.869  -8.196
  431    HG1  THR  61           HG1      THR  61  -4.138  -9.329  -6.124
  432   1HG2  THR  61          HG21      THR  61  -6.234  -9.371  -6.253
  433   2HG2  THR  61          HG22      THR  61  -5.997 -10.646  -7.449
  434   3HG2  THR  61          HG23      THR  61  -7.008  -9.252  -7.834
  435    H    GLU  62           HN       GLU  62  -1.874  -9.060  -9.523
  436    HA   GLU  62           HA       GLU  62  -2.209  -6.702 -11.071
  437   1HB   GLU  62          HB2       GLU  62  -0.131  -7.661  -9.911
  438   2HB   GLU  62          HB1       GLU  62   0.017  -8.746 -11.294
  439   1HG   GLU  62          HG2       GLU  62  -0.411  -6.037 -12.204
  440   2HG   GLU  62          HG1       GLU  62   0.967  -6.095 -11.105
  441    H    TYR  63           HN       TYR  63  -2.457 -10.082 -11.740
  442    HA   TYR  63           HA       TYR  63  -2.440  -9.707 -14.653
  443   1HB   TYR  63          HB2       TYR  63  -2.270 -11.880 -12.676
  444   2HB   TYR  63          HB1       TYR  63  -3.219 -12.297 -14.102
  445    HD1  TYR  63           HD1      TYR  63   0.110 -11.401 -12.838
  446    HD2  TYR  63           HD2      TYR  63  -2.210 -12.289 -16.342
  447    HE1  TYR  63           HE1      TYR  63   2.197 -11.708 -14.143
  448    HE2  TYR  63           HE2      TYR  63  -0.124 -12.596 -17.646
  449    HH   TYR  63           HH       TYR  63   2.274 -11.797 -17.492
  450    H    TYR  64           HN       TYR  64  -4.620  -9.178 -12.202
  451    HA   TYR  64           HA       TYR  64  -6.978 -10.041 -13.840
  452   1HB   TYR  64          HB2       TYR  64  -6.356  -9.700 -10.927
  453   2HB   TYR  64          HB1       TYR  64  -8.024  -9.474 -11.454
  454    HD1  TYR  64           HD1      TYR  64  -9.375 -11.359 -11.324
  455    HD2  TYR  64           HD2      TYR  64  -5.195 -11.840 -12.193
  456    HE1  TYR  64           HE1      TYR  64  -9.677 -13.819 -11.420
  457    HE2  TYR  64           HE2      TYR  64  -5.498 -14.299 -12.289
  458    HH   TYR  64           HH       TYR  64  -8.711 -15.775 -11.805
  459    HA   PRO  65           HA       PRO  65  -7.518  -5.729 -14.592
  460   1HB   PRO  65          HB2       PRO  65 -10.043  -5.856 -15.651
  461   2HB   PRO  65          HB1       PRO  65  -8.592  -6.342 -16.551
  462   1HG   PRO  65          HG2       PRO  65 -10.606  -8.028 -15.155
  463   2HG   PRO  65          HG1       PRO  65  -9.749  -8.317 -16.677
  464   1HD   PRO  65          HD2       PRO  65  -9.074  -9.494 -14.301
  465   2HD   PRO  65          HD1       PRO  65  -7.927  -9.213 -15.629
  466    H    ASN  66           HN       ASN  66  -9.184  -7.608 -12.332
  467    HA   ASN  66           HA       ASN  66 -10.915  -5.368 -11.401
  468   1HB   ASN  66          HB2       ASN  66 -11.684  -7.784 -11.717
  469   2HB   ASN  66          HB1       ASN  66 -10.670  -8.192 -10.333
  470   1HD2  ASN  66          HD21      ASN  66 -12.719  -5.281 -10.873
  471   2HD2  ASN  66          HD22      ASN  66 -13.674  -5.513  -9.489
  472    H    GLY  67           HN       GLY  67  -7.869  -6.824 -10.771
  473   1HA   GLY  67          HA2       GLY  67  -7.691  -5.295  -8.218
  474   2HA   GLY  67          HA1       GLY  67  -7.080  -6.949  -8.306
  475    H    GLY  68           HN       GLY  68  -6.605  -3.669  -9.537
  476   1HA   GLY  68          HA2       GLY  68  -4.110  -4.415 -10.886
  477   2HA   GLY  68          HA1       GLY  68  -4.772  -2.780 -10.751
  478    H    LEU  69           HN       LEU  69  -3.859  -5.289  -8.407
  479    HA   LEU  69           HA       LEU  69  -2.927  -3.380  -6.455
  480   1HB   LEU  69          HB2       LEU  69  -2.074  -6.266  -6.577
  481   2HB   LEU  69          HB1       LEU  69  -2.504  -5.296  -5.172
  482    HG   LEU  69           HG       LEU  69  -4.317  -6.593  -7.185
  483   1HD1  LEU  69          HD11      LEU  69  -5.414  -7.422  -5.192
  484   2HD1  LEU  69          HD12      LEU  69  -4.470  -6.341  -4.166
  485   3HD1  LEU  69          HD13      LEU  69  -3.681  -7.682  -4.996
  486   1HD2  LEU  69          HD21      LEU  69  -5.544  -4.687  -7.245
  487   2HD2  LEU  69          HD22      LEU  69  -4.649  -3.970  -5.909
  488   3HD2  LEU  69          HD23      LEU  69  -5.982  -5.077  -5.584
  489    H    THR  70           HN       THR  70  -1.700  -2.425  -8.483
  490    HA   THR  70           HA       THR  70   0.708  -3.427  -9.510
  491    HB   THR  70           HB       THR  70  -0.195  -0.647  -8.722
  492    HG1  THR  70           HG1      THR  70   0.030  -2.008 -11.200
  493   1HG2  THR  70          HG21      THR  70   1.925   0.045  -9.034
  494   2HG2  THR  70          HG22      THR  70   1.742  -0.423 -10.725
  495   3HG2  THR  70          HG23      THR  70   2.433  -1.558  -9.565
  496    H    ARG  71           HN       ARG  71   2.913  -3.242  -8.835
  497    HA   ARG  71           HA       ARG  71   4.606  -3.508  -7.191
  498   1HB   ARG  71          HB2       ARG  71   3.110  -0.971  -6.478
  499   2HB   ARG  71          HB1       ARG  71   4.658  -1.407  -5.753
  500   1HG   ARG  71          HG2       ARG  71   5.018  -1.766  -8.514
  501   2HG   ARG  71          HG1       ARG  71   4.128  -0.250  -8.357
  502   1HD   ARG  71          HD2       ARG  71   6.211   0.636  -7.981
  503   2HD   ARG  71          HD1       ARG  71   5.974   0.003  -6.340
  504    HE   ARG  71           HE       ARG  71   7.810  -1.082  -8.289
  505   1HH1  ARG  71          HH11      ARG  71   7.544  -1.365  -5.171
  506   2HH1  ARG  71          HH12      ARG  71   7.434  -3.089  -5.049
  507   1HH2  ARG  71          HH21      ARG  71   6.810  -3.552  -8.428
  508   2HH2  ARG  71          HH22      ARG  71   7.020  -4.328  -6.894
  509    H    ASN  72           HN       ASN  72   4.548  -2.730  -4.456
  510    HA   ASN  72           HA       ASN  72   3.032  -4.961  -3.298
  511   1HB   ASN  72          HB2       ASN  72   4.327  -4.405  -1.350
  512   2HB   ASN  72          HB1       ASN  72   5.388  -4.180  -2.740
  513   1HD2  ASN  72          HD21      ASN  72   3.095  -2.300  -0.709
  514   2HD2  ASN  72          HD22      ASN  72   3.964  -0.846  -0.788
  515    H    TYR  73           HN       TYR  73   1.536  -2.543  -4.426
  516    HA   TYR  73           HA       TYR  73   0.519  -0.934  -2.280
  517   1HB   TYR  73          HB2       TYR  73  -0.775  -1.856  -4.875
  518   2HB   TYR  73          HB1       TYR  73  -1.280  -0.467  -3.917
  519    HD1  TYR  73           HD1      TYR  73   1.991  -0.210  -3.300
  520    HD2  TYR  73           HD2      TYR  73  -0.617  -0.026  -6.708
  521    HE1  TYR  73           HE1      TYR  73   3.640   1.211  -4.487
  522    HE2  TYR  73           HE2      TYR  73   1.032   1.395  -7.894
  523    HH   TYR  73           HH       TYR  73   4.126   1.645  -7.132
  524    H    CYS  74           HN       CYS  74  -1.180  -1.280  -0.871
  525    HA   CYS  74           HA       CYS  74  -2.117  -4.045  -0.504
  526   1HB   CYS  74          HB2       CYS  74  -1.501  -2.834   1.462
  527   2HB   CYS  74          HB1       CYS  74  -2.409  -1.409   0.957
  528    H    ARG  75           HN       ARG  75  -4.132  -4.763  -1.130
  529    HA   ARG  75           HA       ARG  75  -6.206  -2.746  -1.866
  530   1HB   ARG  75          HB2       ARG  75  -4.583  -4.432  -3.598
  531   2HB   ARG  75          HB1       ARG  75  -6.303  -4.752  -3.819
  532   1HG   ARG  75          HG2       ARG  75  -6.167  -2.958  -5.234
  533   2HG   ARG  75          HG1       ARG  75  -6.338  -2.041  -3.737
  534   1HD   ARG  75          HD2       ARG  75  -4.127  -1.385  -3.731
  535   2HD   ARG  75          HD1       ARG  75  -3.577  -2.886  -4.502
  536    HE   ARG  75           HE       ARG  75  -4.050  -1.925  -6.623
  537   1HH1  ARG  75          HH21      ARG  75  -3.300   0.716  -5.552
  538   2HH1  ARG  75          HH22      ARG  75  -4.700   1.681  -5.881
  539   1HH2  ARG  75          HH11      ARG  75  -6.781  -1.043  -6.405
  540   2HH2  ARG  75          HH12      ARG  75  -6.672   0.685  -6.363
  541    H    ASN  76           HN       ASN  76  -8.280  -4.150  -2.560
  542    HA   ASN  76           HA       ASN  76  -8.538  -6.439  -0.636
  543   1HB   ASN  76          HB2       ASN  76  -9.552  -4.387   0.248
  544   2HB   ASN  76          HB1       ASN  76 -10.457  -4.171  -1.248
  545   1HD2  ASN  76          HD21      ASN  76 -12.177  -4.288   0.755
  546   2HD2  ASN  76          HD22      ASN  76 -12.866  -5.825   0.966
  547    HA   PRO  77           HA       PRO  77  -9.930  -7.655  -4.875
  548   1HB   PRO  77          HB2       PRO  77  -8.519  -9.994  -4.972
  549   2HB   PRO  77          HB1       PRO  77  -7.835  -8.433  -5.465
  550   1HG   PRO  77          HG2       PRO  77  -7.432  -9.969  -2.958
  551   2HG   PRO  77          HG1       PRO  77  -6.294  -8.960  -3.862
  552   1HD   PRO  77          HD2       PRO  77  -7.597  -8.176  -1.564
  553   2HD   PRO  77          HD1       PRO  77  -6.926  -7.064  -2.776
  554    H    ASP  78           HN       ASP  78 -10.473  -8.577  -1.753
  555    HA   ASP  78           HA       ASP  78 -12.149 -10.937  -2.550
  556   1HB   ASP  78          HB2       ASP  78 -10.094 -10.848  -0.782
  557   2HB   ASP  78          HB1       ASP  78 -11.430 -10.430   0.290
  558    H    ALA  79           HN       ALA  79 -12.340  -7.701  -1.760
  559    HA   ALA  79           HA       ALA  79 -14.122  -6.331  -1.024
  560   1HB   ALA  79          HB1       ALA  79 -16.091  -8.513  -1.225
  561   2HB   ALA  79          HB2       ALA  79 -15.069  -8.348  -2.654
  562   3HB   ALA  79          HB3       ALA  79 -16.028  -6.978  -2.092
  563    H    GLU  80           HN       GLU  80 -12.712  -8.337   0.864
  564    HA   GLU  80           HA       GLU  80 -14.696  -9.122   2.840
  565   1HB   GLU  80          HB2       GLU  80 -12.186  -9.866   2.205
  566   2HB   GLU  80          HB1       GLU  80 -11.817  -8.747   3.518
  567   1HG   GLU  80          HG2       GLU  80 -12.242 -10.488   4.900
  568   2HG   GLU  80          HG1       GLU  80 -13.942 -10.194   4.535
  569    H    ILE  81           HN       ILE  81 -13.591  -8.291   5.250
  570    HA   ILE  81           HA       ILE  81 -14.785  -5.850   5.848
  571    HB   ILE  81           HB       ILE  81 -13.129  -5.817   7.752
  572   1HG1  ILE  81          HG12      ILE  81 -11.772  -8.155   7.595
  573   2HG1  ILE  81          HG11      ILE  81 -11.786  -7.698   5.891
  574   1HG2  ILE  81          HG21      ILE  81 -14.288  -8.527   7.061
  575   2HG2  ILE  81          HG22      ILE  81 -15.159  -7.209   7.846
  576   3HG2  ILE  81          HG23      ILE  81 -13.810  -7.990   8.671
  577   1HD1  ILE  81          HD11      ILE  81 -10.234  -6.114   6.254
  578   2HD1  ILE  81          HD12      ILE  81 -10.100  -6.687   7.917
  579   3HD1  ILE  81          HD13      ILE  81 -11.224  -5.387   7.520
  580    H    SER  82           HN       SER  82 -11.498  -6.401   4.610
  581    HA   SER  82           HA       SER  82 -11.376  -3.669   3.552
  582   1HB   SER  82          HB2       SER  82 -10.045  -2.755   5.174
  583   2HB   SER  82          HB1       SER  82 -10.717  -4.029   6.187
  584    HG   SER  82           HG       SER  82  -8.397  -3.953   6.172
  585    HA   PRO  83           HA       PRO  83  -8.257  -5.430   1.004
  586   1HB   PRO  83          HB2       PRO  83  -6.178  -3.659   1.014
  587   2HB   PRO  83          HB1       PRO  83  -7.729  -3.321   0.222
  588   1HG   PRO  83          HG2       PRO  83  -6.677  -2.346   2.814
  589   2HG   PRO  83          HG1       PRO  83  -7.712  -1.529   1.634
  590   1HD   PRO  83          HD2       PRO  83  -8.600  -2.676   3.987
  591   2HD   PRO  83          HD1       PRO  83  -9.619  -2.339   2.573
  592    H    TRP  84           HN       TRP  84  -6.122  -6.445   0.898
  593    HA   TRP  84           HA       TRP  84  -4.468  -6.612   3.331
  594   1HB   TRP  84          HB2       TRP  84  -4.939  -9.043   3.589
  595   2HB   TRP  84          HB1       TRP  84  -6.403  -8.081   3.798
  596    HD1  TRP  84           HD1      TRP  84  -8.246  -8.191   1.909
  597    HE1  TRP  84           HE1      TRP  84  -8.650  -9.842  -0.030
  598    HE3  TRP  84           HE3      TRP  84  -3.741 -10.591   1.845
  599    HZ2  TRP  84           HZ2      TRP  84  -7.244 -11.911  -1.424
  600    HZ3  TRP  84           HZ3      TRP  84  -3.299 -12.395   0.206
  601    HH2  TRP  84           HH2      TRP  84  -5.043 -13.058  -1.428
  602    H    CYS  85           HN       CYS  85  -2.566  -8.164   2.882
  603    HA   CYS  85           HA       CYS  85  -2.132  -9.198   0.224
  604   1HB   CYS  85          HB2       CYS  85  -0.264  -7.303  -0.146
  605   2HB   CYS  85          HB1       CYS  85  -1.918  -7.105  -0.709
  606    H    TYR  86           HN       TYR  86   0.256  -9.721  -0.129
  607    HA   TYR  86           HA       TYR  86   1.333 -11.077   2.170
  608   1HB   TYR  86          HB2       TYR  86   2.910 -10.271  -0.278
  609   2HB   TYR  86          HB1       TYR  86   3.018 -11.763   0.651
  610    HD1  TYR  86           HD1      TYR  86  -0.104 -12.053   0.860
  611    HD2  TYR  86           HD2      TYR  86   2.604 -11.424  -2.416
  612    HE1  TYR  86           HE1      TYR  86  -1.720 -13.129  -0.682
  613    HE2  TYR  86           HE2      TYR  86   0.988 -12.500  -3.956
  614    HH   TYR  86           HH       TYR  86  -1.680 -14.291  -2.866
  615    H    THR  87           HN       THR  87   3.328 -10.548   3.331
  616    HA   THR  87           HA       THR  87   3.850  -7.602   3.434
  617    HB   THR  87           HB       THR  87   4.338  -7.921   5.683
  618    HG1  THR  87           HG1      THR  87   5.731  -9.379   6.171
  619   1HG2  THR  87          HG21      THR  87   2.081  -9.241   4.794
  620   2HG2  THR  87          HG22      THR  87   2.468  -8.896   6.478
  621   3HG2  THR  87          HG23      THR  87   2.887 -10.461   5.781
  622    H    MET  88           HN       MET  88   6.035  -6.847   3.453
  623    HA   MET  88           HA       MET  88   7.887  -8.076   1.681
  624   1HB   MET  88          HB2       MET  88   9.396  -6.353   2.533
  625   2HB   MET  88          HB1       MET  88   7.770  -5.683   2.397
  626   1HG   MET  88          HG2       MET  88   8.198  -5.003   4.543
  627   2HG   MET  88          HG1       MET  88   7.642  -6.633   4.919
  628   1HE   MET  88          HE1       MET  88  11.415  -4.784   6.129
  629   2HE   MET  88          HE2       MET  88   9.724  -4.580   6.580
  630   3HE   MET  88          HE3       MET  88  10.271  -4.068   4.986
  631    H    ASP  89           HN       ASP  89   7.108  -9.008   4.894
  632    HA   ASP  89           HA       ASP  89   9.787 -10.206   5.358
  633   1HB   ASP  89          HB2       ASP  89   7.847  -8.930   6.936
  634   2HB   ASP  89          HB1       ASP  89   7.740 -10.633   7.384
  635    HA   PRO  90           HA       PRO  90   8.093 -14.020   3.837
  636   1HB   PRO  90          HB2       PRO  90  10.194 -15.612   4.602
  637   2HB   PRO  90          HB1       PRO  90  10.248 -14.559   3.174
  638   1HG   PRO  90          HG2       PRO  90  11.358 -14.100   5.904
  639   2HG   PRO  90          HG1       PRO  90  12.069 -13.736   4.323
  640   1HD   PRO  90          HD2       PRO  90  10.899 -11.838   5.864
  641   2HD   PRO  90          HD1       PRO  90  10.874 -11.776   4.087
  642    H    ASN  91           HN       ASN  91   8.844 -13.176   7.068
  643    HA   ASN  91           HA       ASN  91   7.977 -15.698   8.294
  644   1HB   ASN  91          HB2       ASN  91   8.558 -12.899   9.315
  645   2HB   ASN  91          HB1       ASN  91   8.177 -14.263  10.366
  646   1HD2  ASN  91          HD21      ASN  91  10.789 -12.608   9.694
  647   2HD2  ASN  91          HD22      ASN  91  11.952 -13.829   9.502
  648    H    VAL  92           HN       VAL  92   6.458 -12.956   6.926
  649    HA   VAL  92           HA       VAL  92   3.926 -13.569   8.411
  650    HB   VAL  92           HB       VAL  92   4.910 -10.989   7.138
  651   1HG1  VAL  92          HG11      VAL  92   2.926  -9.981   7.921
  652   2HG1  VAL  92          HG12      VAL  92   2.585 -11.303   9.035
  653   3HG1  VAL  92          HG13      VAL  92   2.364 -11.532   7.300
  654   1HG2  VAL  92          HG21      VAL  92   4.626 -10.505   9.813
  655   2HG2  VAL  92          HG22      VAL  92   6.155 -10.946   9.053
  656   3HG2  VAL  92          HG23      VAL  92   5.171 -12.181   9.837
  657    H    ARG  93           HN       ARG  93   3.335 -15.171   6.799
  658    HA   ARG  93           HA       ARG  93   3.379 -15.168   4.070
  659   1HB   ARG  93          HB2       ARG  93   1.055 -15.756   5.929
  660   2HB   ARG  93          HB1       ARG  93   1.119 -16.281   4.246
  661   1HG   ARG  93          HG2       ARG  93   3.214 -16.972   6.325
  662   2HG   ARG  93          HG1       ARG  93   1.891 -18.040   5.855
  663   1HD   ARG  93          HD2       ARG  93   2.993 -17.283   3.412
  664   2HD   ARG  93          HD1       ARG  93   4.407 -17.510   4.462
  665    HE   ARG  93           HE       ARG  93   3.222 -19.728   5.125
  666   1HH1  ARG  93          HH11      ARG  93   4.810 -20.027   2.657
  667   2HH1  ARG  93          HH12      ARG  93   3.657 -20.658   1.528
  668   1HH2  ARG  93          HH21      ARG  93   0.902 -19.734   3.424
  669   2HH2  ARG  93          HH22      ARG  93   1.442 -20.491   1.962
  670    H    TRP  94           HN       TRP  94   0.473 -13.867   5.684
  671    HA   TRP  94           HA       TRP  94   0.531 -11.484   3.916
  672   1HB   TRP  94          HB2       TRP  94  -1.586 -12.015   2.914
  673   2HB   TRP  94          HB1       TRP  94  -0.604 -13.473   2.780
  674    HD1  TRP  94           HD1      TRP  94  -1.062 -15.403   4.681
  675    HE1  TRP  94           HE1      TRP  94  -3.264 -16.047   5.857
  676    HE3  TRP  94           HE3      TRP  94  -3.807 -11.194   3.776
  677    HZ2  TRP  94           HZ2      TRP  94  -5.849 -14.925   6.348
  678    HZ3  TRP  94           HZ3      TRP  94  -6.134 -11.008   4.607
  679    HH2  TRP  94           HH2      TRP  94  -7.156 -12.868   5.889
  680    H    GLU  95           HN       GLU  95  -1.526 -10.095   4.514
  681    HA   GLU  95           HA       GLU  95  -2.797 -10.510   7.071
  682   1HB   GLU  95          HB2       GLU  95  -0.122  -9.868   7.226
  683   2HB   GLU  95          HB1       GLU  95  -0.887  -8.285   7.371
  684   1HG   GLU  95          HG2       GLU  95  -1.059  -8.860   9.573
  685   2HG   GLU  95          HG1       GLU  95  -2.480  -9.748   9.019
  686    H    TYR  96           HN       TYR  96  -4.411  -8.947   7.381
  687    HA   TYR  96           HA       TYR  96  -5.243  -7.328   5.190
  688   1HB   TYR  96          HB2       TYR  96  -5.838  -7.462   8.149
  689   2HB   TYR  96          HB1       TYR  96  -6.625  -6.255   7.131
  690    HD1  TYR  96           HD1      TYR  96  -8.271  -6.883   5.468
  691    HD2  TYR  96           HD2      TYR  96  -6.220  -9.872   7.774
  692    HE1  TYR  96           HE1      TYR  96  -9.895  -8.592   4.698
  693    HE2  TYR  96           HE2      TYR  96  -7.845 -11.579   7.005
  694    HH   TYR  96           HH       TYR  96  -9.926 -11.835   6.039
  695    H    CYS  97           HN       CYS  97  -5.614  -4.810   5.658
  696    HA   CYS  97           HA       CYS  97  -2.943  -3.698   6.438
  697   1HB   CYS  97          HB2       CYS  97  -5.120  -2.789   4.539
  698   2HB   CYS  97          HB1       CYS  97  -3.696  -1.820   4.915
  699    H    ASN  98           HN       ASN  98  -3.014  -1.505   7.454
  700    HA   ASN  98           HA       ASN  98  -4.816  -1.363   9.696
  701   1HB   ASN  98          HB2       ASN  98  -2.904   0.545   8.326
  702   2HB   ASN  98          HB1       ASN  98  -3.802   1.014   9.770
  703   1HD2  ASN  98          HD21      ASN  98  -1.072   0.972  10.080
  704   2HD2  ASN  98          HD22      ASN  98  -0.581  -0.388  10.969
  705    H    LEU  99           HN       LEU  99  -6.768  -1.661   8.039
  706    HA   LEU  99           HA       LEU  99  -7.612   0.976   6.940
  707   1HB   LEU  99          HB2       LEU  99  -8.233  -1.920   6.429
  708   2HB   LEU  99          HB1       LEU  99  -9.302  -0.663   5.820
  709    HG   LEU  99           HG       LEU  99  -7.227  -1.577   4.398
  710   1HD1  LEU  99          HD11      LEU  99  -7.404   0.405   3.073
  711   2HD1  LEU  99          HD12      LEU  99  -7.871   1.373   4.472
  712   3HD1  LEU  99          HD13      LEU  99  -8.982   0.166   3.823
  713   1HD2  LEU  99          HD21      LEU  99  -5.309  -0.061   4.572
  714   2HD2  LEU  99          HD22      LEU  99  -5.552  -0.909   6.095
  715   3HD2  LEU  99          HD23      LEU  99  -6.067   0.768   5.931
  716    H    THR 100           HN       THR 100  -9.452   1.955   7.606
  717    HA   THR 100           HA       THR 100 -11.384   0.635   9.416
  718    HB   THR 100           HB       THR 100 -11.042   2.825  10.839
  719    HG1  THR 100           HG1      THR 100  -9.131   3.762  10.612
  720   1HG2  THR 100          HG21      THR 100 -10.295   0.215  11.144
  721   2HG2  THR 100          HG22      THR 100 -10.063   1.462  12.369
  722   3HG2  THR 100          HG23      THR 100  -8.742   1.039  11.282
  723    H    GLN 101           HN       GLN 101 -13.370   1.987   9.577
  724    HA   GLN 101           HA       GLN 101 -14.099   3.272   7.124
  725   1HB   GLN 101          HB2       GLN 101 -15.204   2.770   9.813
  726   2HB   GLN 101          HB1       GLN 101 -15.871   4.194   9.014
  727   1HG   GLN 101          HG2       GLN 101 -16.175   2.698   6.948
  728   2HG   GLN 101          HG1       GLN 101 -15.870   1.337   8.029
  729   1HE2  GLN 101          HE21      GLN 101 -18.261   0.879   7.322
  730   2HE2  GLN 101          HE22      GLN 101 -19.477   1.573   8.282
  731    H    CYS 102           HN       CYS 102 -13.133   5.173   6.450
  732    HA   CYS 102           HA       CYS 102 -11.710   7.039   7.957
  733   1HB   CYS 102          HB2       CYS 102 -13.529   7.550   5.582
  734   2HB   CYS 102          HB1       CYS 102 -12.191   8.580   6.087
  735    HA   PRO 103           HA       PRO 103 -14.913   8.924  10.374
  736   1HB   PRO 103          HB2       PRO 103 -13.367  10.867  11.514
  737   2HB   PRO 103          HB1       PRO 103 -13.305   9.167  12.018
  738   1HG   PRO 103          HG2       PRO 103 -11.414  10.712  10.347
  739   2HG   PRO 103          HG1       PRO 103 -11.108   9.371  11.459
  740   1HD   PRO 103          HD2       PRO 103 -11.218   9.182   8.687
  741   2HD   PRO 103          HD1       PRO 103 -11.351   7.823   9.824
  742    H    VAL 104           HN       VAL 104 -15.347  11.519  10.849
  743    HA   VAL 104           HA       VAL 104 -15.127  12.949   8.223
  744    HB   VAL 104           HB       VAL 104 -17.546  12.561  10.016
  745   1HG1  VAL 104          HG11      VAL 104 -18.212  14.563   9.198
  746   2HG1  VAL 104          HG12      VAL 104 -18.368  13.749   7.641
  747   3HG1  VAL 104          HG13      VAL 104 -16.884  14.614   8.039
  748   1HG2  VAL 104          HG21      VAL 104 -18.146  11.841   7.394
  749   2HG2  VAL 104          HG22      VAL 104 -17.795  10.726   8.714
  750   3HG2  VAL 104          HG23      VAL 104 -16.506  11.236   7.624
  751    H    THR 105           HN       THR 105 -14.372  13.017  11.436
  752    HA   THR 105           HA       THR 105 -15.049  15.828  12.004
  753    HB   THR 105           HB       THR 105 -14.980  13.881  13.650
  754    HG1  THR 105           HG1      THR 105 -14.528  15.286  15.173
  755   1HG2  THR 105          HG21      THR 105 -12.433  13.551  12.535
  756   2HG2  THR 105          HG22      THR 105 -13.083  12.705  13.939
  757   3HG2  THR 105          HG23      THR 105 -12.136  14.177  14.157
  758    H    GLU 106           HN       GLU 106 -13.476  15.641   9.663
  759    HA   GLU 106           HA       GLU 106 -11.387  17.480  10.157
  760   1HB   GLU 106          HB2       GLU 106  -9.469  15.814   9.787
  761   2HB   GLU 106          HB1       GLU 106 -10.265  15.737  11.358
  762   1HG   GLU 106          HG2       GLU 106 -11.703  13.892  10.516
  763   2HG   GLU 106          HG1       GLU 106 -10.835  13.943   8.980
  764    H    SER 107           HN       SER 107 -13.293  17.377   8.187
  765    HA   SER 107           HA       SER 107 -11.647  16.905   5.737
  766   1HB   SER 107          HB2       SER 107 -13.260  15.010   6.329
  767   2HB   SER 107          HB1       SER 107 -14.567  16.150   6.024
  768    HG   SER 107           HG       SER 107 -14.300  15.449   4.045
  769    H    SER 108           HN       SER 108 -11.648  19.405   6.359
  770    HA   SER 108           HA       SER 108 -14.020  20.681   5.033
  771   1HB   SER 108          HB2       SER 108 -12.886  20.999   7.613
  772   2HB   SER 108          HB1       SER 108 -12.489  22.460   6.712
  773    HG   SER 108           HG       SER 108 -14.733  22.573   6.151
  774    H    VAL 109           HN       VAL 109 -11.505  19.702   3.763
  775    HA   VAL 109           HA       VAL 109  -9.631  21.776   3.251
  776    HB   VAL 109           HB       VAL 109 -10.680  19.496   1.544
  777   1HG1  VAL 109          HG11      VAL 109  -8.022  20.907   1.249
  778   2HG1  VAL 109          HG12      VAL 109  -9.445  21.390   0.325
  779   3HG1  VAL 109          HG13      VAL 109  -8.780  19.768   0.136
  780   1HG2  VAL 109          HG21      VAL 109  -8.809  19.740   3.804
  781   2HG2  VAL 109          HG22      VAL 109  -8.139  18.876   2.420
  782   3HG2  VAL 109          HG23      VAL 109  -9.630  18.312   3.175
  783    H    LEU 110           HN       LEU 110  -9.564  23.381   1.600
  784    HA   LEU 110           HA       LEU 110 -12.182  23.907   0.228
  785   1HB   LEU 110          HB2       LEU 110 -11.511  25.420   2.142
  786   2HB   LEU 110          HB1       LEU 110 -10.115  25.911   1.181
  787    HG   LEU 110           HG       LEU 110 -11.734  26.544  -0.662
  788   1HD1  LEU 110          HD11      LEU 110 -13.544  25.204   1.019
  789   2HD1  LEU 110          HD12      LEU 110 -13.937  26.124  -0.433
  790   3HD1  LEU 110          HD13      LEU 110 -13.976  26.910   1.145
  791   1HD2  LEU 110          HD21      LEU 110 -11.627  28.655   0.154
  792   2HD2  LEU 110          HD22      LEU 110 -10.901  27.945   1.597
  793   3HD2  LEU 110          HD23      LEU 110 -12.638  28.247   1.540
  794    H    ALA 111           HN       ALA 111 -11.341  22.724  -1.662
  795    HA   ALA 111           HA       ALA 111  -8.895  23.651  -2.980
  796   1HB   ALA 111          HB1       ALA 111 -10.065  21.316  -2.944
  797   2HB   ALA 111          HB2       ALA 111  -9.350  21.870  -4.458
  798   3HB   ALA 111          HB3       ALA 111 -11.092  21.990  -4.209
  799    H    THR 112           HN       THR 112  -9.396  24.004  -5.563
  800    HA   THR 112           HA       THR 112 -11.658  25.923  -5.870
  801    HB   THR 112           HB       THR 112 -10.038  27.578  -6.793
  802    HG1  THR 112           HG1      THR 112  -7.926  26.156  -5.688
  803   1HG2  THR 112          HG21      THR 112 -10.602  27.092  -4.190
  804   2HG2  THR 112          HG22      THR 112  -9.577  28.424  -4.722
  805   3HG2  THR 112          HG23      THR 112  -8.847  26.921  -4.158
  806    H    SER 113           HN       SER 113 -10.953  26.863  -8.405
  807    HA   SER 113           HA       SER 113 -11.526  24.511 -10.062
  808   1HB   SER 113          HB2       SER 113 -11.750  26.233 -11.808
  809   2HB   SER 113          HB1       SER 113 -12.588  26.740 -10.344
  810    HG   SER 113           HG       SER 113 -10.028  27.540 -11.275
  811    H    THR 114           HN       THR 114 -10.099  23.550 -11.531
  812    HA   THR 114           HA       THR 114  -7.316  23.550 -11.079
  813    HB   THR 114           HB       THR 114  -8.641  21.850 -12.312
  814    HG1  THR 114           HG1      THR 114  -6.455  23.089 -13.592
  815   1HG2  THR 114          HG21      THR 114  -9.975  23.662 -13.549
  816   2HG2  THR 114          HG22      THR 114  -9.504  22.246 -14.488
  817   3HG2  THR 114          HG23      THR 114  -8.605  23.754 -14.654
  818    H    ALA 115           HN       ALA 115  -5.796  25.098 -11.502
  819    HA   ALA 115           HA       ALA 115  -6.233  26.936 -13.826
  820   1HB   ALA 115          HB1       ALA 115  -5.984  28.804 -12.465
  821   2HB   ALA 115          HB2       ALA 115  -5.016  27.932 -11.276
  822   3HB   ALA 115          HB3       ALA 115  -6.764  27.704 -11.328
  823    H    VAL 116           HN       VAL 116  -3.749  28.368 -12.759
  824    HA   VAL 116           HA       VAL 116  -1.736  26.324 -13.644
  825    HB   VAL 116           HB       VAL 116  -1.899  29.319 -14.120
  826   1HG1  VAL 116          HG11      VAL 116   0.391  28.990 -14.122
  827   2HG1  VAL 116          HG12      VAL 116   0.029  28.530 -15.785
  828   3HG1  VAL 116          HG13      VAL 116   0.251  27.286 -14.555
  829   1HG2  VAL 116          HG21      VAL 116  -3.129  28.724 -15.914
  830   2HG2  VAL 116          HG22      VAL 116  -2.943  27.017 -15.515
  831   3HG2  VAL 116          HG23      VAL 116  -1.739  27.824 -16.519
  832    H    SER 117           HN       SER 117   0.286  26.364 -12.545
  833    HA   SER 117           HA       SER 117   0.194  27.544  -9.835
  834   1HB   SER 117          HB2       SER 117   1.835  25.528 -11.343
  835   2HB   SER 117          HB1       SER 117   2.456  26.194  -9.836
  836    HG   SER 117           HG       SER 117   1.264  24.450  -9.255
  837    H    GLU 118           HN       GLU 118   1.625  29.147  -9.121
  838    HA   GLU 118           HA       GLU 118   3.286  30.460 -11.244
  839   1HB   GLU 118          HB2       GLU 118   1.203  31.407  -9.691
  840   2HB   GLU 118          HB1       GLU 118   2.624  31.963  -8.805
  841   1HG   GLU 118          HG2       GLU 118   2.622  32.307 -11.771
  842   2HG   GLU 118          HG1       GLU 118   1.599  33.385 -10.819
  843    H    GLN 119           HN       GLN 119   5.400  29.827 -10.936
  844    HA   GLN 119           HA       GLN 119   6.423  29.648  -8.122
  845   1HB   GLN 119          HB2       GLN 119   6.443  27.850 -10.247
  846   2HB   GLN 119          HB1       GLN 119   8.070  28.531 -10.271
  847   1HG   GLN 119          HG2       GLN 119   6.782  27.529  -7.727
  848   2HG   GLN 119          HG1       GLN 119   7.733  26.479  -8.779
  849   1HE2  GLN 119          HE21      GLN 119   8.741  26.868  -6.230
  850   2HE2  GLN 119          HE22      GLN 119  10.089  27.898  -6.273
  Start of MODEL    4
    1   1H    ALA   1          HT1       ALA   1  31.265  17.545  -2.910
    2   2H    ALA   1          HT2       ALA   1  32.187  18.230  -4.162
    3   3H    ALA   1          HT3       ALA   1  31.688  19.187  -2.850
    4    HA   ALA   1           HA       ALA   1  33.532  16.864  -2.599
    5   1HB   ALA   1          HB1       ALA   1  35.012  18.266  -3.584
    6   2HB   ALA   1          HB2       ALA   1  34.859  19.297  -2.162
    7   3HB   ALA   1          HB3       ALA   1  33.847  19.590  -3.576
    8    H    ARG   2           HN       ARG   2  32.311  19.931  -1.203
    9    HA   ARG   2           HA       ARG   2  32.669  18.707   1.516
   10   1HB   ARG   2          HB2       ARG   2  33.746  21.076   0.293
   11   2HB   ARG   2          HB1       ARG   2  32.695  21.553   1.627
   12   1HG   ARG   2          HG2       ARG   2  34.308  19.266   2.374
   13   2HG   ARG   2          HG1       ARG   2  35.332  20.592   1.822
   14   1HD   ARG   2          HD2       ARG   2  33.641  22.011   3.363
   15   2HD   ARG   2          HD1       ARG   2  33.548  20.453   4.208
   16    HE   ARG   2           HE       ARG   2  35.826  20.697   4.815
   17   1HH1  ARG   2          HH21      ARG   2  35.573  23.603   4.924
   18   2HH1  ARG   2          HH22      ARG   2  36.772  24.159   3.805
   19   1HH2  ARG   2          HH11      ARG   2  37.108  21.086   2.231
   20   2HH2  ARG   2          HH12      ARG   2  37.642  22.733   2.281
   21    H    ILE   3           HN       ILE   3  30.981  21.473  -0.032
   22    HA   ILE   3           HA       ILE   3  28.850  21.640   1.838
   23    HB   ILE   3           HB       ILE   3  27.726  22.815  -0.115
   24   1HG1  ILE   3          HG12      ILE   3  30.184  22.700  -1.719
   25   2HG1  ILE   3          HG11      ILE   3  29.350  21.150  -1.617
   26   1HG2  ILE   3          HG21      ILE   3  30.467  23.396   0.922
   27   2HG2  ILE   3          HG22      ILE   3  28.977  24.320   1.111
   28   3HG2  ILE   3          HG23      ILE   3  29.868  24.384  -0.410
   29   1HD1  ILE   3          HD11      ILE   3  27.649  23.539  -2.108
   30   2HD1  ILE   3          HD12      ILE   3  27.514  21.907  -2.764
   31   3HD1  ILE   3          HD13      ILE   3  28.695  23.032  -3.434
   32    H    HIS   4           HN       HIS   4  26.601  20.928   1.572
   33    HA   HIS   4           HA       HIS   4  26.189  18.627  -0.289
   34   1HB   HIS   4          HB2       HIS   4  26.712  18.508   2.511
   35   2HB   HIS   4          HB1       HIS   4  25.017  18.078   2.277
   36    HD1  HIS   4           HD1      HIS   4  24.595  15.718   1.596
   37    HD2  HIS   4           HD2      HIS   4  28.474  16.915   0.650
   38    HE1  HIS   4           HE1      HIS   4  25.768  13.674   0.669
   39    H    HIS   5           HN       HIS   5  24.480  19.457  -1.473
   40    HA   HIS   5           HA       HIS   5  22.381  20.459  -1.930
   41   1HB   HIS   5          HB2       HIS   5  21.925  19.016   0.702
   42   2HB   HIS   5          HB1       HIS   5  20.638  19.563  -0.373
   43    HD1  HIS   5           HD1      HIS   5  21.890  16.519   0.403
   44    HD2  HIS   5           HD2      HIS   5  21.832  18.530  -3.248
   45    HE1  HIS   5           HE1      HIS   5  22.130  14.750  -1.393
   46    H    HIS   6           HN       HIS   6  23.528  22.618  -1.403
   47    HA   HIS   6           HA       HIS   6  23.079  23.845   1.194
   48   1HB   HIS   6          HB2       HIS   6  24.366  24.387  -1.348
   49   2HB   HIS   6          HB1       HIS   6  23.485  25.809  -0.790
   50    HD1  HIS   6           HD1      HIS   6  26.380  26.254  -0.677
   51    HD2  HIS   6           HD2      HIS   6  24.430  24.256   2.419
   52    HE1  HIS   6           HE1      HIS   6  27.879  26.445   1.355
   53    H    HIS   7           HN       HIS   7  21.087  23.286  -1.543
   54    HA   HIS   7           HA       HIS   7  18.872  24.779  -0.327
   55   1HB   HIS   7          HB2       HIS   7  20.628  26.086  -2.076
   56   2HB   HIS   7          HB1       HIS   7  19.228  25.692  -3.073
   57    HD1  HIS   7           HD1      HIS   7  20.267  27.713  -0.087
   58    HD2  HIS   7           HD2      HIS   7  16.812  27.002  -2.308
   59    HE1  HIS   7           HE1      HIS   7  18.570  29.441   0.656
   60    H    HIS   8           HN       HIS   8  16.963  23.761  -0.899
   61    HA   HIS   8           HA       HIS   8  16.978  22.028  -3.347
   62   1HB   HIS   8          HB2       HIS   8  16.902  21.305  -0.581
   63   2HB   HIS   8          HB1       HIS   8  15.328  20.926  -1.280
   64    HD1  HIS   8           HD1      HIS   8  15.272  19.199  -3.245
   65    HD2  HIS   8           HD2      HIS   8  19.051  19.745  -1.571
   66    HE1  HIS   8           HE1      HIS   8  16.720  17.312  -4.114
   67    H    HIS   9           HN       HIS   9  15.381  22.777  -4.681
   68    HA   HIS   9           HA       HIS   9  12.840  23.764  -3.427
   69   1HB   HIS   9          HB2       HIS   9  14.811  25.123  -4.995
   70   2HB   HIS   9          HB1       HIS   9  13.338  25.004  -5.957
   71    HD1  HIS   9           HD1      HIS   9  13.657  25.444  -2.187
   72    HD2  HIS   9           HD2      HIS   9  12.141  27.469  -5.500
   73    HE1  HIS   9           HE1      HIS   9  12.448  27.480  -1.290
   74    H    ILE  10           HN       ILE  10  14.081  23.014  -6.709
   75    HA   ILE  10           HA       ILE  10  11.715  21.203  -7.073
   76    HB   ILE  10           HB       ILE  10  12.985  23.258  -8.902
   77   1HG1  ILE  10          HG12      ILE  10  10.091  23.244  -8.657
   78   2HG1  ILE  10          HG11      ILE  10  10.853  23.359  -7.070
   79   1HG2  ILE  10          HG21      ILE  10  10.693  22.125 -10.112
   80   2HG2  ILE  10          HG22      ILE  10  11.688  20.770  -9.580
   81   3HG2  ILE  10          HG23      ILE  10  12.365  21.992 -10.657
   82   1HD1  ILE  10          HD11      ILE  10  11.035  25.573  -7.535
   83   2HD1  ILE  10          HD12      ILE  10  10.786  25.321  -9.262
   84   3HD1  ILE  10          HD13      ILE  10  12.386  25.088  -8.558
   85    H    GLU  11           HN       GLU  11  14.750  22.044  -8.796
   86    HA   GLU  11           HA       GLU  11  15.134  19.369  -9.815
   87   1HB   GLU  11          HB2       GLU  11  17.260  20.314 -10.578
   88   2HB   GLU  11          HB1       GLU  11  15.984  21.512 -10.796
   89   1HG   GLU  11          HG2       GLU  11  16.657  22.344  -8.430
   90   2HG   GLU  11          HG1       GLU  11  18.140  21.428  -8.693
   91    H    GLY  12           HN       GLY  12  16.437  17.705  -8.995
   92   1HA   GLY  12          HA2       GLY  12  18.286  18.102  -6.798
   93   2HA   GLY  12          HA1       GLY  12  16.791  17.336  -6.259
   94    H    ARG  13           HN       ARG  13  17.046  15.164  -6.141
   95    HA   ARG  13           HA       ARG  13  18.511  13.794  -8.370
   96   1HB   ARG  13          HB2       ARG  13  19.958  13.978  -6.412
   97   2HB   ARG  13          HB1       ARG  13  18.682  13.341  -5.373
   98   1HG   ARG  13          HG2       ARG  13  18.826  11.374  -7.256
   99   2HG   ARG  13          HG1       ARG  13  20.506  11.911  -7.211
  100   1HD   ARG  13          HD2       ARG  13  20.558  11.599  -4.761
  101   2HD   ARG  13          HD1       ARG  13  18.864  11.070  -4.793
  102    HE   ARG  13           HE       ARG  13  20.344   9.546  -6.707
  103   1HH1  ARG  13          HH11      ARG  13  18.467   8.411  -4.634
  104   2HH1  ARG  13          HH12      ARG  13  19.552   7.493  -3.643
  105   1HH2  ARG  13          HH21      ARG  13  22.402   9.045  -4.861
  106   2HH2  ARG  13          HH22      ARG  13  21.778   7.851  -3.772
  107    H    ALA  14           HN       ALA  14  16.376  13.229  -5.541
  108    HA   ALA  14           HA       ALA  14  14.668  11.491  -7.261
  109   1HB   ALA  14          HB1       ALA  14  15.095  10.404  -4.585
  110   2HB   ALA  14          HB2       ALA  14  16.607  10.548  -5.481
  111   3HB   ALA  14          HB3       ALA  14  15.271   9.610  -6.149
  112    HA   PRO  15           HA       PRO  15  12.516  14.313  -4.172
  113   1HB   PRO  15          HB2       PRO  15  11.279  15.936  -5.997
  114   2HB   PRO  15          HB1       PRO  15  12.889  16.278  -5.332
  115   1HG   PRO  15          HG2       PRO  15  12.138  15.099  -7.959
  116   2HG   PRO  15          HG1       PRO  15  13.431  16.241  -7.561
  117   1HD   PRO  15          HD2       PRO  15  13.846  13.575  -7.973
  118   2HD   PRO  15          HD1       PRO  15  14.881  14.584  -6.937
  119    H    THR  16           HN       THR  16  11.593  12.711  -7.168
  120    HA   THR  16           HA       THR  16   8.787  12.420  -6.184
  121    HB   THR  16           HB       THR  16   8.264  12.031  -8.485
  122    HG1  THR  16           HG1      THR  16  11.059  11.732  -8.845
  123   1HG2  THR  16          HG21      THR  16  10.551  14.016  -8.485
  124   2HG2  THR  16          HG22      THR  16   8.926  14.376  -7.900
  125   3HG2  THR  16          HG23      THR  16   9.184  13.979  -9.599
  126    H    GLU  17           HN       GLU  17   8.543  10.045  -8.015
  127    HA   GLU  17           HA       GLU  17   8.914   7.955  -6.149
  128   1HB   GLU  17          HB2       GLU  17   7.652   8.332  -8.526
  129   2HB   GLU  17          HB1       GLU  17   9.008   7.330  -9.047
  130   1HG   GLU  17          HG2       GLU  17   8.429   5.703  -7.225
  131   2HG   GLU  17          HG1       GLU  17   6.990   6.666  -6.886
  132    H    GLN  18           HN       GLN  18  10.650   6.539  -5.803
  133    HA   GLN  18           HA       GLN  18  13.046   6.885  -7.510
  134   1HB   GLN  18          HB2       GLN  18  14.387   6.806  -5.452
  135   2HB   GLN  18          HB1       GLN  18  13.196   8.103  -5.349
  136   1HG   GLN  18          HG2       GLN  18  12.220   5.494  -4.389
  137   2HG   GLN  18          HG1       GLN  18  13.546   6.163  -3.438
  138   1HE2  GLN  18          HE21      GLN  18  12.007   6.600  -1.650
  139   2HE2  GLN  18          HE22      GLN  18  10.938   7.915  -1.745
  140    H    SER  19           HN       SER  19  14.346   4.927  -5.549
  141    HA   SER  19           HA       SER  19  14.217   2.541  -6.940
  142   1HB   SER  19          HB2       SER  19  15.486   3.377  -4.766
  143   2HB   SER  19          HB1       SER  19  14.208   2.493  -3.939
  144    HG   SER  19           HG       SER  19  15.707   0.974  -4.297
  145    HA   PRO  20           HA       PRO  20   9.823   1.747  -6.169
  146   1HB   PRO  20          HB2       PRO  20   9.530   0.030  -8.278
  147   2HB   PRO  20          HB1       PRO  20   9.476   1.795  -8.456
  148   1HG   PRO  20          HG2       PRO  20  11.697  -0.098  -9.033
  149   2HG   PRO  20          HG1       PRO  20  11.192   1.354  -9.912
  150   1HD   PRO  20          HD2       PRO  20  13.336   1.275  -8.217
  151   2HD   PRO  20          HD1       PRO  20  12.404   2.748  -8.566
  152    H    GLY  21           HN       GLY  21   9.961   0.468  -4.287
  153   1HA   GLY  21          HA2       GLY  21   9.810  -2.380  -4.577
  154   2HA   GLY  21          HA1       GLY  21  11.404  -1.936  -3.967
  155    H    VAL  22           HN       VAL  22  11.344  -2.413  -1.808
  156    HA   VAL  22           HA       VAL  22   9.143  -2.514  -0.084
  157    HB   VAL  22           HB       VAL  22  10.882  -2.125   1.687
  158   1HG1  VAL  22          HG11      VAL  22  12.175  -4.082   1.157
  159   2HG1  VAL  22          HG12      VAL  22  11.922  -3.852  -0.574
  160   3HG1  VAL  22          HG13      VAL  22  10.573  -4.324   0.460
  161   1HG2  VAL  22          HG21      VAL  22  13.251  -1.842   0.769
  162   2HG2  VAL  22          HG22      VAL  22  12.226  -0.409   0.698
  163   3HG2  VAL  22          HG23      VAL  22  12.503  -1.369  -0.756
  164    H    GLN  23           HN       GLN  23   7.808  -0.958   0.767
  165    HA   GLN  23           HA       GLN  23   8.632   1.646   1.564
  166   1HB   GLN  23          HB2       GLN  23   8.907   1.878  -0.891
  167   2HB   GLN  23          HB1       GLN  23   7.212   1.440  -1.109
  168   1HG   GLN  23          HG2       GLN  23   6.452   3.422  -0.035
  169   2HG   GLN  23          HG1       GLN  23   8.051   3.767   0.625
  170   1HE2  GLN  23          HE21      GLN  23   6.178   5.256  -1.397
  171   2HE2  GLN  23          HE22      GLN  23   7.224   5.636  -2.678
  172    H    ASP  24           HN       ASP  24   7.252   1.227   3.356
  173    HA   ASP  24           HA       ASP  24   4.567   0.260   3.195
  174   1HB   ASP  24          HB2       ASP  24   5.884   2.110   5.213
  175   2HB   ASP  24          HB1       ASP  24   4.454   1.121   5.502
  176    H    CYS  25           HN       CYS  25   3.467   1.440   1.509
  177    HA   CYS  25           HA       CYS  25   2.355   4.025   2.393
  178   1HB   CYS  25          HB2       CYS  25   4.694   4.041   0.959
  179   2HB   CYS  25          HB1       CYS  25   3.485   4.191  -0.314
  180    H    TYR  26           HN       TYR  26   0.529   4.645   1.137
  181    HA   TYR  26           HA       TYR  26  -0.324   3.038  -1.166
  182   1HB   TYR  26          HB2       TYR  26  -2.187   1.985  -0.078
  183   2HB   TYR  26          HB1       TYR  26  -0.790   1.696   0.957
  184    HD1  TYR  26           HD1      TYR  26  -0.862   2.307   3.214
  185    HD2  TYR  26           HD2      TYR  26  -3.628   4.099   0.461
  186    HE1  TYR  26           HE1      TYR  26  -2.031   3.405   5.105
  187    HE2  TYR  26           HE2      TYR  26  -4.794   5.200   2.353
  188    HH   TYR  26           HH       TYR  26  -5.019   5.229   4.605
  189    H    HIS  27           HN       HIS  27  -2.038   4.099  -2.294
  190    HA   HIS  27           HA       HIS  27  -2.573   6.873  -1.341
  191   1HB   HIS  27          HB2       HIS  27  -3.040   5.498  -4.012
  192   2HB   HIS  27          HB1       HIS  27  -3.185   7.229  -3.705
  193    HD1  HIS  27           HD1      HIS  27  -0.636   7.555  -1.924
  194    HD2  HIS  27           HD2      HIS  27  -0.718   5.552  -5.579
  195    HE1  HIS  27           HE1      HIS  27   1.739   7.568  -2.800
  196    H    GLY  28           HN       GLY  28  -4.808   7.682  -1.452
  197   1HA   GLY  28          HA2       GLY  28  -7.088   7.490  -0.912
  198   2HA   GLY  28          HA1       GLY  28  -7.099   6.169  -2.084
  199    H    ASP  29           HN       ASP  29  -7.746   4.262  -1.229
  200    HA   ASP  29           HA       ASP  29  -7.053   3.709   1.623
  201   1HB   ASP  29          HB2       ASP  29  -9.532   2.811   0.140
  202   2HB   ASP  29          HB1       ASP  29  -9.240   2.716   1.877
  203    H    GLY  30           HN       GLY  30  -5.193   2.877  -0.020
  204   1HA   GLY  30          HA2       GLY  30  -4.064   0.950  -0.755
  205   2HA   GLY  30          HA1       GLY  30  -5.278   0.004   0.115
  206    H    GLN  31           HN       GLN  31  -6.776   2.187  -1.952
  207    HA   GLN  31           HA       GLN  31  -7.737   0.061  -3.704
  208   1HB   GLN  31          HB2       GLN  31  -8.578   2.540  -2.776
  209   2HB   GLN  31          HB1       GLN  31  -8.238   2.844  -4.480
  210   1HG   GLN  31          HG2       GLN  31 -10.414   2.082  -4.651
  211   2HG   GLN  31          HG1       GLN  31  -9.552   0.550  -4.785
  212   1HE2  GLN  31          HE21      GLN  31 -11.987   0.070  -3.873
  213   2HE2  GLN  31          HE22      GLN  31 -12.054  -0.103  -2.185
  214    H    SER  32           HN       SER  32  -5.489   2.797  -4.028
  215    HA   SER  32           HA       SER  32  -5.117   2.498  -6.891
  216   1HB   SER  32          HB2       SER  32  -4.399   4.576  -6.336
  217   2HB   SER  32          HB1       SER  32  -4.187   4.126  -4.647
  218    HG   SER  32           HG       SER  32  -2.152   3.574  -5.035
  219    H    TYR  33           HN       TYR  33  -4.247   0.440  -4.430
  220    HA   TYR  33           HA       TYR  33  -1.509  -0.183  -5.184
  221   1HB   TYR  33          HB2       TYR  33  -3.193  -0.695  -3.076
  222   2HB   TYR  33          HB1       TYR  33  -3.165  -2.258  -3.895
  223    HD1  TYR  33           HD1      TYR  33  -1.116  -3.564  -4.069
  224    HD2  TYR  33           HD2      TYR  33  -1.128   0.300  -2.191
  225    HE1  TYR  33           HE1      TYR  33   1.144  -4.000  -3.149
  226    HE2  TYR  33           HE2      TYR  33   1.130  -0.138  -1.270
  227    HH   TYR  33           HH       TYR  33   3.186  -2.060  -2.288
  228    H    ARG  34           HN       ARG  34  -0.910  -1.326  -6.974
  229    HA   ARG  34           HA       ARG  34  -2.808  -3.359  -8.081
  230   1HB   ARG  34          HB2       ARG  34  -2.399  -0.854  -9.145
  231   2HB   ARG  34          HB1       ARG  34  -1.218  -1.819 -10.031
  232   1HG   ARG  34          HG2       ARG  34  -2.850  -3.205 -10.966
  233   2HG   ARG  34          HG1       ARG  34  -4.025  -2.840  -9.701
  234   1HD   ARG  34          HD2       ARG  34  -4.455  -1.739 -11.986
  235   2HD   ARG  34          HD1       ARG  34  -4.424  -0.635 -10.596
  236    HE   ARG  34           HE       ARG  34  -2.045  -1.091 -12.362
  237   1HH1  ARG  34          HH11      ARG  34  -4.340   1.206 -11.914
  238   2HH1  ARG  34          HH12      ARG  34  -3.277   2.475 -11.406
  239   1HH2  ARG  34          HH21      ARG  34  -0.533   0.389 -11.027
  240   2HH2  ARG  34          HH22      ARG  34  -1.121   2.013 -10.904
  241    H    GLY  35           HN       GLY  35  -0.050  -3.141  -6.570
  242   1HA   GLY  35          HA2       GLY  35   1.579  -4.710  -8.512
  243   2HA   GLY  35          HA1       GLY  35   2.214  -3.911  -7.073
  244    H    SER  36           HN       SER  36   3.160  -6.077  -6.599
  245    HA   SER  36           HA       SER  36   1.126  -7.952  -5.432
  246   1HB   SER  36          HB2       SER  36   3.446  -9.386  -5.765
  247   2HB   SER  36          HB1       SER  36   2.145  -9.313  -6.949
  248    HG   SER  36           HG       SER  36   3.490  -8.320  -8.205
  249    H    PHE  37           HN       PHE  37   1.707  -5.974  -3.714
  250    HA   PHE  37           HA       PHE  37   4.127  -6.427  -2.147
  251   1HB   PHE  37          HB2       PHE  37   2.963  -4.251  -2.378
  252   2HB   PHE  37          HB1       PHE  37   1.553  -4.926  -1.561
  253    HD1  PHE  37           HD1      PHE  37   1.504  -5.213   0.821
  254    HD2  PHE  37           HD2      PHE  37   5.125  -4.006  -1.148
  255    HE1  PHE  37           HE1      PHE  37   2.522  -4.681   3.019
  256    HE2  PHE  37           HE2      PHE  37   6.143  -3.474   1.049
  257    HZ   PHE  37           HZ       PHE  37   4.841  -3.811   3.133
  258    H    SER  38           HN       SER  38   3.521  -8.871  -2.016
  259    HA   SER  38           HA       SER  38   1.381  -9.679  -0.231
  260   1HB   SER  38          HB2       SER  38   2.104 -11.786  -0.830
  261   2HB   SER  38          HB1       SER  38   2.829 -10.859  -2.138
  262    HG   SER  38           HG       SER  38   4.355 -12.224  -1.141
  263    H    THR  39           HN       THR  39   3.019  -7.686   1.108
  264    HA   THR  39           HA       THR  39   4.457  -9.356   3.136
  265    HB   THR  39           HB       THR  39   4.647  -6.365   2.751
  266    HG1  THR  39           HG1      THR  39   5.949  -6.650   1.101
  267   1HG2  THR  39          HG21      THR  39   6.994  -8.010   3.449
  268   2HG2  THR  39          HG22      THR  39   5.697  -8.035   4.644
  269   3HG2  THR  39          HG23      THR  39   6.423  -6.501   4.162
  270    H    THR  40           HN       THR  40   3.403  -9.577   5.066
  271    HA   THR  40           HA       THR  40   0.974  -8.058   5.636
  272    HB   THR  40           HB       THR  40   1.076  -9.474   7.726
  273    HG1  THR  40           HG1      THR  40   3.131  -9.864   8.138
  274   1HG2  THR  40          HG21      THR  40  -0.029 -10.340   5.733
  275   2HG2  THR  40          HG22      THR  40   0.870 -11.643   6.511
  276   3HG2  THR  40          HG23      THR  40   1.519 -10.862   5.069
  277    H    VAL  41           HN       VAL  41   0.772  -7.057   7.917
  278    HA   VAL  41           HA       VAL  41   2.542  -4.844   8.187
  279    HB   VAL  41           HB       VAL  41   0.489  -6.220   9.918
  280   1HG1  VAL  41          HG11      VAL  41   1.988  -5.314  11.553
  281   2HG1  VAL  41          HG12      VAL  41   0.670  -4.153  11.399
  282   3HG1  VAL  41          HG13      VAL  41   2.219  -3.836  10.618
  283   1HG2  VAL  41          HG21      VAL  41   0.612  -4.010   7.988
  284   2HG2  VAL  41          HG22      VAL  41  -0.218  -3.579   9.483
  285   3HG2  VAL  41          HG23      VAL  41  -0.778  -4.951   8.528
  286    H    THR  42           HN       THR  42   2.420  -7.950   9.959
  287    HA   THR  42           HA       THR  42   4.515  -7.386  11.819
  288    HB   THR  42           HB       THR  42   3.783 -10.052  10.574
  289    HG1  THR  42           HG1      THR  42   2.386  -9.837  12.665
  290   1HG2  THR  42          HG21      THR  42   4.957  -9.166  13.211
  291   2HG2  THR  42          HG22      THR  42   5.632 -10.304  12.044
  292   3HG2  THR  42          HG23      THR  42   4.222 -10.755  13.003
  293    H    GLY  43           HN       GLY  43   4.598  -8.147   8.421
  294   1HA   GLY  43          HA2       GLY  43   6.609  -7.742   7.109
  295   2HA   GLY  43          HA1       GLY  43   7.573  -8.114   8.540
  296    H    ARG  44           HN       ARG  44   5.005 -10.276   8.231
  297    HA   ARG  44           HA       ARG  44   6.826 -12.471   7.512
  298   1HB   ARG  44          HB2       ARG  44   4.268 -12.020   8.820
  299   2HB   ARG  44          HB1       ARG  44   4.175 -13.370   7.689
  300   1HG   ARG  44          HG2       ARG  44   6.443 -14.099   8.784
  301   2HG   ARG  44          HG1       ARG  44   5.929 -13.052  10.108
  302   1HD   ARG  44          HD2       ARG  44   4.493 -15.488   9.013
  303   2HD   ARG  44          HD1       ARG  44   5.061 -15.208  10.671
  304    HE   ARG  44           HE       ARG  44   2.679 -13.966   9.432
  305   1HH1  ARG  44          HH21      ARG  44   3.696 -15.215  12.266
  306   2HH1  ARG  44          HH22      ARG  44   3.268 -13.870  13.270
  307   1HH2  ARG  44          HH11      ARG  44   2.666 -11.733  10.607
  308   2HH2  ARG  44          HH12      ARG  44   2.683 -11.900  12.331
  309    H    THR  45           HN       THR  45   5.061 -14.139   6.149
  310    HA   THR  45           HA       THR  45   4.800 -12.741   3.505
  311    HB   THR  45           HB       THR  45   5.517 -15.553   4.356
  312    HG1  THR  45           HG1      THR  45   7.113 -14.822   2.560
  313   1HG2  THR  45          HG21      THR  45   4.404 -16.330   2.552
  314   2HG2  THR  45          HG22      THR  45   5.605 -15.488   1.574
  315   3HG2  THR  45          HG23      THR  45   4.077 -14.700   1.965
  316    H    CYS  46           HN       CYS  46   2.704 -12.531   2.801
  317    HA   CYS  46           HA       CYS  46   0.526 -13.640   4.308
  318   1HB   CYS  46          HB2       CYS  46   0.091 -11.555   3.381
  319   2HB   CYS  46          HB1       CYS  46   0.922 -11.941   1.878
  320    H    GLN  47           HN       GLN  47  -1.093 -15.100   3.533
  321    HA   GLN  47           HA       GLN  47  -0.056 -17.230   1.767
  322   1HB   GLN  47          HB2       GLN  47  -1.054 -17.881   3.871
  323   2HB   GLN  47          HB1       GLN  47  -2.473 -16.882   3.569
  324   1HG   GLN  47          HG2       GLN  47  -2.773 -18.347   1.446
  325   2HG   GLN  47          HG1       GLN  47  -1.680 -19.471   2.254
  326   1HE2  GLN  47          HE21      GLN  47  -2.912 -21.071   3.253
  327   2HE2  GLN  47          HE22      GLN  47  -4.347 -20.797   4.117
  328    H    SER  48           HN       SER  48  -0.683 -17.254  -0.405
  329    HA   SER  48           HA       SER  48  -2.101 -15.352  -1.785
  330   1HB   SER  48          HB2       SER  48  -1.642 -18.286  -2.090
  331   2HB   SER  48          HB1       SER  48  -2.771 -17.518  -3.202
  332    HG   SER  48           HG       SER  48  -0.624 -17.459  -3.985
  333    H    TRP  49           HN       TRP  49  -4.318 -15.438  -2.730
  334    HA   TRP  49           HA       TRP  49  -6.330 -15.771  -0.657
  335   1HB   TRP  49          HB2       TRP  49  -6.686 -15.316  -3.635
  336   2HB   TRP  49          HB1       TRP  49  -7.783 -14.834  -2.343
  337    HD1  TRP  49           HD1      TRP  49  -4.527 -13.854  -4.030
  338    HE1  TRP  49           HE1      TRP  49  -3.862 -11.503  -3.243
  339    HE3  TRP  49           HE3      TRP  49  -7.941 -13.130  -0.363
  340    HZ2  TRP  49           HZ2      TRP  49  -4.645  -9.571  -1.323
  341    HZ3  TRP  49           HZ3      TRP  49  -7.983 -11.027   0.952
  342    HH2  TRP  49           HH2      TRP  49  -6.330  -9.239   0.473
  343    H    SER  50           HN       SER  50  -5.342 -17.541  -3.562
  344    HA   SER  50           HA       SER  50  -7.518 -19.493  -3.402
  345   1HB   SER  50          HB2       SER  50  -6.111 -18.601  -5.412
  346   2HB   SER  50          HB1       SER  50  -4.919 -19.790  -4.897
  347    HG   SER  50           HG       SER  50  -6.110 -21.126  -5.997
  348    H    SER  51           HN       SER  51  -5.357 -19.112  -1.135
  349    HA   SER  51           HA       SER  51  -4.064 -21.760  -1.081
  350   1HB   SER  51          HB2       SER  51  -4.145 -19.503   0.938
  351   2HB   SER  51          HB1       SER  51  -3.004 -20.844   0.916
  352    HG   SER  51           HG       SER  51  -1.943 -19.282  -0.139
  353    H    MET  52           HN       MET  52  -4.587 -23.388   0.339
  354    HA   MET  52           HA       MET  52  -6.744 -23.028   2.327
  355   1HB   MET  52          HB2       MET  52  -7.598 -25.279   0.963
  356   2HB   MET  52          HB1       MET  52  -8.302 -23.673   0.815
  357   1HG   MET  52          HG2       MET  52  -6.636 -23.214  -1.026
  358   2HG   MET  52          HG1       MET  52  -6.193 -24.920  -0.957
  359   1HE   MET  52          HE1       MET  52  -8.758 -22.261  -2.120
  360   2HE   MET  52          HE2       MET  52  -9.266 -22.800  -0.522
  361   3HE   MET  52          HE3       MET  52 -10.283 -23.135  -1.921
  362    H    THR  53           HN       THR  53  -3.787 -23.985   1.874
  363    HA   THR  53           HA       THR  53  -3.800 -26.801   2.638
  364    HB   THR  53           HB       THR  53  -1.307 -25.704   3.226
  365    HG1  THR  53           HG1      THR  53  -1.127 -24.376   1.217
  366   1HG2  THR  53          HG21      THR  53  -0.691 -27.109   1.563
  367   2HG2  THR  53          HG22      THR  53  -1.740 -26.316   0.388
  368   3HG2  THR  53          HG23      THR  53  -2.401 -27.534   1.480
  369    HA   PRO  54           HA       PRO  54  -2.451 -25.207   6.923
  370   1HB   PRO  54          HB2       PRO  54  -2.345 -22.501   7.339
  371   2HB   PRO  54          HB1       PRO  54  -0.968 -23.443   6.733
  372   1HG   PRO  54          HG2       PRO  54  -2.901 -21.743   5.233
  373   2HG   PRO  54          HG1       PRO  54  -1.155 -21.931   5.012
  374   1HD   PRO  54          HD2       PRO  54  -2.995 -23.149   3.424
  375   2HD   PRO  54          HD1       PRO  54  -1.384 -23.828   3.750
  376    H    HIS  55           HN       HIS  55  -4.151 -22.143   6.535
  377    HA   HIS  55           HA       HIS  55  -6.521 -23.372   7.906
  378   1HB   HIS  55          HB2       HIS  55  -6.901 -20.892   8.511
  379   2HB   HIS  55          HB1       HIS  55  -5.512 -21.682   9.259
  380    HD1  HIS  55           HD1      HIS  55  -3.144 -21.115   8.277
  381    HD2  HIS  55           HD2      HIS  55  -6.249 -18.827   6.700
  382    HE1  HIS  55           HE1      HIS  55  -2.059 -19.205   7.028
  383    H    TRP  56           HN       TRP  56  -7.577 -24.033   5.923
  384    HA   TRP  56           HA       TRP  56  -7.911 -22.467   3.601
  385   1HB   TRP  56          HB2       TRP  56  -8.503 -24.903   4.000
  386   2HB   TRP  56          HB1       TRP  56  -9.957 -24.342   4.826
  387    HD1  TRP  56           HD1      TRP  56 -10.653 -21.934   2.875
  388    HE1  TRP  56           HE1      TRP  56 -11.547 -22.357   0.567
  389    HE3  TRP  56           HE3      TRP  56  -9.081 -26.722   2.247
  390    HZ2  TRP  56           HZ2      TRP  56 -11.637 -24.462  -1.361
  391    HZ3  TRP  56           HZ3      TRP  56  -9.592 -27.916   0.136
  392    HH2  TRP  56           HH2      TRP  56 -10.869 -26.802  -1.664
  393    H    HIS  57           HN       HIS  57  -8.991 -20.606   3.234
  394    HA   HIS  57           HA       HIS  57 -11.183 -19.851   5.124
  395   1HB   HIS  57          HB2       HIS  57 -10.399 -17.462   4.432
  396   2HB   HIS  57          HB1       HIS  57  -9.385 -18.367   5.557
  397    HD1  HIS  57           HD1      HIS  57  -9.598 -18.832   1.793
  398    HD2  HIS  57           HD2      HIS  57  -6.844 -17.624   4.677
  399    HE1  HIS  57           HE1      HIS  57  -7.387 -18.568   0.600
  400    H    GLN  58           HN       GLN  58 -13.134 -19.489   4.163
  401    HA   GLN  58           HA       GLN  58 -13.821 -20.145   1.562
  402   1HB   GLN  58          HB2       GLN  58 -14.918 -18.034   3.439
  403   2HB   GLN  58          HB1       GLN  58 -15.759 -18.551   1.977
  404   1HG   GLN  58          HG2       GLN  58 -14.935 -20.889   3.406
  405   2HG   GLN  58          HG1       GLN  58 -15.757 -19.812   4.536
  406   1HE2  GLN  58          HE21      GLN  58 -16.299 -22.162   2.134
  407   2HE2  GLN  58          HE22      GLN  58 -17.940 -21.839   1.845
  408    H    ARG  59           HN       ARG  59 -12.851 -16.896   2.707
  409    HA   ARG  59           HA       ARG  59 -13.174 -15.498   0.259
  410   1HB   ARG  59          HB2       ARG  59 -11.197 -15.182   2.540
  411   2HB   ARG  59          HB1       ARG  59 -11.511 -13.948   1.319
  412   1HG   ARG  59          HG2       ARG  59 -13.850 -15.113   2.776
  413   2HG   ARG  59          HG1       ARG  59 -12.831 -13.953   3.629
  414   1HD   ARG  59          HD2       ARG  59 -13.100 -12.600   1.326
  415   2HD   ARG  59          HD1       ARG  59 -14.615 -13.523   1.274
  416    HE   ARG  59           HE       ARG  59 -14.316 -12.539   3.916
  417   1HH1  ARG  59          HH11      ARG  59 -14.023 -10.948   0.930
  418   2HH1  ARG  59          HH12      ARG  59 -15.192  -9.721   1.290
  419   1HH2  ARG  59          HH21      ARG  59 -16.154 -11.149   4.300
  420   2HH2  ARG  59          HH22      ARG  59 -16.399  -9.835   3.198
  421    H    THR  60           HN       THR  60 -11.900 -15.348  -1.573
  422    HA   THR  60           HA       THR  60  -9.106 -15.971  -1.739
  423    HB   THR  60           HB       THR  60  -9.637 -18.239  -1.307
  424    HG1  THR  60           HG1      THR  60  -9.412 -19.231  -3.366
  425   1HG2  THR  60          HG21      THR  60 -11.791 -18.859  -1.402
  426   2HG2  THR  60          HG22      THR  60 -11.623 -18.969  -3.153
  427   3HG2  THR  60          HG23      THR  60 -12.183 -17.469  -2.414
  428    H    THR  61           HN       THR  61  -8.585 -16.575  -4.167
  429    HA   THR  61           HA       THR  61  -9.782 -14.528  -5.835
  430    HB   THR  61           HB       THR  61  -8.351 -16.104  -7.517
  431    HG1  THR  61           HG1      THR  61  -6.842 -17.218  -6.411
  432   1HG2  THR  61          HG21      THR  61  -7.485 -14.003  -7.368
  433   2HG2  THR  61          HG22      THR  61  -6.333 -14.780  -6.279
  434   3HG2  THR  61          HG23      THR  61  -7.727 -13.921  -5.623
  435    H    GLU  62           HN       GLU  62 -10.656 -17.718  -4.956
  436    HA   GLU  62           HA       GLU  62 -11.875 -18.575  -7.400
  437   1HB   GLU  62          HB2       GLU  62 -11.261 -19.887  -5.255
  438   2HB   GLU  62          HB1       GLU  62 -12.768 -19.252  -4.593
  439   1HG   GLU  62          HG2       GLU  62 -13.600 -20.176  -7.034
  440   2HG   GLU  62          HG1       GLU  62 -12.346 -21.347  -6.626
  441    H    TYR  63           HN       TYR  63 -12.826 -16.575  -4.705
  442    HA   TYR  63           HA       TYR  63 -15.566 -16.277  -5.727
  443   1HB   TYR  63          HB2       TYR  63 -14.078 -15.849  -3.266
  444   2HB   TYR  63          HB1       TYR  63 -15.043 -14.428  -3.672
  445    HD1  TYR  63           HD1      TYR  63 -17.203 -14.389  -2.817
  446    HD2  TYR  63           HD2      TYR  63 -15.415 -18.166  -3.808
  447    HE1  TYR  63           HE1      TYR  63 -19.253 -15.559  -2.058
  448    HE2  TYR  63           HE2      TYR  63 -17.465 -19.337  -3.048
  449    HH   TYR  63           HH       TYR  63 -19.585 -18.265  -1.125
  450    H    TYR  64           HN       TYR  64 -12.516 -15.016  -6.389
  451    HA   TYR  64           HA       TYR  64 -13.745 -12.625  -7.698
  452   1HB   TYR  64          HB2       TYR  64 -11.601 -12.757  -5.598
  453   2HB   TYR  64          HB1       TYR  64 -11.533 -11.476  -6.808
  454    HD1  TYR  64           HD1      TYR  64 -13.798 -13.064  -4.295
  455    HD2  TYR  64           HD2      TYR  64 -12.908  -9.566  -6.624
  456    HE1  TYR  64           HE1      TYR  64 -15.542 -11.801  -3.064
  457    HE2  TYR  64           HE2      TYR  64 -14.651  -8.303  -5.392
  458    HH   TYR  64           HH       TYR  64 -16.647  -8.717  -4.096
  459    HA   PRO  65           HA       PRO  65 -10.924 -14.910 -10.501
  460   1HB   PRO  65          HB2       PRO  65 -12.447 -14.485 -12.736
  461   2HB   PRO  65          HB1       PRO  65 -12.740 -15.824 -11.606
  462   1HG   PRO  65          HG2       PRO  65 -14.144 -13.210 -11.845
  463   2HG   PRO  65          HG1       PRO  65 -14.802 -14.819 -11.509
  464   1HD   PRO  65          HD2       PRO  65 -14.392 -12.936  -9.584
  465   2HD   PRO  65          HD1       PRO  65 -14.341 -14.684  -9.270
  466    H    ASN  66           HN       ASN  66 -12.351 -11.709 -10.586
  467    HA   ASN  66           HA       ASN  66  -9.991 -10.758 -12.178
  468   1HB   ASN  66          HB2       ASN  66 -12.924 -10.407 -12.494
  469   2HB   ASN  66          HB1       ASN  66 -11.947  -8.963 -12.760
  470   1HD2  ASN  66          HD21      ASN  66 -10.564  -8.908 -14.625
  471   2HD2  ASN  66          HD22      ASN  66 -10.569 -10.129 -15.804
  472    H    GLY  67           HN       GLY  67  -9.755 -10.758  -9.450
  473   1HA   GLY  67          HA2       GLY  67 -10.544  -8.022  -8.560
  474   2HA   GLY  67          HA1       GLY  67 -10.092  -9.343  -7.481
  475    H    GLY  68           HN       GLY  68  -7.925  -9.686  -9.847
  476   1HA   GLY  68          HA2       GLY  68  -5.767  -8.773 -10.282
  477   2HA   GLY  68          HA1       GLY  68  -6.104  -7.491  -9.114
  478    H    LEU  69           HN       LEU  69  -6.905 -10.609  -8.016
  479    HA   LEU  69           HA       LEU  69  -4.715 -10.520  -6.045
  480   1HB   LEU  69          HB2       LEU  69  -7.194 -12.205  -6.472
  481   2HB   LEU  69          HB1       LEU  69  -6.089 -12.446  -5.119
  482    HG   LEU  69           HG       LEU  69  -7.662  -9.946  -5.765
  483   1HD1  LEU  69          HD11      LEU  69  -9.084 -10.597  -4.120
  484   2HD1  LEU  69          HD12      LEU  69  -7.763 -11.112  -3.070
  485   3HD1  LEU  69          HD13      LEU  69  -8.370 -12.197  -4.322
  486   1HD2  LEU  69          HD21      LEU  69  -6.479  -9.517  -3.329
  487   2HD2  LEU  69          HD22      LEU  69  -5.863  -8.887  -4.857
  488   3HD2  LEU  69          HD23      LEU  69  -5.204 -10.380  -4.190
  489    H    THR  70           HN       THR  70  -3.352 -10.963  -8.217
  490    HA   THR  70           HA       THR  70  -3.280 -13.730  -9.137
  491    HB   THR  70           HB       THR  70  -1.407 -11.356  -9.402
  492    HG1  THR  70           HG1      THR  70  -2.968 -12.464 -11.442
  493   1HG2  THR  70          HG21      THR  70  -0.260 -13.556  -9.708
  494   2HG2  THR  70          HG22      THR  70  -0.314 -12.594 -11.185
  495   3HG2  THR  70          HG23      THR  70  -1.426 -13.946 -10.973
  496    H    ARG  71           HN       ARG  71  -2.232 -15.394  -8.109
  497    HA   ARG  71           HA       ARG  71  -0.815 -16.524  -6.587
  498   1HB   ARG  71          HB2       ARG  71   0.667 -14.993  -8.191
  499   2HB   ARG  71          HB1       ARG  71   1.006 -14.149  -6.680
  500   1HG   ARG  71          HG2       ARG  71   1.313 -16.718  -5.864
  501   2HG   ARG  71          HG1       ARG  71   1.818 -16.864  -7.549
  502   1HD   ARG  71          HD2       ARG  71   3.338 -14.857  -7.156
  503   2HD   ARG  71          HD1       ARG  71   2.982 -15.037  -5.427
  504    HE   ARG  71           HE       ARG  71   4.210 -17.075  -5.420
  505   1HH1  ARG  71          HH11      ARG  71   5.155 -15.379  -8.038
  506   2HH1  ARG  71          HH12      ARG  71   5.538 -16.729  -9.053
  507   1HH2  ARG  71          HH21      ARG  71   4.040 -19.060  -6.968
  508   2HH2  ARG  71          HH22      ARG  71   4.906 -18.814  -8.447
  509    H    ASN  72           HN       ASN  72   1.031 -14.858  -4.807
  510    HA   ASN  72           HA       ASN  72  -0.946 -14.333  -2.688
  511   1HB   ASN  72          HB2       ASN  72   0.847 -15.761  -2.051
  512   2HB   ASN  72          HB1       ASN  72   2.041 -14.757  -2.876
  513   1HD2  ASN  72          HD21      ASN  72  -0.449 -13.123  -1.078
  514   2HD2  ASN  72          HD22      ASN  72   0.535 -12.646   0.211
  515    H    TYR  73           HN       TYR  73  -1.499 -12.316  -4.153
  516    HA   TYR  73           HA       TYR  73   0.442 -10.087  -3.645
  517   1HB   TYR  73          HB2       TYR  73  -1.847 -10.514  -5.592
  518   2HB   TYR  73          HB1       TYR  73  -0.993  -8.981  -5.436
  519    HD1  TYR  73           HD1      TYR  73  -0.867  -9.985  -8.039
  520    HD2  TYR  73           HD2      TYR  73   1.464 -11.257  -4.660
  521    HE1  TYR  73           HE1      TYR  73   0.900 -10.815  -9.568
  522    HE2  TYR  73           HE2      TYR  73   3.229 -12.085  -6.191
  523    HH   TYR  73           HH       TYR  73   3.857 -11.305  -8.866
  524    H    CYS  74           HN       CYS  74  -0.123  -8.554  -2.174
  525    HA   CYS  74           HA       CYS  74  -2.498  -8.736  -0.551
  526   1HB   CYS  74          HB2       CYS  74  -0.186  -7.821   0.003
  527   2HB   CYS  74          HB1       CYS  74  -0.618  -6.389  -0.930
  528    H    ARG  75           HN       ARG  75  -4.314  -7.324  -0.530
  529    HA   ARG  75           HA       ARG  75  -4.595  -5.242  -2.595
  530   1HB   ARG  75          HB2       ARG  75  -5.418  -7.983  -2.968
  531   2HB   ARG  75          HB1       ARG  75  -6.840  -6.939  -2.961
  532   1HG   ARG  75          HG2       ARG  75  -4.816  -5.611  -4.464
  533   2HG   ARG  75          HG1       ARG  75  -4.898  -7.276  -5.041
  534   1HD   ARG  75          HD2       ARG  75  -7.454  -6.956  -5.123
  535   2HD   ARG  75          HD1       ARG  75  -7.118  -5.221  -4.957
  536    HE   ARG  75           HE       ARG  75  -6.112  -6.929  -7.197
  537   1HH1  ARG  75          HH11      ARG  75  -8.035  -4.325  -6.669
  538   2HH1  ARG  75          HH12      ARG  75  -7.168  -3.212  -7.673
  539   1HH2  ARG  75          HH21      ARG  75  -4.440  -5.310  -8.099
  540   2HH2  ARG  75          HH22      ARG  75  -5.133  -3.770  -8.484
  541    H    ASN  76           HN       ASN  76  -6.637  -4.022  -2.269
  542    HA   ASN  76           HA       ASN  76  -7.857  -4.513   0.428
  543   1HB   ASN  76          HB2       ASN  76  -6.127  -2.592   0.037
  544   2HB   ASN  76          HB1       ASN  76  -7.461  -1.788  -0.789
  545   1HD2  ASN  76          HD21      ASN  76  -7.475  -0.164   0.998
  546   2HD2  ASN  76          HD22      ASN  76  -8.194  -0.555   2.485
  547    HA   PRO  77           HA       PRO  77 -11.166  -4.210  -2.780
  548   1HB   PRO  77          HB2       PRO  77 -12.446  -6.524  -2.090
  549   2HB   PRO  77          HB1       PRO  77 -11.103  -6.472  -3.249
  550   1HG   PRO  77          HG2       PRO  77 -11.123  -7.333  -0.413
  551   2HG   PRO  77          HG1       PRO  77 -10.166  -7.936  -1.774
  552   1HD   PRO  77          HD2       PRO  77  -9.236  -6.225   0.193
  553   2HD   PRO  77          HD1       PRO  77  -8.498  -6.441  -1.408
  554    H    ASP  78           HN       ASP  78 -10.851  -3.713   0.423
  555    HA   ASP  78           HA       ASP  78 -13.797  -3.576   0.954
  556   1HB   ASP  78          HB2       ASP  78 -11.901  -4.885   2.344
  557   2HB   ASP  78          HB1       ASP  78 -11.746  -3.301   3.104
  558    H    ALA  79           HN       ALA  79 -11.088  -1.689   0.210
  559    HA   ALA  79           HA       ALA  79 -10.855   0.665   0.092
  560   1HB   ALA  79          HB1       ALA  79 -13.343   1.438   1.314
  561   2HB   ALA  79          HB2       ALA  79 -13.633   0.067   0.243
  562   3HB   ALA  79          HB3       ALA  79 -12.882   1.534  -0.385
  563    H    GLU  80           HN       GLU  80 -10.117  -0.921   2.505
  564    HA   GLU  80           HA       GLU  80 -10.732   0.839   4.796
  565   1HB   GLU  80          HB2       GLU  80 -10.100  -1.851   4.370
  566   2HB   GLU  80          HB1       GLU  80  -8.657  -1.189   5.139
  567   1HG   GLU  80          HG2       GLU  80  -9.988  -1.801   6.977
  568   2HG   GLU  80          HG1       GLU  80 -10.338  -0.081   6.797
  569    H    ILE  81           HN       ILE  81  -8.552   1.245   6.205
  570    HA   ILE  81           HA       ILE  81  -7.080   3.326   5.139
  571    HB   ILE  81           HB       ILE  81  -5.305   2.593   6.784
  572   1HG1  ILE  81          HG12      ILE  81  -6.418   0.541   8.169
  573   2HG1  ILE  81          HG11      ILE  81  -6.884   0.100   6.526
  574   1HG2  ILE  81          HG21      ILE  81  -8.145   3.055   7.304
  575   2HG2  ILE  81          HG22      ILE  81  -6.728   3.773   8.072
  576   3HG2  ILE  81          HG23      ILE  81  -7.332   2.210   8.620
  577   1HD1  ILE  81          HD11      ILE  81  -4.376  -0.297   7.729
  578   2HD1  ILE  81          HD12      ILE  81  -4.145   1.029   6.589
  579   3HD1  ILE  81          HD13      ILE  81  -4.781  -0.517   6.027
  580    H    SER  82           HN       SER  82  -6.419  -0.138   4.752
  581    HA   SER  82           HA       SER  82  -4.891   0.371   2.299
  582   1HB   SER  82          HB2       SER  82  -3.595   0.387   4.791
  583   2HB   SER  82          HB1       SER  82  -3.260  -1.209   4.124
  584    HG   SER  82           HG       SER  82  -3.065   0.979   2.409
  585    HA   PRO  83           HA       PRO  83  -6.008  -3.790   1.483
  586   1HB   PRO  83          HB2       PRO  83  -3.762  -4.981   0.488
  587   2HB   PRO  83          HB1       PRO  83  -4.674  -3.747  -0.404
  588   1HG   PRO  83          HG2       PRO  83  -2.137  -3.495   1.114
  589   2HG   PRO  83          HG1       PRO  83  -2.647  -2.688  -0.376
  590   1HD   PRO  83          HD2       PRO  83  -2.675  -1.522   2.119
  591   2HD   PRO  83          HD1       PRO  83  -3.678  -0.998   0.750
  592    H    TRP  84           HN       TRP  84  -5.814  -6.042   2.154
  593    HA   TRP  84           HA       TRP  84  -4.044  -6.451   4.544
  594   1HB   TRP  84          HB2       TRP  84  -6.057  -7.934   5.291
  595   2HB   TRP  84          HB1       TRP  84  -6.213  -6.186   5.441
  596    HD1  TRP  84           HD1      TRP  84  -7.515  -4.940   3.341
  597    HE1  TRP  84           HE1      TRP  84  -9.538  -5.776   1.982
  598    HE3  TRP  84           HE3      TRP  84  -7.274  -9.934   4.382
  599    HZ2  TRP  84           HZ2      TRP  84 -10.879  -8.238   1.412
  600    HZ3  TRP  84           HZ3      TRP  84  -8.936 -11.500   3.419
  601    HH2  TRP  84           HH2      TRP  84 -10.736 -10.659   1.937
  602    H    CYS  85           HN       CYS  85  -4.131  -9.073   4.988
  603    HA   CYS  85           HA       CYS  85  -4.370 -10.682   2.573
  604   1HB   CYS  85          HB2       CYS  85  -2.281  -9.012   2.523
  605   2HB   CYS  85          HB1       CYS  85  -1.540 -10.317   3.450
  606    H    TYR  86           HN       TYR  86  -4.295 -12.870   3.097
  607    HA   TYR  86           HA       TYR  86  -4.364 -13.695   5.843
  608   1HB   TYR  86          HB2       TYR  86  -3.748 -15.402   3.418
  609   2HB   TYR  86          HB1       TYR  86  -4.603 -15.883   4.884
  610    HD1  TYR  86           HD1      TYR  86  -5.178 -15.306   1.583
  611    HD2  TYR  86           HD2      TYR  86  -6.579 -13.932   5.404
  612    HE1  TYR  86           HE1      TYR  86  -7.330 -14.632   0.553
  613    HE2  TYR  86           HE2      TYR  86  -8.730 -13.257   4.374
  614    HH   TYR  86           HH       TYR  86  -9.840 -12.979   2.455
  615    H    THR  87           HN       THR  87  -2.743 -15.715   6.378
  616    HA   THR  87           HA       THR  87   0.038 -14.697   5.863
  617    HB   THR  87           HB       THR  87   0.209 -16.199   8.133
  618    HG1  THR  87           HG1      THR  87  -1.789 -16.587   8.642
  619   1HG2  THR  87          HG21      THR  87   0.640 -14.200   9.181
  620   2HG2  THR  87          HG22      THR  87  -0.754 -13.396   8.459
  621   3HG2  THR  87          HG23      THR  87   0.704 -13.661   7.503
  622    H    MET  88           HN       MET  88   1.459 -16.167   4.976
  623    HA   MET  88           HA       MET  88   0.572 -18.704   3.968
  624   1HB   MET  88          HB2       MET  88   2.887 -18.901   3.283
  625   2HB   MET  88          HB1       MET  88   2.422 -17.207   3.121
  626   1HG   MET  88          HG2       MET  88   4.007 -16.585   4.588
  627   2HG   MET  88          HG1       MET  88   3.373 -17.697   5.799
  628   1HE   MET  88          HE1       MET  88   6.977 -18.596   6.074
  629   2HE   MET  88          HE2       MET  88   5.696 -17.470   6.518
  630   3HE   MET  88          HE3       MET  88   6.787 -17.075   5.191
  631    H    ASP  89           HN       ASP  89   1.280 -17.839   7.168
  632    HA   ASP  89           HA       ASP  89   2.299 -20.561   7.824
  633   1HB   ASP  89          HB2       ASP  89   2.717 -17.818   8.779
  634   2HB   ASP  89          HB1       ASP  89   2.420 -18.960  10.091
  635    HA   PRO  90           HA       PRO  90  -1.652 -21.471   9.532
  636   1HB   PRO  90          HB2       PRO  90  -0.893 -23.585  11.101
  637   2HB   PRO  90          HB1       PRO  90  -1.043 -23.695   9.336
  638   1HG   PRO  90          HG2       PRO  90   1.394 -23.389  11.013
  639   2HG   PRO  90          HG1       PRO  90   1.154 -24.324   9.528
  640   1HD   PRO  90          HD2       PRO  90   2.410 -21.889   9.611
  641   2HD   PRO  90          HD1       PRO  90   1.576 -22.525   8.176
  642    H    ASN  91           HN       ASN  91   0.878 -20.057  11.164
  643    HA   ASN  91           HA       ASN  91  -0.308 -20.238  13.873
  644   1HB   ASN  91          HB2       ASN  91   2.241 -19.536  12.596
  645   2HB   ASN  91          HB1       ASN  91   1.792 -18.417  13.884
  646   1HD2  ASN  91          HD21      ASN  91   3.330 -21.369  13.317
  647   2HD2  ASN  91          HD22      ASN  91   3.220 -22.019  14.881
  648    H    VAL  92           HN       VAL  92  -0.601 -18.347  11.063
  649    HA   VAL  92           HA       VAL  92  -1.818 -16.114  12.645
  650    HB   VAL  92           HB       VAL  92  -0.172 -16.025  10.086
  651   1HG1  VAL  92          HG11      VAL  92  -1.678 -13.953  11.684
  652   2HG1  VAL  92          HG12      VAL  92  -1.663 -14.206   9.939
  653   3HG1  VAL  92          HG13      VAL  92  -0.262 -13.495  10.739
  654   1HG2  VAL  92          HG21      VAL  92   0.837 -14.506  12.341
  655   2HG2  VAL  92          HG22      VAL  92   1.636 -15.777  11.416
  656   3HG2  VAL  92          HG23      VAL  92   0.621 -16.196  12.796
  657    H    ARG  93           HN       ARG  93  -3.881 -15.563  11.947
  658    HA   ARG  93           HA       ARG  93  -5.152 -17.174   9.896
  659   1HB   ARG  93          HB2       ARG  93  -5.874 -15.151  11.952
  660   2HB   ARG  93          HB1       ARG  93  -6.971 -15.290  10.578
  661   1HG   ARG  93          HG2       ARG  93  -6.032 -17.692  12.160
  662   2HG   ARG  93          HG1       ARG  93  -7.499 -16.800  12.565
  663   1HD   ARG  93          HD2       ARG  93  -8.503 -17.314  10.434
  664   2HD   ARG  93          HD1       ARG  93  -6.977 -17.977   9.814
  665    HE   ARG  93           HE       ARG  93  -7.397 -19.469  12.084
  666   1HH1  ARG  93          HH11      ARG  93 -10.307 -18.575  11.199
  667   2HH1  ARG  93          HH12      ARG  93 -10.820 -20.043  10.436
  668   1HH2  ARG  93          HH21      ARG  93  -7.633 -21.403  10.308
  669   2HH2  ARG  93          HH22      ARG  93  -9.306 -21.645   9.933
  670    H    TRP  94           HN       TRP  94  -4.756 -13.653  10.353
  671    HA   TRP  94           HA       TRP  94  -3.996 -13.256   7.553
  672   1HB   TRP  94          HB2       TRP  94  -5.992 -12.032   6.934
  673   2HB   TRP  94          HB1       TRP  94  -6.516 -13.575   7.609
  674    HD1  TRP  94           HD1      TRP  94  -7.814 -13.561   9.870
  675    HE1  TRP  94           HE1      TRP  94  -8.817 -11.684  11.325
  676    HE3  TRP  94           HE3      TRP  94  -5.610  -9.495   7.705
  677    HZ2  TRP  94           HZ2      TRP  94  -8.700  -8.832  11.539
  678    HZ3  TRP  94           HZ3      TRP  94  -6.072  -7.213   8.553
  679    HH2  TRP  94           HH2      TRP  94  -7.613  -6.876  10.466
  680    H    GLU  95           HN       GLU  95  -3.694 -10.798   7.162
  681    HA   GLU  95           HA       GLU  95  -3.601  -9.101   9.556
  682   1HB   GLU  95          HB2       GLU  95  -1.234 -10.579   8.477
  683   2HB   GLU  95          HB1       GLU  95  -0.978  -8.947   9.097
  684   1HG   GLU  95          HG2       GLU  95  -2.514  -9.936  11.084
  685   2HG   GLU  95          HG1       GLU  95  -1.736 -11.427  10.550
  686    H    TYR  96           HN       TYR  96  -2.941  -6.904   9.023
  687    HA   TYR  96           HA       TYR  96  -3.653  -6.099   6.328
  688   1HB   TYR  96          HB2       TYR  96  -2.936  -4.897   8.940
  689   2HB   TYR  96          HB1       TYR  96  -2.581  -3.897   7.530
  690    HD1  TYR  96           HD1      TYR  96  -5.000  -4.427   9.906
  691    HD2  TYR  96           HD2      TYR  96  -4.597  -4.223   5.634
  692    HE1  TYR  96           HE1      TYR  96  -7.405  -3.854   9.706
  693    HE2  TYR  96           HE2      TYR  96  -7.001  -3.649   5.435
  694    HH   TYR  96           HH       TYR  96  -9.185  -4.213   7.322
  695    H    CYS  97           HN       CYS  97  -2.140  -4.657   5.027
  696    HA   CYS  97           HA       CYS  97   0.562  -5.902   4.944
  697   1HB   CYS  97          HB2       CYS  97  -1.272  -4.453   3.060
  698   2HB   CYS  97          HB1       CYS  97   0.453  -4.519   2.695
  699    H    ASN  98           HN       ASN  98   2.397  -4.724   5.377
  700    HA   ASN  98           HA       ASN  98   2.384  -2.337   6.865
  701   1HB   ASN  98          HB2       ASN  98   4.338  -3.826   5.152
  702   2HB   ASN  98          HB1       ASN  98   4.801  -2.233   5.750
  703   1HD2  ASN  98          HD21      ASN  98   5.780  -5.008   6.569
  704   2HD2  ASN  98          HD22      ASN  98   5.554  -5.060   8.251
  705    H    LEU  99           HN       LEU  99   0.831  -0.916   5.722
  706    HA   LEU  99           HA       LEU  99   2.164   0.580   3.501
  707   1HB   LEU  99          HB2       LEU  99  -0.662  -0.511   3.625
  708   2HB   LEU  99          HB1       LEU  99  -0.101   0.624   2.396
  709    HG   LEU  99           HG       LEU  99   1.291  -2.005   2.928
  710   1HD1  LEU  99          HD11      LEU  99   0.080  -2.730   0.803
  711   2HD1  LEU  99          HD12      LEU  99  -0.985  -1.346   1.045
  712   3HD1  LEU  99          HD13      LEU  99  -0.919  -2.631   2.253
  713   1HD2  LEU  99          HD21      LEU  99   2.183  -1.585   0.658
  714   2HD2  LEU  99          HD22      LEU  99   2.573  -0.257   1.751
  715   3HD2  LEU  99          HD23      LEU  99   1.265  -0.081   0.581
  716    H    THR 100           HN       THR 100   1.939   2.782   3.696
  717    HA   THR 100           HA       THR 100   0.154   3.810   5.869
  718    HB   THR 100           HB       THR 100   1.807   5.564   6.098
  719    HG1  THR 100           HG1      THR 100   3.633   5.540   4.699
  720   1HG2  THR 100          HG21      THR 100   2.235   3.176   6.999
  721   2HG2  THR 100          HG22      THR 100   3.600   4.291   6.952
  722   3HG2  THR 100          HG23      THR 100   3.428   3.056   5.705
  723    H    GLN 101           HN       GLN 101  -0.870   5.915   5.393
  724    HA   GLN 101           HA       GLN 101  -1.961   6.068   2.718
  725   1HB   GLN 101          HB2       GLN 101  -2.826   6.839   5.088
  726   2HB   GLN 101          HB1       GLN 101  -1.979   8.336   4.693
  727   1HG   GLN 101          HG2       GLN 101  -3.243   8.402   2.522
  728   2HG   GLN 101          HG1       GLN 101  -4.178   7.015   3.079
  729   1HE2  GLN 101          HE21      GLN 101  -6.173   8.296   3.155
  730   2HE2  GLN 101          HE22      GLN 101  -6.423   9.457   4.368
  731    H    CYS 102           HN       CYS 102  -0.077   6.317   1.302
  732    HA   CYS 102           HA       CYS 102   2.036   8.072   1.508
  733   1HB   CYS 102          HB2       CYS 102   0.621   6.631  -0.521
  734   2HB   CYS 102          HB1       CYS 102   1.044   8.221  -1.159
  735    HA   PRO 103           HA       PRO 103  -0.384  11.866   1.801
  736   1HB   PRO 103          HB2       PRO 103   1.676  13.377   2.784
  737   2HB   PRO 103          HB1       PRO 103   0.693  12.305   3.801
  738   1HG   PRO 103          HG2       PRO 103   3.409  11.876   2.670
  739   2HG   PRO 103          HG1       PRO 103   2.752  11.402   4.244
  740   1HD   PRO 103          HD2       PRO 103   3.058   9.682   2.139
  741   2HD   PRO 103          HD1       PRO 103   1.856   9.465   3.430
  742    H    VAL 104           HN       VAL 104  -0.414  13.712   0.435
  743    HA   VAL 104           HA       VAL 104   1.005  13.542  -2.059
  744    HB   VAL 104           HB       VAL 104  -1.264  14.622  -1.349
  745   1HG1  VAL 104          HG11      VAL 104   0.384  16.246   0.132
  746   2HG1  VAL 104          HG12      VAL 104  -1.268  16.649  -0.335
  747   3HG1  VAL 104          HG13      VAL 104   0.088  17.233  -1.300
  748   1HG2  VAL 104          HG21      VAL 104   0.374  14.885  -3.568
  749   2HG2  VAL 104          HG22      VAL 104   0.000  16.555  -3.144
  750   3HG2  VAL 104          HG23      VAL 104  -1.305  15.413  -3.466
  751    H    THR 105           HN       THR 105   1.853  16.139  -2.585
  752    HA   THR 105           HA       THR 105   4.233  16.400  -0.782
  753    HB   THR 105           HB       THR 105   4.457  15.685  -3.225
  754    HG1  THR 105           HG1      THR 105   5.673  18.060  -2.276
  755   1HG2  THR 105          HG21      THR 105   3.913  18.596  -3.802
  756   2HG2  THR 105          HG22      THR 105   2.646  17.375  -3.922
  757   3HG2  THR 105          HG23      THR 105   4.077  17.266  -4.949
  758    H    GLU 106           HN       GLU 106   4.292  18.273   0.398
  759    HA   GLU 106           HA       GLU 106   3.708  20.447   1.134
  760   1HB   GLU 106          HB2       GLU 106   4.961  20.490  -1.272
  761   2HB   GLU 106          HB1       GLU 106   3.456  21.303  -1.702
  762   1HG   GLU 106          HG2       GLU 106   4.413  23.177  -0.871
  763   2HG   GLU 106          HG1       GLU 106   4.121  22.472   0.719
  764    H    SER 107           HN       SER 107   1.532  19.693   1.832
  765    HA   SER 107           HA       SER 107  -0.751  19.909   0.036
  766   1HB   SER 107          HB2       SER 107  -1.955  19.650   2.269
  767   2HB   SER 107          HB1       SER 107  -0.797  18.378   1.890
  768    HG   SER 107           HG       SER 107  -0.493  20.600   3.622
  769    H    SER 108           HN       SER 108  -1.534  21.873  -0.627
  770    HA   SER 108           HA       SER 108  -1.892  24.037   1.361
  771   1HB   SER 108          HB2       SER 108  -0.403  24.590  -1.204
  772   2HB   SER 108          HB1       SER 108  -0.467  25.570   0.258
  773    HG   SER 108           HG       SER 108   1.415  23.978  -0.314
  774    H    VAL 109           HN       VAL 109  -2.940  25.998   0.124
  775    HA   VAL 109           HA       VAL 109  -4.583  25.109  -2.198
  776    HB   VAL 109           HB       VAL 109  -6.610  25.936  -0.948
  777   1HG1  VAL 109          HG11      VAL 109  -6.717  23.964   0.600
  778   2HG1  VAL 109          HG12      VAL 109  -5.002  23.686   0.296
  779   3HG1  VAL 109          HG13      VAL 109  -6.165  23.547  -1.023
  780   1HG2  VAL 109          HG21      VAL 109  -4.552  26.801   0.863
  781   2HG2  VAL 109          HG22      VAL 109  -5.612  25.671   1.705
  782   3HG2  VAL 109          HG23      VAL 109  -6.285  27.114   0.945
  783    H    LEU 110           HN       LEU 110  -6.310  27.382  -2.113
  784    HA   LEU 110           HA       LEU 110  -4.494  29.440  -3.148
  785   1HB   LEU 110          HB2       LEU 110  -6.596  30.505  -3.794
  786   2HB   LEU 110          HB1       LEU 110  -6.703  28.779  -4.143
  787    HG   LEU 110           HG       LEU 110  -7.551  29.053  -1.475
  788   1HD1  LEU 110          HD11      LEU 110  -7.765  31.549  -2.371
  789   2HD1  LEU 110          HD12      LEU 110  -9.020  30.840  -1.355
  790   3HD1  LEU 110          HD13      LEU 110  -9.238  30.913  -3.103
  791   1HD2  LEU 110          HD21      LEU 110  -8.902  28.570  -4.128
  792   2HD2  LEU 110          HD22      LEU 110  -9.834  28.588  -2.631
  793   3HD2  LEU 110          HD23      LEU 110  -8.540  27.410  -2.850
  794    H    ALA 111           HN       ALA 111  -5.540  31.819  -2.411
  795    HA   ALA 111           HA       ALA 111  -5.380  31.848   0.587
  796   1HB   ALA 111          HB1       ALA 111  -4.050  33.503  -1.557
  797   2HB   ALA 111          HB2       ALA 111  -3.304  32.655  -0.203
  798   3HB   ALA 111          HB3       ALA 111  -4.230  34.129   0.081
  799    H    THR 112           HN       THR 112  -6.093  34.194  -2.035
  800    HA   THR 112           HA       THR 112  -8.793  34.634  -0.850
  801    HB   THR 112           HB       THR 112  -8.066  37.183  -1.200
  802    HG1  THR 112           HG1      THR 112  -6.022  37.336  -1.558
  803   1HG2  THR 112          HG21      THR 112  -8.487  35.543   0.951
  804   2HG2  THR 112          HG22      THR 112  -8.128  37.266   1.069
  805   3HG2  THR 112          HG23      THR 112  -6.833  36.082   1.241
  806    H    SER 113           HN       SER 113 -10.238  34.660  -2.518
  807    HA   SER 113           HA       SER 113  -9.377  34.743  -5.293
  808   1HB   SER 113          HB2       SER 113 -11.871  34.628  -5.639
  809   2HB   SER 113          HB1       SER 113 -11.251  33.390  -4.551
  810    HG   SER 113           HG       SER 113 -12.617  34.181  -3.173
  811    H    THR 114           HN       THR 114 -11.977  36.748  -3.906
  812    HA   THR 114           HA       THR 114 -10.692  39.152  -5.157
  813    HB   THR 114           HB       THR 114 -13.537  38.122  -5.309
  814    HG1  THR 114           HG1      THR 114 -12.491  37.323  -6.984
  815   1HG2  THR 114          HG21      THR 114 -13.745  40.298  -6.771
  816   2HG2  THR 114          HG22      THR 114 -12.409  40.865  -5.769
  817   3HG2  THR 114          HG23      THR 114 -13.937  40.400  -5.021
  818    H    ALA 115           HN       ALA 115 -13.470  38.243  -3.067
  819    HA   ALA 115           HA       ALA 115 -12.519  40.236  -1.058
  820   1HB   ALA 115          HB1       ALA 115 -14.075  41.417  -2.499
  821   2HB   ALA 115          HB2       ALA 115 -14.897  41.084  -0.975
  822   3HB   ALA 115          HB3       ALA 115 -15.239  40.096  -2.395
  823    H    VAL 116           HN       VAL 116 -15.378  38.139  -1.620
  824    HA   VAL 116           HA       VAL 116 -15.549  37.372   1.175
  825    HB   VAL 116           HB       VAL 116 -17.416  36.078   0.395
  826   1HG1  VAL 116          HG11      VAL 116 -17.055  38.762  -0.297
  827   2HG1  VAL 116          HG12      VAL 116 -18.590  37.895  -0.250
  828   3HG1  VAL 116          HG13      VAL 116 -17.693  38.017  -1.763
  829   1HG2  VAL 116          HG21      VAL 116 -17.613  35.896  -2.231
  830   2HG2  VAL 116          HG22      VAL 116 -16.627  34.733  -1.345
  831   3HG2  VAL 116          HG23      VAL 116 -15.860  36.086  -2.176
  832    H    SER 117           HN       SER 117 -15.702  34.832   1.572
  833    HA   SER 117           HA       SER 117 -13.058  33.722   0.828
  834   1HB   SER 117          HB2       SER 117 -14.576  33.798   3.120
  835   2HB   SER 117          HB1       SER 117 -14.916  32.177   2.522
  836    HG   SER 117           HG       SER 117 -12.436  32.276   2.195
  837    H    GLU 118           HN       GLU 118 -12.859  32.181  -0.757
  838    HA   GLU 118           HA       GLU 118 -15.237  31.187  -2.153
  839   1HB   GLU 118          HB2       GLU 118 -12.883  31.882  -3.037
  840   2HB   GLU 118          HB1       GLU 118 -12.389  30.266  -2.531
  841   1HG   GLU 118          HG2       GLU 118 -14.685  29.680  -3.869
  842   2HG   GLU 118          HG1       GLU 118 -14.135  31.089  -4.777
  843    H    GLN 119           HN       GLN 119 -15.964  30.082   0.000
  844    HA   GLN 119           HA       GLN 119 -14.555  27.743   0.944
  845   1HB   GLN 119          HB2       GLN 119 -16.928  29.281   1.488
  846   2HB   GLN 119          HB1       GLN 119 -17.345  27.567   1.460
  847   1HG   GLN 119          HG2       GLN 119 -14.846  27.894   2.838
  848   2HG   GLN 119          HG1       GLN 119 -16.035  28.995   3.536
  849   1HE2  GLN 119          HE21      GLN 119 -15.082  25.660   3.295
  850   2HE2  GLN 119          HE22      GLN 119 -16.375  25.012   4.183
  Start of MODEL    5
    1   1H    ALA   1          HT1       ALA   1  42.096   2.752   2.796
    2   2H    ALA   1          HT2       ALA   1  42.863   3.302   1.383
    3   3H    ALA   1          HT3       ALA   1  42.300   1.701   1.481
    4    HA   ALA   1           HA       ALA   1  40.919   3.561   0.236
    5   1HB   ALA   1          HB1       ALA   1  38.921   2.070   1.147
    6   2HB   ALA   1          HB2       ALA   1  40.231   1.165   1.906
    7   3HB   ALA   1          HB3       ALA   1  40.188   1.350   0.153
    8    H    ARG   2           HN       ARG   2  40.227   2.824   3.682
    9    HA   ARG   2           HA       ARG   2  38.866   5.490   3.873
   10   1HB   ARG   2          HB2       ARG   2  37.591   4.424   5.682
   11   2HB   ARG   2          HB1       ARG   2  37.520   3.418   4.234
   12   1HG   ARG   2          HG2       ARG   2  38.963   1.812   5.112
   13   2HG   ARG   2          HG1       ARG   2  39.703   2.948   6.241
   14   1HD   ARG   2          HD2       ARG   2  38.173   1.295   7.371
   15   2HD   ARG   2          HD1       ARG   2  37.649   2.976   7.598
   16    HE   ARG   2           HE       ARG   2  36.411   2.186   5.236
   17   1HH1  ARG   2          HH11      ARG   2  36.813   0.045   7.778
   18   2HH1  ARG   2          HH12      ARG   2  35.124  -0.205   8.072
   19   1HH2  ARG   2          HH21      ARG   2  34.106   2.307   5.908
   20   2HH2  ARG   2          HH22      ARG   2  33.591   1.076   7.012
   21    H    ILE   3           HN       ILE   3  41.695   5.414   4.079
   22    HA   ILE   3           HA       ILE   3  42.120   5.791   7.027
   23    HB   ILE   3           HB       ILE   3  43.293   3.884   5.797
   24   1HG1  ILE   3          HG12      ILE   3  45.145   5.989   6.952
   25   2HG1  ILE   3          HG11      ILE   3  44.096   4.972   7.940
   26   1HG2  ILE   3          HG21      ILE   3  45.084   4.413   4.294
   27   2HG2  ILE   3          HG22      ILE   3  44.957   6.136   4.647
   28   3HG2  ILE   3          HG23      ILE   3  43.683   5.327   3.734
   29   1HD1  ILE   3          HD11      ILE   3  46.653   4.304   7.192
   30   2HD1  ILE   3          HD12      ILE   3  45.691   3.482   5.963
   31   3HD1  ILE   3          HD13      ILE   3  45.415   3.144   7.672
   32    H    HIS   4           HN       HIS   4  42.127   7.274   3.922
   33    HA   HIS   4           HA       HIS   4  43.675   9.609   5.000
   34   1HB   HIS   4          HB2       HIS   4  44.316  10.019   2.708
   35   2HB   HIS   4          HB1       HIS   4  44.557   8.298   3.012
   36    HD1  HIS   4           HD1      HIS   4  43.003   6.638   1.806
   37    HD2  HIS   4           HD2      HIS   4  42.085  10.624   1.006
   38    HE1  HIS   4           HE1      HIS   4  41.355   6.621  -0.117
   39    H    HIS   5           HN       HIS   5  40.671   8.535   3.534
   40    HA   HIS   5           HA       HIS   5  39.272  10.937   4.334
   41   1HB   HIS   5          HB2       HIS   5  40.814  11.421   2.226
   42   2HB   HIS   5          HB1       HIS   5  39.478  10.668   1.355
   43    HD1  HIS   5           HD1      HIS   5  37.727  12.283   0.650
   44    HD2  HIS   5           HD2      HIS   5  39.664  13.558   4.114
   45    HE1  HIS   5           HE1      HIS   5  36.705  14.518   1.260
   46    H    HIS   6           HN       HIS   6  37.168  10.293   4.596
   47    HA   HIS   6           HA       HIS   6  36.155   8.047   2.880
   48   1HB   HIS   6          HB2       HIS   6  34.821   7.482   4.979
   49   2HB   HIS   6          HB1       HIS   6  36.564   7.251   5.116
   50    HD1  HIS   6           HD1      HIS   6  34.158  10.176   5.670
   51    HD2  HIS   6           HD2      HIS   6  37.495   8.404   7.433
   52    HE1  HIS   6           HE1      HIS   6  34.660  11.516   7.760
   53    H    HIS   7           HN       HIS   7  35.803  10.728   2.097
   54    HA   HIS   7           HA       HIS   7  33.217  11.721   3.066
   55   1HB   HIS   7          HB2       HIS   7  35.309  13.006   2.228
   56   2HB   HIS   7          HB1       HIS   7  34.736  12.604   0.609
   57    HD1  HIS   7           HD1      HIS   7  32.363  13.354   3.433
   58    HD2  HIS   7           HD2      HIS   7  33.852  15.235   0.023
   59    HE1  HIS   7           HE1      HIS   7  30.967  15.440   3.098
   60    H    HIS   8           HN       HIS   8  34.456  10.110   0.132
   61    HA   HIS   8           HA       HIS   8  33.281   9.203  -1.720
   62   1HB   HIS   8          HB2       HIS   8  32.304   8.294   0.807
   63   2HB   HIS   8          HB1       HIS   8  30.921   8.439  -0.279
   64    HD1  HIS   8           HD1      HIS   8  34.247   6.683   0.053
   65    HD2  HIS   8           HD2      HIS   8  30.874   6.576  -2.394
   66    HE1  HIS   8           HE1      HIS   8  34.484   4.625  -1.404
   67    H    HIS   9           HN       HIS   9  30.705   9.119  -2.511
   68    HA   HIS   9           HA       HIS   9  29.233  11.584  -1.975
   69   1HB   HIS   9          HB2       HIS   9  31.247  12.258  -3.361
   70   2HB   HIS   9          HB1       HIS   9  30.601  11.259  -4.662
   71    HD1  HIS   9           HD1      HIS   9  29.884  14.398  -2.704
   72    HD2  HIS   9           HD2      HIS   9  28.358  12.351  -5.999
   73    HE1  HIS   9           HE1      HIS   9  28.219  15.956  -3.805
   74    H    ILE  10           HN       ILE  10  28.177   9.125  -1.777
   75    HA   ILE  10           HA       ILE  10  26.958   8.337  -4.368
   76    HB   ILE  10           HB       ILE  10  27.961   6.749  -2.649
   77   1HG1  ILE  10          HG12      ILE  10  25.036   6.431  -3.401
   78   2HG1  ILE  10          HG11      ILE  10  26.423   5.933  -4.370
   79   1HG2  ILE  10          HG21      ILE  10  25.419   7.453  -1.150
   80   2HG2  ILE  10          HG22      ILE  10  27.040   7.955  -0.670
   81   3HG2  ILE  10          HG23      ILE  10  26.612   6.244  -0.673
   82   1HD1  ILE  10          HD11      ILE  10  25.304   4.086  -3.007
   83   2HD1  ILE  10          HD12      ILE  10  25.941   4.890  -1.572
   84   3HD1  ILE  10          HD13      ILE  10  27.047   4.252  -2.790
   85    H    GLU  11           HN       GLU  11  26.004   9.551  -1.155
   86    HA   GLU  11           HA       GLU  11  23.187   9.831  -2.080
   87   1HB   GLU  11          HB2       GLU  11  24.504   9.164   0.327
   88   2HB   GLU  11          HB1       GLU  11  23.771  10.744   0.608
   89   1HG   GLU  11          HG2       GLU  11  22.322   8.314  -0.484
   90   2HG   GLU  11          HG1       GLU  11  22.203   8.916   1.170
   91    H    GLY  12           HN       GLY  12  24.709  11.589  -3.495
   92   1HA   GLY  12          HA2       GLY  12  24.986  14.140  -2.086
   93   2HA   GLY  12          HA1       GLY  12  25.260  13.872  -3.808
   94    H    ARG  13           HN       ARG  13  23.808  16.100  -2.845
   95    HA   ARG  13           HA       ARG  13  21.048  15.447  -3.829
   96   1HB   ARG  13          HB2       ARG  13  22.061  16.720  -1.390
   97   2HB   ARG  13          HB1       ARG  13  20.859  17.708  -2.220
   98   1HG   ARG  13          HG2       ARG  13  19.180  16.125  -1.969
   99   2HG   ARG  13          HG1       ARG  13  20.319  14.781  -1.876
  100   1HD   ARG  13          HD2       ARG  13  20.541  14.983   0.387
  101   2HD   ARG  13          HD1       ARG  13  20.594  16.756   0.310
  102    HE   ARG  13           HE       ARG  13  17.968  15.712  -0.373
  103   1HH1  ARG  13          HH11      ARG  13  20.122  16.248   2.263
  104   2HH1  ARG  13          HH12      ARG  13  18.867  16.688   3.373
  105   1HH2  ARG  13          HH21      ARG  13  16.329  16.407   1.029
  106   2HH2  ARG  13          HH22      ARG  13  16.721  16.777   2.675
  107    H    ALA  14           HN       ALA  14  22.976  16.197  -5.677
  108    HA   ALA  14           HA       ALA  14  23.425  18.952  -6.121
  109   1HB   ALA  14          HB1       ALA  14  24.581  17.685  -7.633
  110   2HB   ALA  14          HB2       ALA  14  23.139  17.883  -8.629
  111   3HB   ALA  14          HB3       ALA  14  23.346  16.426  -7.657
  112    HA   PRO  15           HA       PRO  15  19.377  19.161  -8.645
  113   1HB   PRO  15          HB2       PRO  15  17.773  16.944  -8.715
  114   2HB   PRO  15          HB1       PRO  15  19.084  17.224  -9.880
  115   1HG   PRO  15          HG2       PRO  15  19.033  15.473  -7.472
  116   2HG   PRO  15          HG1       PRO  15  19.769  15.191  -9.058
  117   1HD   PRO  15          HD2       PRO  15  21.185  15.952  -6.854
  118   2HD   PRO  15          HD1       PRO  15  21.677  16.328  -8.520
  119    H    THR  16           HN       THR  16  16.856  19.000  -8.024
  120    HA   THR  16           HA       THR  16  16.697  19.092  -5.028
  121    HB   THR  16           HB       THR  16  14.667  20.524  -6.599
  122    HG1  THR  16           HG1      THR  16  17.347  21.424  -6.706
  123   1HG2  THR  16          HG21      THR  16  16.187  22.266  -5.003
  124   2HG2  THR  16          HG22      THR  16  16.154  20.737  -4.125
  125   3HG2  THR  16          HG23      THR  16  14.644  21.524  -4.586
  126    H    GLU  17           HN       GLU  17  14.937  18.261  -8.014
  127    HA   GLU  17           HA       GLU  17  12.569  17.268  -6.836
  128   1HB   GLU  17          HB2       GLU  17  14.111  16.679  -9.364
  129   2HB   GLU  17          HB1       GLU  17  12.561  15.906  -9.032
  130   1HG   GLU  17          HG2       GLU  17  11.652  17.744 -10.007
  131   2HG   GLU  17          HG1       GLU  17  12.014  18.547  -8.479
  132    H    GLN  18           HN       GLN  18  12.448  15.617  -5.364
  133    HA   GLN  18           HA       GLN  18  13.778  13.085  -5.892
  134   1HB   GLN  18          HB2       GLN  18  14.768  15.116  -3.997
  135   2HB   GLN  18          HB1       GLN  18  14.635  13.494  -3.315
  136   1HG   GLN  18          HG2       GLN  18  16.382  12.728  -4.529
  137   2HG   GLN  18          HG1       GLN  18  15.795  13.498  -6.004
  138   1HE2  GLN  18          HE21      GLN  18  16.484  15.244  -2.970
  139   2HE2  GLN  18          HE22      GLN  18  17.785  16.141  -3.589
  140    H    SER  19           HN       SER  19  11.028  13.919  -5.644
  141    HA   SER  19           HA       SER  19   9.786  13.583  -3.159
  142   1HB   SER  19          HB2       SER  19   9.056  13.827  -5.790
  143   2HB   SER  19          HB1       SER  19   8.541  12.179  -5.444
  144    HG   SER  19           HG       SER  19   7.001  13.919  -4.958
  145    HA   PRO  20           HA       PRO  20  11.054   9.414  -2.225
  146   1HB   PRO  20          HB2       PRO  20   9.662   9.198   0.122
  147   2HB   PRO  20          HB1       PRO  20  11.191  10.089  -0.017
  148   1HG   PRO  20          HG2       PRO  20   8.400  11.119   0.047
  149   2HG   PRO  20          HG1       PRO  20   9.868  11.790   0.774
  150   1HD   PRO  20          HD2       PRO  20   8.759  12.732  -1.537
  151   2HD   PRO  20          HD1       PRO  20  10.489  12.859  -1.151
  152    H    GLY  21           HN       GLY  21  10.088   7.416  -2.645
  153   1HA   GLY  21          HA2       GLY  21   7.754   7.129  -4.091
  154   2HA   GLY  21          HA1       GLY  21   8.369   5.846  -3.046
  155    H    VAL  22           HN       VAL  22   5.921   8.239  -3.439
  156    HA   VAL  22           HA       VAL  22   4.518   7.188  -1.052
  157    HB   VAL  22           HB       VAL  22   6.064   9.109  -0.408
  158   1HG1  VAL  22          HG11      VAL  22   5.734  10.415  -2.490
  159   2HG1  VAL  22          HG12      VAL  22   5.343  11.367  -1.058
  160   3HG1  VAL  22          HG13      VAL  22   4.049  10.683  -2.042
  161   1HG2  VAL  22          HG21      VAL  22   3.123   8.958   0.040
  162   2HG2  VAL  22          HG22      VAL  22   3.930  10.434   0.571
  163   3HG2  VAL  22          HG23      VAL  22   4.444   8.871   1.206
  164    H    GLN  23           HN       GLN  23   2.308   7.191  -1.414
  165    HA   GLN  23           HA       GLN  23   0.837   9.087  -2.907
  166   1HB   GLN  23          HB2       GLN  23   0.525   7.626  -4.986
  167   2HB   GLN  23          HB1       GLN  23   2.103   8.394  -4.825
  168   1HG   GLN  23          HG2       GLN  23   2.924   6.276  -3.715
  169   2HG   GLN  23          HG1       GLN  23   1.385   5.530  -4.148
  170   1HE2  GLN  23          HE21      GLN  23   0.930   5.212  -6.465
  171   2HE2  GLN  23          HE22      GLN  23   2.183   5.250  -7.609
  172    H    ASP  24           HN       ASP  24  -0.076   8.147  -0.695
  173    HA   ASP  24           HA       ASP  24  -1.505   5.587  -0.955
  174   1HB   ASP  24          HB2       ASP  24  -2.214   6.180   1.356
  175   2HB   ASP  24          HB1       ASP  24  -0.468   6.323   1.152
  176    H    CYS  25           HN       CYS  25  -3.307   5.638  -2.268
  177    HA   CYS  25           HA       CYS  25  -5.505   7.477  -1.577
  178   1HB   CYS  25          HB2       CYS  25  -3.656   8.357  -3.376
  179   2HB   CYS  25          HB1       CYS  25  -4.832   7.587  -4.439
  180    H    TYR  26           HN       TYR  26  -7.495   6.816  -2.484
  181    HA   TYR  26           HA       TYR  26  -7.620   4.581  -4.386
  182   1HB   TYR  26          HB2       TYR  26  -8.535   2.983  -2.846
  183   2HB   TYR  26          HB1       TYR  26  -7.092   3.635  -2.070
  184    HD1  TYR  26           HD1      TYR  26  -7.232   4.684   0.033
  185    HD2  TYR  26           HD2      TYR  26 -10.802   4.061  -2.266
  186    HE1  TYR  26           HE1      TYR  26  -8.601   5.425   1.964
  187    HE2  TYR  26           HE2      TYR  26 -12.172   4.803  -0.336
  188    HH   TYR  26           HH       TYR  26 -11.671   4.800   2.382
  189    H    HIS  27           HN       HIS  27  -9.811   4.296  -5.171
  190    HA   HIS  27           HA       HIS  27 -11.584   6.597  -4.484
  191   1HB   HIS  27          HB2       HIS  27 -10.741   6.143  -6.839
  192   2HB   HIS  27          HB1       HIS  27 -11.708   4.668  -6.823
  193    HD1  HIS  27           HD1      HIS  27 -11.938   8.272  -7.428
  194    HD2  HIS  27           HD2      HIS  27 -14.591   5.219  -6.425
  195    HE1  HIS  27           HE1      HIS  27 -14.263   9.164  -7.890
  196    H    GLY  28           HN       GLY  28 -13.780   6.194  -3.911
  197   1HA   GLY  28          HA2       GLY  28 -15.620   4.954  -3.125
  198   2HA   GLY  28          HA1       GLY  28 -14.941   3.545  -3.943
  199    H    ASP  29           HN       ASP  29 -14.007   1.995  -2.694
  200    HA   ASP  29           HA       ASP  29 -13.052   2.706   0.022
  201   1HB   ASP  29          HB2       ASP  29 -15.431   1.156  -0.730
  202   2HB   ASP  29          HB1       ASP  29 -14.381   0.321   0.416
  203    H    GLY  30           HN       GLY  30 -11.360   2.233  -2.027
  204   1HA   GLY  30          HA2       GLY  30  -9.439   0.899  -2.397
  205   2HA   GLY  30          HA1       GLY  30 -10.038  -0.236  -1.181
  206    H    GLN  31           HN       GLN  31 -12.653   0.278  -3.043
  207    HA   GLN  31           HA       GLN  31 -12.394  -2.290  -4.417
  208   1HB   GLN  31          HB2       GLN  31 -14.409  -0.237  -3.815
  209   2HB   GLN  31          HB1       GLN  31 -14.632  -0.980  -5.399
  210   1HG   GLN  31          HG2       GLN  31 -14.282  -3.231  -4.153
  211   2HG   GLN  31          HG1       GLN  31 -14.611  -2.301  -2.691
  212   1HE2  GLN  31          HE21      GLN  31 -16.486  -4.214  -3.195
  213   2HE2  GLN  31          HE22      GLN  31 -17.906  -3.540  -3.837
  214    H    SER  32           HN       SER  32 -11.626  -2.583  -6.478
  215    HA   SER  32           HA       SER  32 -10.988  -2.081  -8.705
  216   1HB   SER  32          HB2       SER  32 -13.321  -0.873  -8.367
  217   2HB   SER  32          HB1       SER  32 -12.337   0.587  -8.405
  218    HG   SER  32           HG       SER  32 -11.499  -0.156 -10.413
  219    H    TYR  33           HN       TYR  33  -9.500  -1.108  -6.209
  220    HA   TYR  33           HA       TYR  33  -8.333   1.376  -6.310
  221   1HB   TYR  33          HB2       TYR  33  -7.670  -0.280  -4.699
  222   2HB   TYR  33          HB1       TYR  33  -7.089  -1.364  -5.963
  223    HD1  TYR  33           HD1      TYR  33  -6.565   2.139  -4.723
  224    HD2  TYR  33           HD2      TYR  33  -4.803  -1.380  -6.447
  225    HE1  TYR  33           HE1      TYR  33  -4.328   3.203  -4.606
  226    HE2  TYR  33           HE2      TYR  33  -2.566  -0.315  -6.330
  227    HH   TYR  33           HH       TYR  33  -1.754   2.257  -6.292
  228    H    ARG  34           HN       ARG  34  -7.945  -1.180  -8.693
  229    HA   ARG  34           HA       ARG  34  -6.733  -1.231 -10.729
  230   1HB   ARG  34          HB2       ARG  34  -8.367   0.976 -10.516
  231   2HB   ARG  34          HB1       ARG  34  -6.818   1.708 -10.936
  232   1HG   ARG  34          HG2       ARG  34  -6.620   0.299 -12.902
  233   2HG   ARG  34          HG1       ARG  34  -8.068  -0.601 -12.449
  234   1HD   ARG  34          HD2       ARG  34  -9.072   0.895 -13.892
  235   2HD   ARG  34          HD1       ARG  34  -9.067   1.933 -12.452
  236    HE   ARG  34           HE       ARG  34  -6.587   2.418 -13.445
  237   1HH1  ARG  34          HH21      ARG  34  -9.433   3.822 -14.003
  238   2HH1  ARG  34          HH22      ARG  34  -9.171   4.250 -15.661
  239   1HH2  ARG  34          HH11      ARG  34  -6.340   2.277 -15.997
  240   2HH2  ARG  34          HH12      ARG  34  -7.419   3.375 -16.790
  241    H    GLY  35           HN       GLY  35  -4.697  -1.779  -9.539
  242   1HA   GLY  35          HA2       GLY  35  -2.445  -0.387 -10.335
  243   2HA   GLY  35          HA1       GLY  35  -2.869   0.360  -8.794
  244    H    SER  36           HN       SER  36  -0.616  -0.657  -8.357
  245    HA   SER  36           HA       SER  36  -1.053  -3.409  -7.247
  246   1HB   SER  36          HB2       SER  36   1.404  -3.729  -7.893
  247   2HB   SER  36          HB1       SER  36   0.267  -3.635  -9.234
  248    HG   SER  36           HG       SER  36   1.266  -1.214  -8.354
  249    H    PHE  37           HN       PHE  37  -1.535  -1.612  -5.417
  250    HA   PHE  37           HA       PHE  37   0.798  -0.385  -4.186
  251   1HB   PHE  37          HB2       PHE  37  -1.739   0.225  -4.091
  252   2HB   PHE  37          HB1       PHE  37  -1.813  -0.990  -2.812
  253    HD1  PHE  37           HD1      PHE  37  -0.775   2.371  -3.695
  254    HD2  PHE  37           HD2      PHE  37  -0.308  -0.763  -0.797
  255    HE1  PHE  37           HE1      PHE  37   0.174   4.001  -2.085
  256    HE2  PHE  37           HE2      PHE  37   0.640   0.866   0.814
  257    HZ   PHE  37           HZ       PHE  37   0.881   3.250   0.170
  258    H    SER  38           HN       SER  38   1.899  -2.678  -4.351
  259    HA   SER  38           HA       SER  38   1.200  -4.715  -2.453
  260   1HB   SER  38          HB2       SER  38   3.847  -5.046  -2.963
  261   2HB   SER  38          HB1       SER  38   2.581  -5.508  -4.096
  262    HG   SER  38           HG       SER  38   3.915  -4.202  -5.235
  263    H    THR  39           HN       THR  39   1.178  -2.213  -0.992
  264    HA   THR  39           HA       THR  39   3.437  -2.726   0.902
  265    HB   THR  39           HB       THR  39   2.449  -0.123  -0.292
  266    HG1  THR  39           HG1      THR  39   4.683   0.027  -0.798
  267   1HG2  THR  39          HG21      THR  39   3.314  -0.548   2.372
  268   2HG2  THR  39          HG22      THR  39   3.077   0.995   1.554
  269   3HG2  THR  39          HG23      THR  39   4.657   0.213   1.522
  270    H    THR  40           HN       THR  40   2.872  -2.368   3.120
  271    HA   THR  40           HA       THR  40  -0.041  -2.378   3.664
  272    HB   THR  40           HB       THR  40   0.828  -2.929   5.984
  273    HG1  THR  40           HG1      THR  40   2.863  -2.669   6.351
  274   1HG2  THR  40          HG21      THR  40   1.456  -5.166   5.423
  275   2HG2  THR  40          HG22      THR  40   2.071  -4.670   3.846
  276   3HG2  THR  40          HG23      THR  40   0.337  -4.644   4.164
  277    H    VAL  41           HN       VAL  41  -0.707  -1.093   5.701
  278    HA   VAL  41           HA       VAL  41  -0.355   1.708   5.261
  279    HB   VAL  41           HB       VAL  41  -1.438  -0.063   7.446
  280   1HG1  VAL  41          HG11      VAL  41  -1.065   2.934   7.524
  281   2HG1  VAL  41          HG12      VAL  41  -0.643   1.749   8.760
  282   3HG1  VAL  41          HG13      VAL  41  -2.336   2.132   8.447
  283   1HG2  VAL  41          HG21      VAL  41  -3.393   1.687   6.641
  284   2HG2  VAL  41          HG22      VAL  41  -3.133   0.091   5.939
  285   3HG2  VAL  41          HG23      VAL  41  -2.442   1.517   5.166
  286    H    THR  42           HN       THR  42   0.948  -0.392   7.864
  287    HA   THR  42           HA       THR  42   2.533   1.572   9.164
  288    HB   THR  42           HB       THR  42   3.823  -0.977   9.242
  289    HG1  THR  42           HG1      THR  42   2.246  -2.210   8.630
  290   1HG2  THR  42          HG21      THR  42   2.272  -0.933  11.454
  291   2HG2  THR  42          HG22      THR  42   2.173   0.764  10.988
  292   3HG2  THR  42          HG23      THR  42   3.745   0.024  11.294
  293    H    GLY  43           HN       GLY  43   2.999  -0.061   6.132
  294   1HA   GLY  43          HA2       GLY  43   4.599   0.918   4.531
  295   2HA   GLY  43          HA1       GLY  43   5.669   1.259   5.892
  296    H    ARG  44           HN       ARG  44   4.452  -1.689   6.601
  297    HA   ARG  44           HA       ARG  44   6.903  -3.082   5.949
  298   1HB   ARG  44          HB2       ARG  44   4.338  -3.528   7.325
  299   2HB   ARG  44          HB1       ARG  44   5.014  -4.983   6.591
  300   1HG   ARG  44          HG2       ARG  44   7.254  -3.957   7.711
  301   2HG   ARG  44          HG1       ARG  44   6.047  -3.347   8.844
  302   1HD   ARG  44          HD2       ARG  44   6.475  -6.248   8.044
  303   2HD   ARG  44          HD1       ARG  44   6.752  -5.530   9.643
  304    HE   ARG  44           HE       ARG  44   4.171  -6.300   8.581
  305   1HH1  ARG  44          HH21      ARG  44   5.891  -4.607  10.991
  306   2HH1  ARG  44          HH22      ARG  44   4.485  -3.881  11.695
  307   1HH2  ARG  44          HH11      ARG  44   2.318  -5.080   9.269
  308   2HH2  ARG  44          HH12      ARG  44   2.465  -4.149  10.722
  309    H    THR  45           HN       THR  45   6.047  -5.560   5.064
  310    HA   THR  45           HA       THR  45   4.984  -4.971   2.316
  311    HB   THR  45           HB       THR  45   7.123  -6.911   3.257
  312    HG1  THR  45           HG1      THR  45   7.727  -4.699   3.110
  313   1HG2  THR  45          HG21      THR  45   5.433  -6.996   0.960
  314   2HG2  THR  45          HG22      THR  45   6.799  -8.043   1.346
  315   3HG2  THR  45          HG23      THR  45   7.055  -6.563   0.422
  316    H    CYS  46           HN       CYS  46   3.235  -6.233   1.725
  317    HA   CYS  46           HA       CYS  46   2.094  -8.042   3.661
  318   1HB   CYS  46          HB2       CYS  46   1.208  -7.804   0.794
  319   2HB   CYS  46          HB1       CYS  46   0.226  -8.055   2.228
  320    H    GLN  47           HN       GLN  47   1.487 -10.318   3.081
  321    HA   GLN  47           HA       GLN  47   3.782 -11.675   1.798
  322   1HB   GLN  47          HB2       GLN  47   3.057 -12.501   3.932
  323   2HB   GLN  47          HB1       GLN  47   1.373 -12.552   3.412
  324   1HG   GLN  47          HG2       GLN  47   2.335 -14.808   3.372
  325   2HG   GLN  47          HG1       GLN  47   1.970 -14.276   1.730
  326   1HE2  GLN  47          HE21      GLN  47   4.748 -13.918   4.021
  327   2HE2  GLN  47          HE22      GLN  47   5.933 -14.281   2.861
  328    H    SER  48           HN       SER  48   3.619 -12.643  -0.225
  329    HA   SER  48           HA       SER  48   1.750 -12.056  -2.166
  330   1HB   SER  48          HB2       SER  48   3.821 -13.999  -1.666
  331   2HB   SER  48          HB1       SER  48   2.492 -14.770  -2.528
  332    HG   SER  48           HG       SER  48   3.647 -13.865  -4.119
  333    H    TRP  49           HN       TRP  49  -0.369 -12.693  -2.602
  334    HA   TRP  49           HA       TRP  49  -1.980 -13.957  -0.626
  335   1HB   TRP  49          HB2       TRP  49  -2.328 -13.851  -3.646
  336   2HB   TRP  49          HB1       TRP  49  -3.617 -14.086  -2.467
  337    HD1  TRP  49           HD1      TRP  49  -1.354 -11.414  -3.943
  338    HE1  TRP  49           HE1      TRP  49  -2.191  -9.114  -3.179
  339    HE3  TRP  49           HE3      TRP  49  -4.833 -12.806  -0.539
  340    HZ2  TRP  49           HZ2      TRP  49  -4.068  -7.992  -1.372
  341    HZ3  TRP  49           HZ3      TRP  49  -6.151 -11.117   0.711
  342    HH2  TRP  49           HH2      TRP  49  -5.770  -8.700   0.295
  343    H    SER  50           HN       SER  50  -0.272 -15.170  -3.454
  344    HA   SER  50           HA       SER  50  -1.108 -17.947  -3.125
  345   1HB   SER  50          HB2       SER  50  -0.572 -16.738  -5.259
  346   2HB   SER  50          HB1       SER  50   1.110 -16.666  -4.746
  347    HG   SER  50           HG       SER  50   0.890 -19.041  -4.528
  348    H    SER  51           HN       SER  51   0.440 -16.575  -0.832
  349    HA   SER  51           HA       SER  51   2.986 -18.102  -0.848
  350   1HB   SER  51          HB2       SER  51   3.632 -16.578   0.800
  351   2HB   SER  51          HB1       SER  51   2.475 -15.608  -0.107
  352    HG   SER  51           HG       SER  51   0.994 -15.899   1.450
  353    H    MET  52           HN       MET  52   2.730 -20.211  -0.179
  354    HA   MET  52           HA       MET  52   0.687 -20.794   1.910
  355   1HB   MET  52          HB2       MET  52   2.301 -22.768   0.293
  356   2HB   MET  52          HB1       MET  52   0.722 -23.000   1.031
  357   1HG   MET  52          HG2       MET  52   1.430 -21.583  -1.511
  358   2HG   MET  52          HG1       MET  52   0.120 -22.710  -1.191
  359   1HE   MET  52          HE1       MET  52  -2.248 -21.614   0.551
  360   2HE   MET  52          HE2       MET  52  -1.570 -20.340   1.561
  361   3HE   MET  52          HE3       MET  52  -0.709 -21.856   1.373
  362    H    THR  53           HN       THR  53   3.456 -19.603   2.376
  363    HA   THR  53           HA       THR  53   4.737 -21.797   3.924
  364    HB   THR  53           HB       THR  53   6.250 -19.473   4.172
  365    HG1  THR  53           HG1      THR  53   6.204 -18.536   2.163
  366   1HG2  THR  53          HG21      THR  53   6.597 -22.010   3.273
  367   2HG2  THR  53          HG22      THR  53   7.807 -20.740   3.088
  368   3HG2  THR  53          HG23      THR  53   6.716 -21.120   1.755
  369    HA   PRO  54           HA       PRO  54   4.064 -18.646   7.402
  370   1HB   PRO  54          HB2       PRO  54   3.054 -16.169   6.831
  371   2HB   PRO  54          HB1       PRO  54   4.788 -16.540   6.772
  372   1HG   PRO  54          HG2       PRO  54   2.830 -16.293   4.553
  373   2HG   PRO  54          HG1       PRO  54   4.531 -15.809   4.619
  374   1HD   PRO  54          HD2       PRO  54   3.623 -18.078   3.376
  375   2HD   PRO  54          HD1       PRO  54   5.271 -17.872   4.005
  376    H    HIS  55           HN       HIS  55   1.539 -16.738   5.922
  377    HA   HIS  55           HA       HIS  55  -0.511 -18.266   7.413
  378   1HB   HIS  55          HB2       HIS  55  -1.041 -15.921   5.596
  379   2HB   HIS  55          HB1       HIS  55  -1.822 -16.337   7.121
  380    HD1  HIS  55           HD1      HIS  55   1.359 -14.857   5.740
  381    HD2  HIS  55           HD2      HIS  55  -0.540 -15.315   9.421
  382    HE1  HIS  55           HE1      HIS  55   2.697 -13.514   7.401
  383    H    TRP  56           HN       TRP  56  -1.422 -20.013   6.399
  384    HA   TRP  56           HA       TRP  56  -1.482 -20.113   3.429
  385   1HB   TRP  56          HB2       TRP  56  -0.622 -21.934   5.036
  386   2HB   TRP  56          HB1       TRP  56  -2.319 -22.232   5.414
  387    HD1  TRP  56           HD1      TRP  56  -3.762 -22.181   2.787
  388    HE1  TRP  56           HE1      TRP  56  -3.251 -23.786   0.864
  389    HE3  TRP  56           HE3      TRP  56   0.961 -23.520   4.049
  390    HZ2  TRP  56           HZ2      TRP  56  -1.106 -25.436  -0.036
  391    HZ3  TRP  56           HZ3      TRP  56   2.227 -25.094   2.634
  392    HH2  TRP  56           HH2      TRP  56   1.211 -26.069   0.597
  393    H    HIS  57           HN       HIS  57  -3.401 -20.049   2.273
  394    HA   HIS  57           HA       HIS  57  -5.984 -20.518   3.578
  395   1HB   HIS  57          HB2       HIS  57  -6.777 -18.285   3.488
  396   2HB   HIS  57          HB1       HIS  57  -5.133 -18.122   4.100
  397    HD1  HIS  57           HD1      HIS  57  -4.031 -18.771   1.035
  398    HD2  HIS  57           HD2      HIS  57  -6.495 -15.654   2.298
  399    HE1  HIS  57           HE1      HIS  57  -3.811 -16.936  -0.698
  400    H    GLN  58           HN       GLN  58  -7.369 -18.877   1.524
  401    HA   GLN  58           HA       GLN  58  -6.504 -20.058  -1.049
  402   1HB   GLN  58          HB2       GLN  58  -8.724 -21.005   0.671
  403   2HB   GLN  58          HB1       GLN  58  -9.121 -20.822  -1.039
  404   1HG   GLN  58          HG2       GLN  58  -7.036 -22.148  -1.572
  405   2HG   GLN  58          HG1       GLN  58  -6.884 -22.480   0.153
  406   1HE2  GLN  58          HE21      GLN  58  -7.720 -24.169  -2.391
  407   2HE2  GLN  58          HE22      GLN  58  -9.094 -25.000  -1.840
  408    H    ARG  59           HN       ARG  59  -6.347 -17.855  -1.752
  409    HA   ARG  59           HA       ARG  59  -8.848 -16.707  -2.726
  410   1HB   ARG  59          HB2       ARG  59  -8.164 -16.113  -0.132
  411   2HB   ARG  59          HB1       ARG  59  -7.417 -14.777  -1.009
  412   1HG   ARG  59          HG2       ARG  59  -9.909 -15.035  -2.216
  413   2HG   ARG  59          HG1       ARG  59 -10.246 -15.310  -0.506
  414   1HD   ARG  59          HD2       ARG  59  -8.762 -13.197  -0.107
  415   2HD   ARG  59          HD1       ARG  59  -9.073 -12.863  -1.823
  416    HE   ARG  59           HE       ARG  59 -11.419 -12.654  -1.329
  417   1HH1  ARG  59          HH11      ARG  59  -9.913 -11.470   1.172
  418   2HH1  ARG  59          HH12      ARG  59 -10.954 -12.054   2.427
  419   1HH2  ARG  59          HH21      ARG  59 -12.596 -14.318   0.380
  420   2HH2  ARG  59          HH22      ARG  59 -12.471 -13.666   1.980
  421    H    THR  60           HN       THR  60  -6.061 -17.565  -3.579
  422    HA   THR  60           HA       THR  60  -4.539 -15.228  -4.345
  423    HB   THR  60           HB       THR  60  -3.517 -17.412  -4.225
  424    HG1  THR  60           HG1      THR  60  -2.460 -16.565  -5.833
  425   1HG2  THR  60          HG21      THR  60  -5.232 -18.964  -4.515
  426   2HG2  THR  60          HG22      THR  60  -4.330 -19.125  -6.022
  427   3HG2  THR  60          HG23      THR  60  -5.817 -18.177  -5.981
  428    H    THR  61           HN       THR  61  -4.034 -15.322  -6.936
  429    HA   THR  61           HA       THR  61  -6.423 -14.252  -8.203
  430    HB   THR  61           HB       THR  61  -4.589 -14.522 -10.180
  431    HG1  THR  61           HG1      THR  61  -2.918 -14.147  -7.987
  432   1HG2  THR  61          HG21      THR  61  -4.751 -12.305  -9.902
  433   2HG2  THR  61          HG22      THR  61  -3.643 -12.410  -8.533
  434   3HG2  THR  61          HG23      THR  61  -5.382 -12.544  -8.273
  435    H    GLU  62           HN       GLU  62  -5.111 -17.380  -7.724
  436    HA   GLU  62           HA       GLU  62  -5.937 -18.617 -10.176
  437   1HB   GLU  62          HB2       GLU  62  -4.329 -19.645  -8.642
  438   2HB   GLU  62          HB1       GLU  62  -5.530 -19.648  -7.350
  439   1HG   GLU  62          HG2       GLU  62  -6.727 -20.951  -9.565
  440   2HG   GLU  62          HG1       GLU  62  -5.102 -21.619  -9.405
  441    H    TYR  63           HN       TYR  63  -7.474 -17.640  -7.240
  442    HA   TYR  63           HA       TYR  63  -9.999 -19.007  -7.962
  443   1HB   TYR  63          HB2       TYR  63  -8.634 -18.369  -5.582
  444   2HB   TYR  63          HB1       TYR  63 -10.038 -17.302  -5.610
  445    HD1  TYR  63           HD1      TYR  63  -9.014 -20.874  -5.993
  446    HD2  TYR  63           HD2      TYR  63 -12.192 -18.124  -5.104
  447    HE1  TYR  63           HE1      TYR  63 -10.470 -22.770  -5.333
  448    HE2  TYR  63           HE2      TYR  63 -13.648 -20.020  -4.445
  449    HH   TYR  63           HH       TYR  63 -12.442 -23.174  -3.943
  450    H    TYR  64           HN       TYR  64  -8.423 -16.215  -8.771
  451    HA   TYR  64           HA       TYR  64 -11.007 -14.765  -9.217
  452   1HB   TYR  64          HB2       TYR  64  -8.740 -14.083  -7.509
  453   2HB   TYR  64          HB1       TYR  64  -9.055 -12.824  -8.702
  454    HD1  TYR  64           HD1      TYR  64 -11.340 -11.799  -8.863
  455    HD2  TYR  64           HD2      TYR  64 -10.247 -14.486  -5.695
  456    HE1  TYR  64           HE1      TYR  64 -13.283 -11.021  -7.534
  457    HE2  TYR  64           HE2      TYR  64 -12.192 -13.709  -4.366
  458    HH   TYR  64           HH       TYR  64 -14.059 -10.941  -5.287
  459    HA   PRO  65           HA       PRO  65  -8.870 -14.873 -13.188
  460   1HB   PRO  65          HB2       PRO  65 -11.077 -14.165 -14.650
  461   2HB   PRO  65          HB1       PRO  65 -10.774 -15.823 -14.092
  462   1HG   PRO  65          HG2       PRO  65 -12.577 -13.743 -12.956
  463   2HG   PRO  65          HG1       PRO  65 -12.828 -15.488 -13.119
  464   1HD   PRO  65          HD2       PRO  65 -12.127 -14.290 -10.776
  465   2HD   PRO  65          HD1       PRO  65 -11.696 -15.966 -11.185
  466    H    ASN  66           HN       ASN  66 -10.097 -12.361 -11.336
  467    HA   ASN  66           HA       ASN  66  -8.766 -10.342 -13.056
  468   1HB   ASN  66          HB2       ASN  66 -11.689 -10.571 -12.436
  469   2HB   ASN  66          HB1       ASN  66 -10.984  -8.957 -12.543
  470   1HD2  ASN  66          HD21      ASN  66 -11.463 -11.979 -14.398
  471   2HD2  ASN  66          HD22      ASN  66 -11.264 -11.262 -15.924
  472    H    GLY  67           HN       GLY  67  -8.693 -11.687 -10.232
  473   1HA   GLY  67          HA2       GLY  67  -9.253  -9.659  -8.293
  474   2HA   GLY  67          HA1       GLY  67  -8.149 -11.014  -8.052
  475    H    GLY  68           HN       GLY  68  -6.243 -10.522 -10.008
  476   1HA   GLY  68          HA2       GLY  68  -4.504  -9.029 -10.643
  477   2HA   GLY  68          HA1       GLY  68  -5.314  -7.746  -9.739
  478    H    LEU  69           HN       LEU  69  -5.041 -10.682  -8.034
  479    HA   LEU  69           HA       LEU  69  -3.355  -9.503  -6.006
  480   1HB   LEU  69          HB2       LEU  69  -4.219 -12.369  -6.494
  481   2HB   LEU  69          HB1       LEU  69  -3.644 -11.708  -4.962
  482    HG   LEU  69           HG       LEU  69  -6.192 -11.050  -6.436
  483   1HD1  LEU  69          HD11      LEU  69  -5.433 -12.615  -4.122
  484   2HD1  LEU  69          HD12      LEU  69  -7.013 -12.481  -4.896
  485   3HD1  LEU  69          HD13      LEU  69  -6.540 -11.327  -3.648
  486   1HD2  LEU  69          HD21      LEU  69  -4.699  -9.477  -4.340
  487   2HD2  LEU  69          HD22      LEU  69  -6.453  -9.366  -4.480
  488   3HD2  LEU  69          HD23      LEU  69  -5.428  -8.896  -5.837
  489    H    THR  70           HN       THR  70  -1.786  -9.198  -8.143
  490    HA   THR  70           HA       THR  70  -0.055 -11.433  -8.772
  491    HB   THR  70           HB       THR  70   0.687  -8.511  -8.933
  492    HG1  THR  70           HG1      THR  70  -0.821  -9.683 -10.955
  493   1HG2  THR  70          HG21      THR  70   1.016 -10.152 -11.301
  494   2HG2  THR  70          HG22      THR  70   1.790 -10.902  -9.905
  495   3HG2  THR  70          HG23      THR  70   2.233  -9.264 -10.385
  496    H    ARG  71           HN       ARG  71   1.338 -12.335  -7.299
  497    HA   ARG  71           HA       ARG  71   2.896 -12.506  -5.528
  498   1HB   ARG  71          HB2       ARG  71   3.255  -9.593  -6.313
  499   2HB   ARG  71          HB1       ARG  71   4.408 -10.547  -5.379
  500   1HG   ARG  71          HG2       ARG  71   4.447 -12.179  -7.336
  501   2HG   ARG  71          HG1       ARG  71   3.574 -10.953  -8.256
  502   1HD   ARG  71          HD2       ARG  71   5.455  -9.328  -7.554
  503   2HD   ARG  71          HD1       ARG  71   6.363 -10.783  -7.098
  504    HE   ARG  71           HE       ARG  71   5.497 -11.465  -9.583
  505   1HH1  ARG  71          HH21      ARG  71   8.320 -10.435  -8.971
  506   2HH1  ARG  71          HH22      ARG  71   8.477  -9.190 -10.166
  507   1HH2  ARG  71          HH11      ARG  71   5.081  -9.058 -10.855
  508   2HH2  ARG  71          HH12      ARG  71   6.642  -8.410 -11.233
  509    H    ASN  72           HN       ASN  72   3.419  -9.837  -3.977
  510    HA   ASN  72           HA       ASN  72   1.360 -10.299  -1.930
  511   1HB   ASN  72          HB2       ASN  72   3.255  -9.844  -0.772
  512   2HB   ASN  72          HB1       ASN  72   4.056  -9.248  -2.219
  513   1HD2  ASN  72          HD21      ASN  72   2.881  -6.896  -2.857
  514   2HD2  ASN  72          HD22      ASN  72   2.854  -5.821  -1.545
  515    H    TYR  73           HN       TYR  73   1.073  -8.798  -4.730
  516    HA   TYR  73           HA       TYR  73   0.518  -6.120  -4.612
  517   1HB   TYR  73          HB2       TYR  73  -0.751  -8.499  -5.871
  518   2HB   TYR  73          HB1       TYR  73  -1.704  -7.015  -5.896
  519    HD1  TYR  73           HD1      TYR  73   1.974  -6.960  -5.813
  520    HD2  TYR  73           HD2      TYR  73  -1.508  -6.710  -8.315
  521    HE1  TYR  73           HE1      TYR  73   3.370  -6.090  -7.668
  522    HE2  TYR  73           HE2      TYR  73  -0.112  -5.840 -10.171
  523    HH   TYR  73           HH       TYR  73   3.401  -5.710  -9.919
  524    H    CYS  74           HN       CYS  74  -1.240  -4.820  -3.928
  525    HA   CYS  74           HA       CYS  74  -2.767  -5.919  -1.616
  526   1HB   CYS  74          HB2       CYS  74  -1.363  -3.979  -1.189
  527   2HB   CYS  74          HB1       CYS  74  -2.078  -3.117  -2.553
  528    H    ARG  75           HN       ARG  75  -4.869  -6.417  -2.002
  529    HA   ARG  75           HA       ARG  75  -6.368  -4.837  -4.067
  530   1HB   ARG  75          HB2       ARG  75  -5.602  -7.613  -3.917
  531   2HB   ARG  75          HB1       ARG  75  -7.360  -7.485  -3.933
  532   1HG   ARG  75          HG2       ARG  75  -6.739  -7.567  -6.227
  533   2HG   ARG  75          HG1       ARG  75  -7.047  -5.860  -5.908
  534   1HD   ARG  75          HD2       ARG  75  -4.622  -5.478  -5.590
  535   2HD   ARG  75          HD1       ARG  75  -4.315  -7.192  -5.930
  536    HE   ARG  75           HE       ARG  75  -4.568  -6.656  -8.208
  537   1HH1  ARG  75          HH11      ARG  75  -7.525  -6.072  -7.762
  538   2HH1  ARG  75          HH12      ARG  75  -7.652  -4.469  -8.405
  539   1HH2  ARG  75          HH21      ARG  75  -4.231  -3.904  -8.388
  540   2HH2  ARG  75          HH22      ARG  75  -5.788  -3.242  -8.761
  541    H    ASN  76           HN       ASN  76  -8.829  -5.193  -3.713
  542    HA   ASN  76           HA       ASN  76  -9.410  -5.447  -0.779
  543   1HB   ASN  76          HB2       ASN  76  -9.508  -3.138  -1.348
  544   2HB   ASN  76          HB1       ASN  76 -10.319  -3.472  -2.879
  545   1HD2  ASN  76          HD21      ASN  76 -12.596  -3.464  -2.862
  546   2HD2  ASN  76          HD22      ASN  76 -13.540  -3.399  -1.453
  547    HA   PRO  77           HA       PRO  77 -12.125  -8.343  -3.113
  548   1HB   PRO  77          HB2       PRO  77 -11.659 -10.517  -1.527
  549   2HB   PRO  77          HB1       PRO  77 -10.620 -10.086  -2.898
  550   1HG   PRO  77          HG2       PRO  77 -10.169  -9.721   0.003
  551   2HG   PRO  77          HG1       PRO  77  -9.007 -10.025  -1.295
  552   1HD   PRO  77          HD2       PRO  77  -9.496  -7.559  -0.107
  553   2HD   PRO  77          HD1       PRO  77  -8.683  -7.814  -1.665
  554    H    ASP  78           HN       ASP  78 -12.981  -6.386  -1.169
  555    HA   ASP  78           HA       ASP  78 -15.220  -7.849   0.038
  556   1HB   ASP  78          HB2       ASP  78 -13.416  -8.197   1.663
  557   2HB   ASP  78          HB1       ASP  78 -13.080  -6.466   1.695
  558    H    ALA  79           HN       ALA  79 -14.083  -4.901   1.512
  559    HA   ALA  79           HA       ALA  79 -15.011  -2.876  -0.156
  560   1HB   ALA  79          HB1       ALA  79 -17.117  -4.586   0.976
  561   2HB   ALA  79          HB2       ALA  79 -17.190  -3.485  -0.400
  562   3HB   ALA  79          HB3       ALA  79 -17.394  -2.864   1.238
  563    H    GLU  80           HN       GLU  80 -13.109  -2.986   1.867
  564    HA   GLU  80           HA       GLU  80 -14.247  -1.630   4.257
  565   1HB   GLU  80          HB2       GLU  80 -11.326  -2.113   3.772
  566   2HB   GLU  80          HB1       GLU  80 -12.227  -2.195   5.283
  567   1HG   GLU  80          HG2       GLU  80 -12.317  -4.195   3.013
  568   2HG   GLU  80          HG1       GLU  80 -11.616  -4.441   4.610
  569    H    ILE  81           HN       ILE  81 -12.446   0.130   5.020
  570    HA   ILE  81           HA       ILE  81 -12.804   2.502   3.585
  571    HB   ILE  81           HB       ILE  81 -11.852   2.155   5.874
  572   1HG1  ILE  81          HG12      ILE  81 -11.522   4.283   4.420
  573   2HG1  ILE  81          HG11      ILE  81 -10.506   4.093   5.846
  574   1HG2  ILE  81          HG21      ILE  81  -9.307   1.463   4.395
  575   2HG2  ILE  81          HG22      ILE  81 -10.352   0.280   5.181
  576   3HG2  ILE  81          HG23      ILE  81  -9.536   1.512   6.143
  577   1HD1  ILE  81          HD11      ILE  81  -8.767   3.023   4.299
  578   2HD1  ILE  81          HD12      ILE  81  -9.034   4.750   4.082
  579   3HD1  ILE  81          HD13      ILE  81  -9.752   3.602   2.956
  580    H    SER  82           HN       SER  82 -10.308   0.027   3.259
  581    HA   SER  82           HA       SER  82  -9.775   0.834   0.475
  582   1HB   SER  82          HB2       SER  82  -7.812   1.923   0.873
  583   2HB   SER  82          HB1       SER  82  -8.385   2.055   2.533
  584    HG   SER  82           HG       SER  82  -6.539   1.011   2.823
  585    HA   PRO  83           HA       PRO  83  -8.427  -3.336   0.176
  586   1HB   PRO  83          HB2       PRO  83  -6.050  -3.286  -1.171
  587   2HB   PRO  83          HB1       PRO  83  -7.604  -2.914  -1.944
  588   1HG   PRO  83          HG2       PRO  83  -5.464  -1.086  -1.023
  589   2HG   PRO  83          HG1       PRO  83  -6.553  -0.943  -2.409
  590   1HD   PRO  83          HD2       PRO  83  -6.847   0.418  -0.021
  591   2HD   PRO  83          HD1       PRO  83  -8.150   0.121  -1.191
  592    H    TRP  84           HN       TRP  84  -6.927  -4.968   1.001
  593    HA   TRP  84           HA       TRP  84  -4.864  -3.940   2.913
  594   1HB   TRP  84          HB2       TRP  84  -5.765  -5.894   4.384
  595   2HB   TRP  84          HB1       TRP  84  -6.726  -4.420   4.294
  596    HD1  TRP  84           HD1      TRP  84  -8.731  -4.471   2.353
  597    HE1  TRP  84           HE1      TRP  84 -10.284  -6.427   1.720
  598    HE3  TRP  84           HE3      TRP  84  -6.048  -8.381   4.252
  599    HZ2  TRP  84           HZ2      TRP  84 -10.379  -9.272   1.984
  600    HZ3  TRP  84           HZ3      TRP  84  -6.895 -10.701   4.048
  601    HH2  TRP  84           HH2      TRP  84  -9.056 -11.151   2.918
  602    H    CYS  85           HN       CYS  85  -3.791  -6.264   3.811
  603    HA   CYS  85           HA       CYS  85  -3.536  -8.322   1.781
  604   1HB   CYS  85          HB2       CYS  85  -1.185  -7.633   1.142
  605   2HB   CYS  85          HB1       CYS  85  -2.439  -6.527   0.586
  606    H    TYR  86           HN       TYR  86  -2.500 -10.108   2.668
  607    HA   TYR  86           HA       TYR  86  -2.045 -10.383   5.429
  608   1HB   TYR  86          HB2       TYR  86  -0.553 -11.813   3.208
  609   2HB   TYR  86          HB1       TYR  86  -0.978 -12.459   4.793
  610    HD1  TYR  86           HD1      TYR  86  -1.765 -13.073   1.629
  611    HD2  TYR  86           HD2      TYR  86  -3.751 -11.599   5.142
  612    HE1  TYR  86           HE1      TYR  86  -3.941 -13.852   0.729
  613    HE2  TYR  86           HE2      TYR  86  -5.925 -12.378   4.242
  614    HH   TYR  86           HH       TYR  86  -6.136 -13.922   1.035
  615    H    THR  87           HN       THR  87   0.427 -11.120   6.130
  616    HA   THR  87           HA       THR  87   2.183  -8.804   5.364
  617    HB   THR  87           HB       THR  87   3.095  -9.736   7.785
  618    HG1  THR  87           HG1      THR  87   1.534 -11.018   8.372
  619   1HG2  THR  87          HG21      THR  87   2.165  -7.398   6.778
  620   2HG2  THR  87          HG22      THR  87   2.568  -7.639   8.478
  621   3HG2  THR  87          HG23      THR  87   0.893  -7.772   7.941
  622    H    MET  88           HN       MET  88   4.186  -9.319   4.582
  623    HA   MET  88           HA       MET  88   4.900 -12.018   3.911
  624   1HB   MET  88          HB2       MET  88   5.740  -9.340   3.444
  625   2HB   MET  88          HB1       MET  88   7.153 -10.236   4.003
  626   1HG   MET  88          HG2       MET  88   5.632 -11.840   2.139
  627   2HG   MET  88          HG1       MET  88   6.029 -10.281   1.417
  628   1HE   MET  88          HE1       MET  88   9.378  -9.963   3.099
  629   2HE   MET  88          HE2       MET  88   8.052  -9.166   2.256
  630   3HE   MET  88          HE3       MET  88   9.453  -9.726   1.347
  631    H    ASP  89           HN       ASP  89   4.880 -10.661   6.979
  632    HA   ASP  89           HA       ASP  89   7.307 -12.176   7.828
  633   1HB   ASP  89          HB2       ASP  89   5.817  -9.759   8.865
  634   2HB   ASP  89          HB1       ASP  89   6.955 -10.639   9.886
  635    HA   PRO  90           HA       PRO  90   4.578 -14.933   9.895
  636   1HB   PRO  90          HB2       PRO  90   6.383 -16.031  11.632
  637   2HB   PRO  90          HB1       PRO  90   6.365 -16.407   9.897
  638   1HG   PRO  90          HG2       PRO  90   8.154 -14.591  11.420
  639   2HG   PRO  90          HG1       PRO  90   8.513 -15.628  10.032
  640   1HD   PRO  90          HD2       PRO  90   8.114 -12.903   9.884
  641   2HD   PRO  90          HD1       PRO  90   7.897 -14.027   8.525
  642    H    ASN  91           HN       ASN  91   5.607 -12.098  11.167
  643    HA   ASN  91           HA       ASN  91   4.677 -12.687  13.943
  644   1HB   ASN  91          HB2       ASN  91   5.843 -10.632  14.498
  645   2HB   ASN  91          HB1       ASN  91   6.906 -11.585  13.462
  646   1HD2  ASN  91          HD21      ASN  91   6.892  -8.619  13.765
  647   2HD2  ASN  91          HD22      ASN  91   6.585  -7.995  12.217
  648    H    VAL  92           HN       VAL  92   3.521 -11.568  10.990
  649    HA   VAL  92           HA       VAL  92   1.342 -10.029  12.363
  650    HB   VAL  92           HB       VAL  92   2.770  -9.416   9.746
  651   1HG1  VAL  92          HG11      VAL  92   1.414  -7.261   9.979
  652   2HG1  VAL  92          HG12      VAL  92   0.467  -8.096  11.211
  653   3HG1  VAL  92          HG13      VAL  92   0.489  -8.702   9.554
  654   1HG2  VAL  92          HG21      VAL  92   3.680  -8.929  12.287
  655   2HG2  VAL  92          HG22      VAL  92   2.752  -7.464  11.972
  656   3HG2  VAL  92          HG23      VAL  92   4.066  -7.925  10.890
  657    H    ARG  93           HN       ARG  93  -0.731 -10.541  11.593
  658    HA   ARG  93           HA       ARG  93  -0.990 -12.849   9.845
  659   1HB   ARG  93          HB2       ARG  93  -2.349 -12.303  11.928
  660   2HB   ARG  93          HB1       ARG  93  -3.137 -11.044  10.975
  661   1HG   ARG  93          HG2       ARG  93  -3.504 -13.010   9.250
  662   2HG   ARG  93          HG1       ARG  93  -3.302 -14.023  10.679
  663   1HD   ARG  93          HD2       ARG  93  -5.025 -11.982  11.527
  664   2HD   ARG  93          HD1       ARG  93  -5.597 -12.409   9.902
  665    HE   ARG  93           HE       ARG  93  -5.845 -14.095  12.200
  666   1HH1  ARG  93          HH21      ARG  93  -7.353 -14.511   9.647
  667   2HH1  ARG  93          HH22      ARG  93  -6.683 -15.999   9.067
  668   1HH2  ARG  93          HH11      ARG  93  -3.903 -15.863  11.135
  669   2HH2  ARG  93          HH12      ARG  93  -4.732 -16.764   9.909
  670    H    TRP  94           HN       TRP  94  -2.160  -9.476   9.778
  671    HA   TRP  94           HA       TRP  94  -1.715  -9.297   6.882
  672   1HB   TRP  94          HB2       TRP  94  -4.054  -9.084   6.307
  673   2HB   TRP  94          HB1       TRP  94  -3.888 -10.561   7.257
  674    HD1  TRP  94           HD1      TRP  94  -4.661 -10.451   9.842
  675    HE1  TRP  94           HE1      TRP  94  -6.402  -8.950  11.010
  676    HE3  TRP  94           HE3      TRP  94  -5.154  -6.778   6.330
  677    HZ2  TRP  94           HZ2      TRP  94  -7.817  -6.512  10.518
  678    HZ3  TRP  94           HZ3      TRP  94  -6.702  -4.881   6.704
  679    HH2  TRP  94           HH2      TRP  94  -8.033  -4.742   8.791
  680    H    GLU  95           HN       GLU  95  -2.534  -7.040   6.117
  681    HA   GLU  95           HA       GLU  95  -2.861  -5.051   8.279
  682   1HB   GLU  95          HB2       GLU  95  -0.326  -5.847   7.485
  683   2HB   GLU  95          HB1       GLU  95  -0.598  -4.385   6.537
  684   1HG   GLU  95          HG2       GLU  95   0.416  -3.801   8.689
  685   2HG   GLU  95          HG1       GLU  95  -1.235  -3.183   8.617
  686    H    TYR  96           HN       TYR  96  -3.536  -2.996   7.460
  687    HA   TYR  96           HA       TYR  96  -4.899  -3.065   4.892
  688   1HB   TYR  96          HB2       TYR  96  -4.592  -1.319   7.258
  689   2HB   TYR  96          HB1       TYR  96  -4.912  -0.458   5.753
  690    HD1  TYR  96           HD1      TYR  96  -6.572  -1.503   8.475
  691    HD2  TYR  96           HD2      TYR  96  -6.647  -2.176   4.234
  692    HE1  TYR  96           HE1      TYR  96  -8.965  -2.139   8.619
  693    HE2  TYR  96           HE2      TYR  96  -9.040  -2.813   4.377
  694    HH   TYR  96           HH       TYR  96 -10.638  -3.606   5.989
  695    H    CYS  97           HN       CYS  97  -4.502  -1.187   3.295
  696    HA   CYS  97           HA       CYS  97  -1.553  -0.934   2.856
  697   1HB   CYS  97          HB2       CYS  97  -3.990  -0.795   1.066
  698   2HB   CYS  97          HB1       CYS  97  -2.354  -0.457   0.499
  699    H    ASN  98           HN       ASN  98  -0.622   1.094   2.645
  700    HA   ASN  98           HA       ASN  98  -1.817   3.397   3.807
  701   1HB   ASN  98          HB2       ASN  98   0.567   2.667   2.233
  702   2HB   ASN  98          HB1       ASN  98   0.090   4.357   2.070
  703   1HD2  ASN  98          HD21      ASN  98   2.458   4.047   3.373
  704   2HD2  ASN  98          HD22      ASN  98   2.283   4.247   5.049
  705    H    LEU  99           HN       LEU  99  -3.976   3.450   2.684
  706    HA   LEU  99           HA       LEU  99  -3.749   4.942   0.103
  707   1HB   LEU  99          HB2       LEU  99  -5.557   2.603   0.778
  708   2HB   LEU  99          HB1       LEU  99  -5.698   3.573  -0.689
  709    HG   LEU  99           HG       LEU  99  -3.113   2.222   0.100
  710   1HD1  LEU  99          HD11      LEU  99  -5.240   1.163  -1.782
  711   2HD1  LEU  99          HD12      LEU  99  -4.961   0.551  -0.151
  712   3HD1  LEU  99          HD13      LEU  99  -3.706   0.389  -1.380
  713   1HD2  LEU  99          HD21      LEU  99  -4.138   3.828  -2.160
  714   2HD2  LEU  99          HD22      LEU  99  -3.228   2.392  -2.628
  715   3HD2  LEU  99          HD23      LEU  99  -2.482   3.611  -1.595
  716    H    THR 100           HN       THR 100  -5.101   6.689   0.003
  717    HA   THR 100           HA       THR 100  -7.024   7.090   2.257
  718    HB   THR 100           HB       THR 100  -6.590   9.448   1.896
  719    HG1  THR 100           HG1      THR 100  -5.680  10.169   0.116
  720   1HG2  THR 100          HG21      THR 100  -4.929   8.289   3.244
  721   2HG2  THR 100          HG22      THR 100  -4.118   9.496   2.244
  722   3HG2  THR 100          HG23      THR 100  -4.058   7.791   1.793
  723    H    GLN 101           HN       GLN 101  -9.052   8.190   1.677
  724    HA   GLN 101           HA       GLN 101 -10.284   7.144  -0.716
  725   1HB   GLN 101          HB2       GLN 101 -11.186   7.951   1.646
  726   2HB   GLN 101          HB1       GLN 101 -11.353   9.496   0.812
  727   1HG   GLN 101          HG2       GLN 101 -12.993   8.713  -0.607
  728   2HG   GLN 101          HG1       GLN 101 -12.368   7.063  -0.586
  729   1HE2  GLN 101          HE21      GLN 101 -13.134   5.627   1.067
  730   2HE2  GLN 101          HE22      GLN 101 -14.357   6.059   2.162
  731    H    CYS 102           HN       CYS 102  -8.847   7.977  -2.436
  732    HA   CYS 102           HA       CYS 102  -7.992  10.510  -2.972
  733   1HB   CYS 102          HB2       CYS 102  -8.634   8.120  -4.401
  734   2HB   CYS 102          HB1       CYS 102  -9.166   9.498  -5.367
  735    HA   PRO 103           HA       PRO 103 -12.221  11.853  -4.757
  736   1HB   PRO 103          HB2       PRO 103 -14.397  10.275  -4.249
  737   2HB   PRO 103          HB1       PRO 103 -13.358  10.066  -5.672
  738   1HG   PRO 103          HG2       PRO 103 -13.428   8.521  -3.137
  739   2HG   PRO 103          HG1       PRO 103 -13.137   7.966  -4.792
  740   1HD   PRO 103          HD2       PRO 103 -11.167   8.355  -2.928
  741   2HD   PRO 103          HD1       PRO 103 -10.904   8.415  -4.684
  742    H    VAL 104           HN       VAL 104 -14.119  10.131  -2.375
  743    HA   VAL 104           HA       VAL 104 -14.887  12.507  -0.980
  744    HB   VAL 104           HB       VAL 104 -14.942   9.590  -0.139
  745   1HG1  VAL 104          HG11      VAL 104 -16.961  10.379   1.166
  746   2HG1  VAL 104          HG12      VAL 104 -16.477  12.033   0.789
  747   3HG1  VAL 104          HG13      VAL 104 -15.422  11.004   1.757
  748   1HG2  VAL 104          HG21      VAL 104 -17.007  11.270  -1.600
  749   2HG2  VAL 104          HG22      VAL 104 -17.182   9.576  -1.142
  750   3HG2  VAL 104          HG23      VAL 104 -15.988  10.043  -2.353
  751    H    THR 105           HN       THR 105 -14.536  12.731   1.474
  752    HA   THR 105           HA       THR 105 -11.917  11.760   2.461
  753    HB   THR 105           HB       THR 105 -12.633  14.649   1.890
  754    HG1  THR 105           HG1      THR 105 -10.916  12.735   0.839
  755   1HG2  THR 105          HG21      THR 105 -10.818  13.461   3.873
  756   2HG2  THR 105          HG22      THR 105 -11.450  15.104   3.769
  757   3HG2  THR 105          HG23      THR 105 -10.041  14.639   2.815
  758    H    GLU 106           HN       GLU 106 -12.691  10.943   4.407
  759    HA   GLU 106           HA       GLU 106 -13.873  10.874   6.466
  760   1HB   GLU 106          HB2       GLU 106 -12.033  12.880   6.341
  761   2HB   GLU 106          HB1       GLU 106 -13.483  13.802   6.739
  762   1HG   GLU 106          HG2       GLU 106 -13.597  12.945   8.837
  763   2HG   GLU 106          HG1       GLU 106 -13.188  11.318   8.290
  764    H    SER 107           HN       SER 107 -16.022  10.527   5.553
  765    HA   SER 107           HA       SER 107 -17.687  12.897   4.954
  766   1HB   SER 107          HB2       SER 107 -18.470   9.976   5.077
  767   2HB   SER 107          HB1       SER 107 -19.236  11.258   4.143
  768    HG   SER 107           HG       SER 107 -17.447   9.656   3.268
  769    H    SER 108           HN       SER 108 -18.219  13.951   6.884
  770    HA   SER 108           HA       SER 108 -19.546  12.280   8.997
  771   1HB   SER 108          HB2       SER 108 -17.256  13.314   9.478
  772   2HB   SER 108          HB1       SER 108 -18.047  14.885   9.381
  773    HG   SER 108           HG       SER 108 -18.043  14.171  11.515
  774    H    VAL 109           HN       VAL 109 -19.284  15.765   8.173
  775    HA   VAL 109           HA       VAL 109 -22.151  16.122   8.815
  776    HB   VAL 109           HB       VAL 109 -21.580  18.468   8.722
  777   1HG1  VAL 109          HG11      VAL 109 -19.101  17.076   9.760
  778   2HG1  VAL 109          HG12      VAL 109 -20.644  17.027  10.612
  779   3HG1  VAL 109          HG13      VAL 109 -19.830  18.570  10.350
  780   1HG2  VAL 109          HG21      VAL 109 -19.631  17.498   6.798
  781   2HG2  VAL 109          HG22      VAL 109 -18.862  18.538   7.997
  782   3HG2  VAL 109          HG23      VAL 109 -20.221  19.142   7.048
  783    H    LEU 110           HN       LEU 110 -23.438  17.519   7.209
  784    HA   LEU 110           HA       LEU 110 -22.660  17.058   4.365
  785   1HB   LEU 110          HB2       LEU 110 -25.130  16.086   5.818
  786   2HB   LEU 110          HB1       LEU 110 -25.077  16.229   4.061
  787    HG   LEU 110           HG       LEU 110 -23.179  14.578   5.758
  788   1HD1  LEU 110          HD11      LEU 110 -24.276  12.663   4.633
  789   2HD1  LEU 110          HD12      LEU 110 -25.384  13.778   3.832
  790   3HD1  LEU 110          HD13      LEU 110 -25.431  13.596   5.586
  791   1HD2  LEU 110          HD21      LEU 110 -23.322  15.244   2.822
  792   2HD2  LEU 110          HD22      LEU 110 -22.623  13.715   3.353
  793   3HD2  LEU 110          HD23      LEU 110 -21.916  15.240   3.887
  794    H    ALA 111           HN       ALA 111 -22.376  19.466   4.558
  795    HA   ALA 111           HA       ALA 111 -24.861  21.044   4.924
  796   1HB   ALA 111          HB1       ALA 111 -22.026  21.380   5.240
  797   2HB   ALA 111          HB2       ALA 111 -23.315  22.476   5.737
  798   3HB   ALA 111          HB3       ALA 111 -22.617  22.611   4.123
  799    H    THR 112           HN       THR 112 -26.122  21.475   3.157
  800    HA   THR 112           HA       THR 112 -24.916  21.239   0.437
  801    HB   THR 112           HB       THR 112 -26.902  19.892   1.021
  802    HG1  THR 112           HG1      THR 112 -26.579  21.210  -1.079
  803   1HG2  THR 112          HG21      THR 112 -27.668  22.276   2.346
  804   2HG2  THR 112          HG22      THR 112 -28.547  20.749   2.289
  805   3HG2  THR 112          HG23      THR 112 -28.864  21.993   1.081
  806    H    SER 113           HN       SER 113 -25.201  23.639   2.594
  807    HA   SER 113           HA       SER 113 -26.678  25.747   1.469
  808   1HB   SER 113          HB2       SER 113 -25.589  25.878   3.628
  809   2HB   SER 113          HB1       SER 113 -24.002  25.666   2.895
  810    HG   SER 113           HG       SER 113 -23.988  27.708   2.365
  811    H    THR 114           HN       THR 114 -25.633  27.717   0.336
  812    HA   THR 114           HA       THR 114 -23.805  26.761  -1.846
  813    HB   THR 114           HB       THR 114 -25.554  29.103  -2.301
  814    HG1  THR 114           HG1      THR 114 -26.870  26.675  -2.462
  815   1HG2  THR 114          HG21      THR 114 -25.435  28.372  -4.450
  816   2HG2  THR 114          HG22      THR 114 -25.710  26.690  -3.995
  817   3HG2  THR 114          HG23      THR 114 -24.098  27.391  -3.850
  818    H    ALA 115           HN       ALA 115 -24.561  29.308   0.462
  819    HA   ALA 115           HA       ALA 115 -22.520  31.153  -0.563
  820   1HB   ALA 115          HB1       ALA 115 -23.338  31.820   2.063
  821   2HB   ALA 115          HB2       ALA 115 -24.748  31.111   1.278
  822   3HB   ALA 115          HB3       ALA 115 -23.944  32.504   0.555
  823    H    VAL 116           HN       VAL 116 -22.094  28.273   0.819
  824    HA   VAL 116           HA       VAL 116 -20.210  29.044   2.967
  825    HB   VAL 116           HB       VAL 116 -21.840  27.101   3.033
  826   1HG1  VAL 116          HG11      VAL 116 -21.743  25.419   1.507
  827   2HG1  VAL 116          HG12      VAL 116 -19.980  25.409   1.495
  828   3HG1  VAL 116          HG13      VAL 116 -20.861  26.583   0.518
  829   1HG2  VAL 116          HG21      VAL 116 -19.003  27.143   3.716
  830   2HG2  VAL 116          HG22      VAL 116 -19.591  25.499   3.471
  831   3HG2  VAL 116          HG23      VAL 116 -20.368  26.546   4.659
  832    H    SER 117           HN       SER 117 -20.017  28.965  -0.337
  833    HA   SER 117           HA       SER 117 -17.317  27.728  -0.475
  834   1HB   SER 117          HB2       SER 117 -19.528  27.818  -2.139
  835   2HB   SER 117          HB1       SER 117 -18.451  29.006  -2.867
  836    HG   SER 117           HG       SER 117 -18.289  26.314  -2.858
  837    H    GLU 118           HN       GLU 118 -15.615  29.070  -0.023
  838    HA   GLU 118           HA       GLU 118 -15.286  31.607  -1.401
  839   1HB   GLU 118          HB2       GLU 118 -15.458  33.027   0.608
  840   2HB   GLU 118          HB1       GLU 118 -16.976  32.171   0.334
  841   1HG   GLU 118          HG2       GLU 118 -15.840  30.349   1.894
  842   2HG   GLU 118          HG1       GLU 118 -14.915  31.740   2.461
  843    H    GLN 119           HN       GLN 119 -13.344  30.138  -1.796
  844    HA   GLN 119           HA       GLN 119 -11.300  30.579   0.351
  845   1HB   GLN 119          HB2       GLN 119 -12.486  28.154  -0.386
  846   2HB   GLN 119          HB1       GLN 119 -10.928  28.144  -1.214
  847   1HG   GLN 119          HG2       GLN 119 -11.331  28.696   1.742
  848   2HG   GLN 119          HG1       GLN 119 -10.751  27.175   1.061
  849   1HE2  GLN 119          HE21      GLN 119  -9.868  30.541   1.702
  850   2HE2  GLN 119          HE22      GLN 119  -8.221  30.365   1.333
  Start of MODEL    6
    1   1H    ALA   1          HT1       ALA   1  29.141  11.986  -2.275
    2   2H    ALA   1          HT2       ALA   1  28.989  11.876  -0.586
    3   3H    ALA   1          HT3       ALA   1  28.825  10.486  -1.550
    4    HA   ALA   1           HA       ALA   1  31.262  11.197  -2.295
    5   1HB   ALA   1          HB1       ALA   1  31.140  11.994   0.610
    6   2HB   ALA   1          HB2       ALA   1  30.798  13.176  -0.653
    7   3HB   ALA   1          HB3       ALA   1  32.373  12.387  -0.587
    8    H    ARG   2           HN       ARG   2  30.258  10.347   1.040
    9    HA   ARG   2           HA       ARG   2  31.518   7.658   0.625
   10   1HB   ARG   2          HB2       ARG   2  31.861   9.700   2.540
   11   2HB   ARG   2          HB1       ARG   2  30.983   8.417   3.373
   12   1HG   ARG   2          HG2       ARG   2  32.757   7.001   3.316
   13   2HG   ARG   2          HG1       ARG   2  33.177   7.450   1.663
   14   1HD   ARG   2          HD2       ARG   2  33.744   9.757   3.131
   15   2HD   ARG   2          HD1       ARG   2  34.306   8.432   4.169
   16    HE   ARG   2           HE       ARG   2  35.414   7.556   1.979
   17   1HH1  ARG   2          HH21      ARG   2  34.557   9.958   0.370
   18   2HH1  ARG   2          HH22      ARG   2  35.973  10.953   0.441
   19   1HH2  ARG   2          HH11      ARG   2  37.376   9.229   3.102
   20   2HH2  ARG   2          HH12      ARG   2  37.568  10.540   1.987
   21    H    ILE   3           HN       ILE   3  29.122   8.932   2.953
   22    HA   ILE   3           HA       ILE   3  27.584   6.458   2.887
   23    HB   ILE   3           HB       ILE   3  27.208   9.210   4.101
   24   1HG1  ILE   3          HG12      ILE   3  27.475   6.878   5.848
   25   2HG1  ILE   3          HG11      ILE   3  28.863   7.074   4.777
   26   1HG2  ILE   3          HG21      ILE   3  25.044   8.662   4.420
   27   2HG2  ILE   3          HG22      ILE   3  25.603   7.360   5.469
   28   3HG2  ILE   3          HG23      ILE   3  25.296   7.046   3.761
   29   1HD1  ILE   3          HD11      ILE   3  29.194   9.355   5.523
   30   2HD1  ILE   3          HD12      ILE   3  29.084   8.323   6.948
   31   3HD1  ILE   3          HD13      ILE   3  27.704   9.308   6.465
   32    H    HIS   4           HN       HIS   4  25.607   6.098   1.830
   33    HA   HIS   4           HA       HIS   4  23.986   6.382   0.129
   34   1HB   HIS   4          HB2       HIS   4  24.114   8.717   1.887
   35   2HB   HIS   4          HB1       HIS   4  23.452   9.114   0.300
   36    HD1  HIS   4           HD1      HIS   4  20.972   9.155   0.713
   37    HD2  HIS   4           HD2      HIS   4  22.767   5.758   2.333
   38    HE1  HIS   4           HE1      HIS   4  19.091   7.684   1.554
   39    H    HIS   5           HN       HIS   5  23.465   8.406  -1.656
   40    HA   HIS   5           HA       HIS   5  24.245   9.274  -3.716
   41   1HB   HIS   5          HB2       HIS   5  26.034  10.056  -1.523
   42   2HB   HIS   5          HB1       HIS   5  26.817  10.113  -3.101
   43    HD1  HIS   5           HD1      HIS   5  25.517  12.495  -1.122
   44    HD2  HIS   5           HD2      HIS   5  24.272  11.222  -4.891
   45    HE1  HIS   5           HE1      HIS   5  24.181  14.403  -2.117
   46    H    HIS   6           HN       HIS   6  24.520   7.514  -5.113
   47    HA   HIS   6           HA       HIS   6  27.259   6.308  -5.184
   48   1HB   HIS   6          HB2       HIS   6  24.960   5.077  -4.223
   49   2HB   HIS   6          HB1       HIS   6  25.075   4.485  -5.881
   50    HD1  HIS   6           HD1      HIS   6  27.883   5.268  -3.425
   51    HD2  HIS   6           HD2      HIS   6  26.351   2.044  -5.577
   52    HE1  HIS   6           HE1      HIS   6  29.469   3.332  -3.040
   53    H    HIS   7           HN       HIS   7  24.149   6.132  -6.978
   54    HA   HIS   7           HA       HIS   7  25.659   6.868  -9.460
   55   1HB   HIS   7          HB2       HIS   7  24.583   4.351  -8.723
   56   2HB   HIS   7          HB1       HIS   7  23.516   5.000  -9.969
   57    HD1  HIS   7           HD1      HIS   7  25.052   2.682 -10.943
   58    HD2  HIS   7           HD2      HIS   7  26.717   6.503 -10.974
   59    HE1  HIS   7           HE1      HIS   7  26.914   2.639 -12.660
   60    H    HIS   8           HN       HIS   8  24.308   8.856  -8.227
   61    HA   HIS   8           HA       HIS   8  22.617  10.463  -8.606
   62   1HB   HIS   8          HB2       HIS   8  23.172   9.049 -11.026
   63   2HB   HIS   8          HB1       HIS   8  21.433   9.331 -10.956
   64    HD1  HIS   8           HD1      HIS   8  20.659  11.864 -10.663
   65    HD2  HIS   8           HD2      HIS   8  24.708  11.346 -11.509
   66    HE1  HIS   8           HE1      HIS   8  21.536  14.129 -11.381
   67    H    HIS   9           HN       HIS   9  22.004   8.109  -6.964
   68    HA   HIS   9           HA       HIS   9  20.077   7.238  -5.896
   69   1HB   HIS   9          HB2       HIS   9  19.442   9.724  -6.863
   70   2HB   HIS   9          HB1       HIS   9  18.227   8.723  -7.658
   71    HD1  HIS   9           HD1      HIS   9  16.418   9.847  -6.068
   72    HD2  HIS   9           HD2      HIS   9  19.279   7.531  -4.111
   73    HE1  HIS   9           HE1      HIS   9  15.527   9.428  -3.734
   74    H    ILE  10           HN       ILE  10  17.502   6.841  -7.263
   75    HA   ILE  10           HA       ILE  10  18.133   5.124  -9.596
   76    HB   ILE  10           HB       ILE  10  18.580   3.763  -7.574
   77   1HG1  ILE  10          HG12      ILE  10  17.178   1.875  -8.162
   78   2HG1  ILE  10          HG11      ILE  10  15.973   2.940  -8.888
   79   1HG2  ILE  10          HG21      ILE  10  16.556   5.201  -6.433
   80   2HG2  ILE  10          HG22      ILE  10  17.174   3.683  -5.782
   81   3HG2  ILE  10          HG23      ILE  10  15.729   3.685  -6.793
   82   1HD1  ILE  10          HD11      ILE  10  17.421   3.526 -10.685
   83   2HD1  ILE  10          HD12      ILE  10  17.588   1.778 -10.508
   84   3HD1  ILE  10          HD13      ILE  10  18.831   2.852  -9.866
   85    H    GLU  11           HN       GLU  11  16.655   6.359 -10.840
   86    HA   GLU  11           HA       GLU  11  13.859   6.610  -9.828
   87   1HB   GLU  11          HB2       GLU  11  15.221   7.803 -12.265
   88   2HB   GLU  11          HB1       GLU  11  13.674   8.298 -11.578
   89   1HG   GLU  11          HG2       GLU  11  16.373   8.492 -10.208
   90   2HG   GLU  11          HG1       GLU  11  15.441   9.841 -10.859
   91    H    GLY  12           HN       GLY  12  13.180   4.409 -10.229
   92   1HA   GLY  12          HA2       GLY  12  12.271   3.932 -12.946
   93   2HA   GLY  12          HA1       GLY  12  13.570   2.832 -12.481
   94    H    ARG  13           HN       ARG  13  10.701   4.163 -10.802
   95    HA   ARG  13           HA       ARG  13   9.992   1.344 -10.045
   96   1HB   ARG  13          HB2       ARG  13  10.560   3.735  -8.516
   97   2HB   ARG  13          HB1       ARG  13   8.918   3.182  -8.186
   98   1HG   ARG  13          HG2       ARG  13   9.692   0.996  -7.556
   99   2HG   ARG  13          HG1       ARG  13  11.322   1.343  -8.136
  100   1HD   ARG  13          HD2       ARG  13  11.620   1.754  -5.863
  101   2HD   ARG  13          HD1       ARG  13  11.093   3.368  -6.382
  102    HE   ARG  13           HE       ARG  13   8.829   1.654  -5.810
  103   1HH1  ARG  13          HH11      ARG  13   8.922   4.553  -5.116
  104   2HH1  ARG  13          HH12      ARG  13   9.062   4.517  -3.390
  105   1HH2  ARG  13          HH21      ARG  13  10.039   1.190  -3.275
  106   2HH2  ARG  13          HH22      ARG  13   9.695   2.612  -2.347
  107    H    ALA  14           HN       ALA  14   7.688   0.919  -9.900
  108    HA   ALA  14           HA       ALA  14   6.074   2.175 -11.916
  109   1HB   ALA  14          HB1       ALA  14   5.226   0.105 -11.499
  110   2HB   ALA  14          HB2       ALA  14   4.360   0.871 -10.167
  111   3HB   ALA  14          HB3       ALA  14   5.905   0.072  -9.871
  112    HA   PRO  15           HA       PRO  15   3.807   4.323  -8.305
  113   1HB   PRO  15          HB2       PRO  15   4.804   4.018  -5.776
  114   2HB   PRO  15          HB1       PRO  15   3.627   2.896  -6.489
  115   1HG   PRO  15          HG2       PRO  15   6.567   2.599  -6.163
  116   2HG   PRO  15          HG1       PRO  15   5.285   1.387  -6.018
  117   1HD   PRO  15          HD2       PRO  15   6.905   1.652  -8.214
  118   2HD   PRO  15          HD1       PRO  15   5.274   0.946  -8.256
  119    H    THR  16           HN       THR  16   4.347   6.470  -8.512
  120    HA   THR  16           HA       THR  16   7.092   7.392  -8.569
  121    HB   THR  16           HB       THR  16   5.224   8.376  -9.860
  122    HG1  THR  16           HG1      THR  16   6.350  10.123  -9.735
  123   1HG2  THR  16          HG21      THR  16   3.306   9.178  -8.907
  124   2HG2  THR  16          HG22      THR  16   4.145   9.765  -7.470
  125   3HG2  THR  16          HG23      THR  16   3.744   8.054  -7.621
  126    H    GLU  17           HN       GLU  17   4.565   7.306  -6.101
  127    HA   GLU  17           HA       GLU  17   5.640   9.162  -4.260
  128   1HB   GLU  17          HB2       GLU  17   4.136   6.578  -3.761
  129   2HB   GLU  17          HB1       GLU  17   4.209   7.961  -2.669
  130   1HG   GLU  17          HG2       GLU  17   3.407   8.950  -5.212
  131   2HG   GLU  17          HG1       GLU  17   2.422   7.525  -4.874
  132    H    GLN  18           HN       GLN  18   7.786   9.034  -3.626
  133    HA   GLN  18           HA       GLN  18   9.333   6.655  -3.483
  134   1HB   GLN  18          HB2       GLN  18   9.740   9.355  -3.392
  135   2HB   GLN  18          HB1       GLN  18  10.037   8.913  -1.711
  136   1HG   GLN  18          HG2       GLN  18  11.901   7.667  -2.221
  137   2HG   GLN  18          HG1       GLN  18  11.276   7.184  -3.799
  138   1HE2  GLN  18          HE21      GLN  18  11.837   8.482  -5.619
  139   2HE2  GLN  18          HE22      GLN  18  12.806   9.871  -5.510
  140    H    SER  19           HN       SER  19   8.476   8.689  -0.670
  141    HA   SER  19           HA       SER  19   8.776   6.467   1.183
  142   1HB   SER  19          HB2       SER  19   9.326   8.597   2.011
  143   2HB   SER  19          HB1       SER  19   7.914   9.350   1.273
  144    HG   SER  19           HG       SER  19   8.051   8.696   3.704
  145    HA   PRO  20           HA       PRO  20   4.572   5.082   0.716
  146   1HB   PRO  20          HB2       PRO  20   4.682   3.117   2.614
  147   2HB   PRO  20          HB1       PRO  20   5.400   2.941   1.001
  148   1HG   PRO  20          HG2       PRO  20   6.706   3.506   3.600
  149   2HG   PRO  20          HG1       PRO  20   7.299   2.584   2.211
  150   1HD   PRO  20          HD2       PRO  20   8.052   5.171   2.840
  151   2HD   PRO  20          HD1       PRO  20   8.213   4.420   1.238
  152    H    GLY  21           HN       GLY  21   2.637   5.519   1.846
  153   1HA   GLY  21          HA2       GLY  21   1.536   5.738   4.102
  154   2HA   GLY  21          HA1       GLY  21   2.959   6.656   4.597
  155    H    VAL  22           HN       VAL  22   1.474   7.000   1.427
  156    HA   VAL  22           HA       VAL  22   0.403   9.673   2.261
  157    HB   VAL  22           HB       VAL  22   2.069   8.928  -0.164
  158   1HG1  VAL  22          HG11      VAL  22   0.344  11.271   0.473
  159   2HG1  VAL  22          HG12      VAL  22   0.767  10.577  -1.093
  160   3HG1  VAL  22          HG13      VAL  22   1.916  11.615  -0.249
  161   1HG2  VAL  22          HG21      VAL  22   3.707   9.330   1.375
  162   2HG2  VAL  22          HG22      VAL  22   2.608  10.171   2.467
  163   3HG2  VAL  22          HG23      VAL  22   3.302  11.022   1.087
  164    H    GLN  23           HN       GLN  23  -1.604  10.153   1.376
  165    HA   GLN  23           HA       GLN  23  -3.579   9.880   0.102
  166   1HB   GLN  23          HB2       GLN  23  -1.330   9.031  -1.522
  167   2HB   GLN  23          HB1       GLN  23  -2.758   8.068  -1.902
  168   1HG   GLN  23          HG2       GLN  23  -4.036   9.980  -2.470
  169   2HG   GLN  23          HG1       GLN  23  -2.899  11.076  -1.682
  170   1HE2  GLN  23          HE21      GLN  23  -2.144   8.377  -3.928
  171   2HE2  GLN  23          HE22      GLN  23  -1.411   9.357  -5.104
  172    H    ASP  24           HN       ASP  24  -3.818   8.463   2.265
  173    HA   ASP  24           HA       ASP  24  -3.861   5.575   1.923
  174   1HB   ASP  24          HB2       ASP  24  -5.263   7.298   3.985
  175   2HB   ASP  24          HB1       ASP  24  -4.719   5.632   4.176
  176    H    CYS  25           HN       CYS  25  -5.240   5.900  -0.190
  177    HA   CYS  25           HA       CYS  25  -7.998   5.227   0.498
  178   1HB   CYS  25          HB2       CYS  25  -9.048   7.114  -0.498
  179   2HB   CYS  25          HB1       CYS  25  -7.744   7.785   0.477
  180    H    TYR  26           HN       TYR  26  -9.284   5.151  -1.821
  181    HA   TYR  26           HA       TYR  26  -7.415   4.162  -3.925
  182   1HB   TYR  26          HB2       TYR  26  -8.515   2.030  -4.038
  183   2HB   TYR  26          HB1       TYR  26  -8.147   2.311  -2.341
  184    HD1  TYR  26           HD1      TYR  26 -10.900   2.940  -4.827
  185    HD2  TYR  26           HD2      TYR  26  -9.847   2.005  -0.770
  186    HE1  TYR  26           HE1      TYR  26 -13.297   2.669  -4.264
  187    HE2  TYR  26           HE2      TYR  26 -12.243   1.732  -0.210
  188    HH   TYR  26           HH       TYR  26 -14.386   1.148  -1.541
  189    H    HIS  27           HN       HIS  27  -8.416   4.098  -6.047
  190    HA   HIS  27           HA       HIS  27 -10.776   5.916  -6.250
  191   1HB   HIS  27          HB2       HIS  27  -8.769   6.627  -7.395
  192   2HB   HIS  27          HB1       HIS  27  -8.584   5.045  -8.154
  193    HD1  HIS  27           HD1      HIS  27  -9.642   8.274  -9.033
  194    HD2  HIS  27           HD2      HIS  27 -11.287   4.495  -9.659
  195    HE1  HIS  27           HE1      HIS  27 -11.259   8.508 -10.968
  196    H    GLY  28           HN       GLY  28 -12.711   5.096  -6.955
  197   1HA   GLY  28          HA2       GLY  28 -14.235   3.669  -8.054
  198   2HA   GLY  28          HA1       GLY  28 -12.861   2.856  -8.806
  199    H    ASP  29           HN       ASP  29 -11.713   1.236  -7.518
  200    HA   ASP  29           HA       ASP  29 -13.133   0.250  -5.105
  201   1HB   ASP  29          HB2       ASP  29 -13.000  -0.969  -7.803
  202   2HB   ASP  29          HB1       ASP  29 -12.784  -2.066  -6.439
  203    H    GLY  30           HN       GLY  30 -10.335   1.243  -6.265
  204   1HA   GLY  30          HA2       GLY  30  -8.137   0.906  -5.474
  205   2HA   GLY  30          HA1       GLY  30  -8.769  -0.332  -4.383
  206    H    GLN  31           HN       GLN  31 -10.098  -1.253  -7.174
  207    HA   GLN  31           HA       GLN  31  -8.641  -3.579  -7.618
  208   1HB   GLN  31          HB2       GLN  31 -10.827  -2.627  -8.650
  209   2HB   GLN  31          HB1       GLN  31  -9.772  -1.908  -9.866
  210   1HG   GLN  31          HG2       GLN  31  -9.460  -4.819  -9.215
  211   2HG   GLN  31          HG1       GLN  31 -10.790  -4.312 -10.256
  212   1HE2  GLN  31          HE21      GLN  31  -8.689  -5.899 -11.325
  213   2HE2  GLN  31          HE22      GLN  31  -7.784  -4.954 -12.407
  214    H    SER  32           HN       SER  32  -6.507  -3.857  -8.120
  215    HA   SER  32           HA       SER  32  -4.433  -3.557  -9.223
  216   1HB   SER  32          HB2       SER  32  -6.241  -3.064 -11.076
  217   2HB   SER  32          HB1       SER  32  -5.724  -1.394 -10.863
  218    HG   SER  32           HG       SER  32  -4.278  -3.635 -11.758
  219    H    TYR  33           HN       TYR  33  -5.650  -1.640  -7.036
  220    HA   TYR  33           HA       TYR  33  -4.810   0.973  -7.134
  221   1HB   TYR  33          HB2       TYR  33  -5.786   0.007  -5.165
  222   2HB   TYR  33          HB1       TYR  33  -4.463  -1.146  -4.999
  223    HD1  TYR  33           HD1      TYR  33  -5.189   2.521  -5.021
  224    HD2  TYR  33           HD2      TYR  33  -2.592  -0.626  -3.681
  225    HE1  TYR  33           HE1      TYR  33  -3.955   4.144  -3.609
  226    HE2  TYR  33           HE2      TYR  33  -1.360   0.997  -2.272
  227    HH   TYR  33           HH       TYR  33  -1.815   4.398  -2.549
  228    H    ARG  34           HN       ARG  34  -2.981   1.446  -8.406
  229    HA   ARG  34           HA       ARG  34  -0.526   0.024  -8.456
  230   1HB   ARG  34          HB2       ARG  34   0.313   2.123  -9.474
  231   2HB   ARG  34          HB1       ARG  34  -1.273   1.687 -10.111
  232   1HG   ARG  34          HG2       ARG  34  -1.772   3.857  -9.606
  233   2HG   ARG  34          HG1       ARG  34  -2.015   3.205  -7.986
  234   1HD   ARG  34          HD2       ARG  34  -0.406   4.640  -7.277
  235   2HD   ARG  34          HD1       ARG  34   0.763   3.671  -8.196
  236    HE   ARG  34           HE       ARG  34  -0.487   5.269 -10.108
  237   1HH1  ARG  34          HH11      ARG  34  -0.340   6.902  -7.367
  238   2HH1  ARG  34          HH12      ARG  34   1.004   7.926  -7.749
  239   1HH2  ARG  34          HH21      ARG  34   1.947   6.093 -10.538
  240   2HH2  ARG  34          HH22      ARG  34   2.299   7.467  -9.545
  241    H    GLY  35           HN       GLY  35  -1.639   2.598  -6.277
  242   1HA   GLY  35          HA2       GLY  35   0.748   3.416  -5.099
  243   2HA   GLY  35          HA1       GLY  35  -0.755   3.251  -4.192
  244    H    SER  36           HN       SER  36   1.844   2.679  -3.116
  245    HA   SER  36           HA       SER  36   1.695  -0.305  -2.786
  246   1HB   SER  36          HB2       SER  36   4.187   0.422  -1.948
  247   2HB   SER  36          HB1       SER  36   3.815  -0.021  -3.612
  248    HG   SER  36           HG       SER  36   3.803   2.593  -2.492
  249    H    PHE  37           HN       PHE  37  -0.033   0.466  -1.123
  250    HA   PHE  37           HA       PHE  37   1.086   1.633   1.352
  251   1HB   PHE  37          HB2       PHE  37  -1.242   1.996   0.144
  252   2HB   PHE  37          HB1       PHE  37  -1.694   0.544   1.037
  253    HD1  PHE  37           HD1      PHE  37   0.514   1.408   3.263
  254    HD2  PHE  37           HD2      PHE  37  -2.983   3.204   1.531
  255    HE1  PHE  37           HE1      PHE  37   0.196   2.766   5.313
  256    HE2  PHE  37           HE2      PHE  37  -3.300   4.560   3.582
  257    HZ   PHE  37           HZ       PHE  37  -1.711   4.342   5.472
  258    H    SER  38           HN       SER  38   2.501  -0.116   2.004
  259    HA   SER  38           HA       SER  38   1.512  -2.825   2.349
  260   1HB   SER  38          HB2       SER  38   3.823  -2.303   3.921
  261   2HB   SER  38          HB1       SER  38   3.750  -3.078   2.342
  262    HG   SER  38           HG       SER  38   4.922  -1.345   1.894
  263    H    THR  39           HN       THR  39  -0.139  -0.800   3.779
  264    HA   THR  39           HA       THR  39   0.334  -1.749   6.582
  265    HB   THR  39           HB       THR  39  -1.042   0.835   5.876
  266    HG1  THR  39           HG1      THR  39   1.720   0.257   5.881
  267   1HG2  THR  39          HG21      THR  39  -1.150   0.196   8.188
  268   2HG2  THR  39          HG22      THR  39   0.062   1.472   8.069
  269   3HG2  THR  39          HG23      THR  39   0.565  -0.213   8.217
  270    H    THR  40           HN       THR  40  -1.622  -2.228   7.779
  271    HA   THR  40           HA       THR  40  -3.862  -3.082   6.053
  272    HB   THR  40           HB       THR  40  -4.574  -3.861   8.501
  273    HG1  THR  40           HG1      THR  40  -2.756  -2.515   9.297
  274   1HG2  THR  40          HG21      THR  40  -3.690  -5.915   7.954
  275   2HG2  THR  40          HG22      THR  40  -2.129  -5.239   7.490
  276   3HG2  THR  40          HG23      THR  40  -3.506  -5.112   6.395
  277    H    VAL  41           HN       VAL  41  -6.125  -2.739   7.122
  278    HA   VAL  41           HA       VAL  41  -6.709   0.079   7.158
  279    HB   VAL  41           HB       VAL  41  -8.167  -2.501   7.717
  280   1HG1  VAL  41          HG11      VAL  41  -9.316  -1.103   9.232
  281   2HG1  VAL  41          HG12      VAL  41 -10.257  -0.955   7.747
  282   3HG1  VAL  41          HG13      VAL  41  -9.125   0.318   8.204
  283   1HG2  VAL  41          HG21      VAL  41  -8.666  -0.306   5.688
  284   2HG2  VAL  41          HG22      VAL  41  -9.328  -1.941   5.680
  285   3HG2  VAL  41          HG23      VAL  41  -7.608  -1.683   5.385
  286    H    THR  42           HN       THR  42  -6.325  -2.359   9.721
  287    HA   THR  42           HA       THR  42  -7.176  -0.595  11.869
  288    HB   THR  42           HB       THR  42  -5.683  -3.222  11.677
  289    HG1  THR  42           HG1      THR  42  -7.928  -3.155  11.185
  290   1HG2  THR  42          HG21      THR  42  -4.948  -2.041  13.708
  291   2HG2  THR  42          HG22      THR  42  -5.979  -3.411  14.120
  292   3HG2  THR  42          HG23      THR  42  -6.630  -1.772  14.166
  293    H    GLY  43           HN       GLY  43  -4.415  -0.615   9.945
  294   1HA   GLY  43          HA2       GLY  43  -2.659   1.030  10.232
  295   2HA   GLY  43          HA1       GLY  43  -2.964   1.008  11.969
  296    H    ARG  44           HN       ARG  44  -3.066  -2.145  11.232
  297    HA   ARG  44           HA       ARG  44  -0.453  -2.716  12.337
  298   1HB   ARG  44          HB2       ARG  44  -2.905  -4.004  11.882
  299   2HB   ARG  44          HB1       ARG  44  -1.737  -4.899  10.909
  300   1HG   ARG  44          HG2       ARG  44  -0.316  -4.554  13.211
  301   2HG   ARG  44          HG1       ARG  44  -1.956  -4.672  13.850
  302   1HD   ARG  44          HD2       ARG  44  -0.690  -6.677  11.946
  303   2HD   ARG  44          HD1       ARG  44  -0.909  -6.918  13.691
  304    HE   ARG  44           HE       ARG  44  -2.999  -7.136  11.709
  305   1HH1  ARG  44          HH21      ARG  44  -2.386  -7.599  14.906
  306   2HH1  ARG  44          HH22      ARG  44  -3.936  -7.096  15.493
  307   1HH2  ARG  44          HH11      ARG  44  -4.962  -5.799  12.443
  308   2HH2  ARG  44          HH12      ARG  44  -5.396  -6.075  14.097
  309    H    THR  45           HN       THR  45   0.489  -4.816  10.812
  310    HA   THR  45           HA       THR  45   1.184  -3.522   8.192
  311    HB   THR  45           HB       THR  45   2.886  -5.026  10.204
  312    HG1  THR  45           HG1      THR  45   3.461  -3.100  10.755
  313   1HG2  THR  45          HG21      THR  45   3.453  -5.668   7.875
  314   2HG2  THR  45          HG22      THR  45   4.741  -4.733   8.634
  315   3HG2  THR  45          HG23      THR  45   3.659  -3.963   7.472
  316    H    CYS  46           HN       CYS  46   0.632  -4.831   6.488
  317    HA   CYS  46           HA       CYS  46  -0.406  -7.468   6.885
  318   1HB   CYS  46          HB2       CYS  46   0.579  -6.312   4.278
  319   2HB   CYS  46          HB1       CYS  46  -0.756  -7.431   4.534
  320    H    GLN  47           HN       GLN  47   0.525  -9.460   5.930
  321    HA   GLN  47           HA       GLN  47   3.446  -9.578   6.368
  322   1HB   GLN  47          HB2       GLN  47   2.104 -11.256   7.420
  323   2HB   GLN  47          HB1       GLN  47   1.225 -11.586   5.931
  324   1HG   GLN  47          HG2       GLN  47   2.808 -13.357   6.170
  325   2HG   GLN  47          HG1       GLN  47   3.460 -12.288   4.927
  326   1HE2  GLN  47          HE21      GLN  47   5.712 -12.548   5.295
  327   2HE2  GLN  47          HE22      GLN  47   6.468 -12.187   6.772
  328    H    SER  48           HN       SER  48   4.925 -10.091   4.706
  329    HA   SER  48           HA       SER  48   4.670  -9.320   2.085
  330   1HB   SER  48          HB2       SER  48   6.113 -11.738   3.211
  331   2HB   SER  48          HB1       SER  48   6.464 -11.005   1.648
  332    HG   SER  48           HG       SER  48   6.538  -9.003   3.213
  333    H    TRP  49           HN       TRP  49   3.753 -10.222   0.191
  334    HA   TRP  49           HA       TRP  49   1.592 -12.063   0.426
  335   1HB   TRP  49          HB2       TRP  49   3.383 -11.270  -1.899
  336   2HB   TRP  49          HB1       TRP  49   1.870 -12.160  -2.084
  337    HD1  TRP  49           HD1      TRP  49   3.246  -8.714  -1.408
  338    HE1  TRP  49           HE1      TRP  49   1.315  -7.031  -1.339
  339    HE3  TRP  49           HE3      TRP  49  -0.706 -11.878  -1.443
  340    HZ2  TRP  49           HZ2      TRP  49  -1.524  -7.004  -1.292
  341    HZ3  TRP  49           HZ3      TRP  49  -3.034 -11.023  -1.383
  342    HH2  TRP  49           HH2      TRP  49  -3.449  -8.577  -1.307
  343    H    SER  50           HN       SER  50   5.008 -12.453  -0.311
  344    HA   SER  50           HA       SER  50   4.888 -15.320  -0.811
  345   1HB   SER  50          HB2       SER  50   6.505 -13.473  -1.637
  346   2HB   SER  50          HB1       SER  50   7.287 -13.650  -0.069
  347    HG   SER  50           HG       SER  50   6.704 -15.922  -1.622
  348    H    SER  51           HN       SER  51   3.929 -14.224   1.928
  349    HA   SER  51           HA       SER  51   5.802 -14.923   3.967
  350   1HB   SER  51          HB2       SER  51   4.004 -14.486   5.340
  351   2HB   SER  51          HB1       SER  51   3.347 -13.799   3.859
  352    HG   SER  51           HG       SER  51   2.855 -16.311   5.047
  353    H    MET  52           HN       MET  52   6.502 -16.930   4.600
  354    HA   MET  52           HA       MET  52   4.873 -19.310   3.762
  355   1HB   MET  52          HB2       MET  52   7.888 -19.252   3.800
  356   2HB   MET  52          HB1       MET  52   6.824 -20.318   2.897
  357   1HG   MET  52          HG2       MET  52   6.146 -17.763   2.012
  358   2HG   MET  52          HG1       MET  52   7.903 -17.740   2.122
  359   1HE   MET  52          HE1       MET  52   5.101 -20.042  -0.529
  360   2HE   MET  52          HE2       MET  52   5.093 -18.312  -0.197
  361   3HE   MET  52          HE3       MET  52   4.813 -19.454   1.115
  362    H    THR  53           HN       THR  53   5.957 -17.633   6.384
  363    HA   THR  53           HA       THR  53   6.796 -20.046   7.925
  364    HB   THR  53           HB       THR  53   8.094 -18.612   9.096
  365    HG1  THR  53           HG1      THR  53   6.452 -17.910  10.377
  366   1HG2  THR  53          HG21      THR  53   8.235 -17.657   6.740
  367   2HG2  THR  53          HG22      THR  53   8.704 -16.559   8.038
  368   3HG2  THR  53          HG23      THR  53   7.121 -16.400   7.278
  369    HA   PRO  54           HA       PRO  54   3.025 -18.647  10.367
  370   1HB   PRO  54          HB2       PRO  54   1.670 -16.389   9.647
  371   2HB   PRO  54          HB1       PRO  54   3.111 -16.355  10.679
  372   1HG   PRO  54          HG2       PRO  54   2.797 -15.514   7.894
  373   2HG   PRO  54          HG1       PRO  54   4.037 -15.074   9.073
  374   1HD   PRO  54          HD2       PRO  54   4.220 -16.981   6.940
  375   2HD   PRO  54          HD1       PRO  54   5.466 -16.530   8.119
  376    H    HIS  55           HN       HIS  55   1.481 -16.898   7.748
  377    HA   HIS  55           HA       HIS  55  -0.221 -19.299   7.203
  378   1HB   HIS  55          HB2       HIS  55  -1.622 -17.390   6.063
  379   2HB   HIS  55          HB1       HIS  55  -1.596 -17.496   7.821
  380    HD1  HIS  55           HD1      HIS  55  -0.084 -15.769   9.099
  381    HD2  HIS  55           HD2      HIS  55  -0.377 -15.088   4.997
  382    HE1  HIS  55           HE1      HIS  55   0.821 -13.442   8.698
  383    H    TRP  56           HN       TRP  56   1.581 -20.163   5.848
  384    HA   TRP  56           HA       TRP  56   2.757 -18.968   3.615
  385   1HB   TRP  56          HB2       TRP  56   3.220 -21.216   4.603
  386   2HB   TRP  56          HB1       TRP  56   1.725 -21.809   3.883
  387    HD1  TRP  56           HD1      TRP  56   1.768 -20.786   1.056
  388    HE1  TRP  56           HE1      TRP  56   3.546 -21.423  -0.649
  389    HE3  TRP  56           HE3      TRP  56   5.472 -22.183   4.216
  390    HZ2  TRP  56           HZ2      TRP  56   6.217 -22.407  -0.687
  391    HZ3  TRP  56           HZ3      TRP  56   7.641 -22.951   3.312
  392    HH2  TRP  56           HH2      TRP  56   8.026 -23.078   0.874
  393    H    HIS  57           HN       HIS  57   2.067 -18.439   1.560
  394    HA   HIS  57           HA       HIS  57  -0.748 -19.162   0.824
  395   1HB   HIS  57          HB2       HIS  57  -1.061 -16.961   0.101
  396   2HB   HIS  57          HB1       HIS  57   0.055 -16.704   1.440
  397    HD1  HIS  57           HD1      HIS  57   2.600 -17.800  -0.155
  398    HD2  HIS  57           HD2      HIS  57  -0.026 -14.850  -1.492
  399    HE1  HIS  57           HE1      HIS  57   3.859 -16.456  -1.889
  400    H    GLN  58           HN       GLN  58  -0.818 -18.544  -1.799
  401    HA   GLN  58           HA       GLN  58   1.535 -19.932  -3.036
  402   1HB   GLN  58          HB2       GLN  58  -1.362 -20.569  -2.998
  403   2HB   GLN  58          HB1       GLN  58  -0.565 -20.743  -4.563
  404   1HG   GLN  58          HG2       GLN  58   1.060 -22.266  -3.661
  405   2HG   GLN  58          HG1       GLN  58   0.536 -21.937  -2.009
  406   1HE2  GLN  58          HE21      GLN  58  -0.505 -23.803  -1.286
  407   2HE2  GLN  58          HE22      GLN  58  -1.676 -24.662  -2.165
  408    H    ARG  59           HN       ARG  59   0.070 -17.063  -2.873
  409    HA   ARG  59           HA       ARG  59   0.170 -16.539  -5.823
  410   1HB   ARG  59          HB2       ARG  59  -1.677 -15.918  -3.735
  411   2HB   ARG  59          HB1       ARG  59  -0.972 -14.399  -4.292
  412   1HG   ARG  59          HG2       ARG  59  -1.463 -15.137  -6.657
  413   2HG   ARG  59          HG1       ARG  59  -2.359 -16.497  -5.980
  414   1HD   ARG  59          HD2       ARG  59  -3.293 -14.206  -4.605
  415   2HD   ARG  59          HD1       ARG  59  -3.243 -13.770  -6.325
  416    HE   ARG  59           HE       ARG  59  -4.797 -15.534  -6.788
  417   1HH1  ARG  59          HH11      ARG  59  -5.744 -14.550  -4.004
  418   2HH1  ARG  59          HH12      ARG  59  -6.047 -16.069  -3.230
  419   1HH2  ARG  59          HH21      ARG  59  -4.294 -17.917  -5.586
  420   2HH2  ARG  59          HH22      ARG  59  -5.223 -17.977  -4.125
  421    H    THR  60           HN       THR  60   2.649 -16.668  -4.764
  422    HA   THR  60           HA       THR  60   3.654 -14.266  -3.513
  423    HB   THR  60           HB       THR  60   4.852 -16.378  -3.450
  424    HG1  THR  60           HG1      THR  60   6.731 -15.475  -3.725
  425   1HG2  THR  60          HG21      THR  60   4.592 -16.172  -6.433
  426   2HG2  THR  60          HG22      THR  60   4.186 -17.529  -5.382
  427   3HG2  THR  60          HG23      THR  60   5.875 -17.144  -5.712
  428    H    THR  61           HN       THR  61   5.596 -13.196  -4.815
  429    HA   THR  61           HA       THR  61   4.431 -11.684  -6.988
  430    HB   THR  61           HB       THR  61   7.094 -11.168  -7.075
  431    HG1  THR  61           HG1      THR  61   8.066 -12.116  -5.493
  432   1HG2  THR  61          HG21      THR  61   5.651 -10.170  -4.666
  433   2HG2  THR  61          HG22      THR  61   4.917  -9.868  -6.241
  434   3HG2  THR  61          HG23      THR  61   6.541  -9.273  -5.896
  435    H    GLU  62           HN       GLU  62   5.899 -14.764  -6.734
  436    HA   GLU  62           HA       GLU  62   7.230 -14.913  -9.259
  437   1HB   GLU  62          HB2       GLU  62   6.995 -16.482  -7.057
  438   2HB   GLU  62          HB1       GLU  62   5.845 -17.291  -8.122
  439   1HG   GLU  62          HG2       GLU  62   7.976 -16.856  -9.808
  440   2HG   GLU  62          HG1       GLU  62   8.781 -17.185  -8.274
  441    H    TYR  63           HN       TYR  63   3.949 -15.048  -8.183
  442    HA   TYR  63           HA       TYR  63   2.919 -16.036 -10.752
  443   1HB   TYR  63          HB2       TYR  63   1.867 -15.293  -8.042
  444   2HB   TYR  63          HB1       TYR  63   0.737 -15.354  -9.394
  445    HD1  TYR  63           HD1      TYR  63   3.651 -17.401  -8.182
  446    HD2  TYR  63           HD2      TYR  63  -0.399 -17.366  -9.613
  447    HE1  TYR  63           HE1      TYR  63   3.565 -19.874  -8.000
  448    HE2  TYR  63           HE2      TYR  63  -0.485 -19.837  -9.432
  449    HH   TYR  63           HH       TYR  63   1.613 -21.758  -9.480
  450    H    TYR  64           HN       TYR  64   4.007 -13.120  -9.461
  451    HA   TYR  64           HA       TYR  64   2.697 -11.572 -11.636
  452   1HB   TYR  64          HB2       TYR  64   2.259 -11.334  -8.689
  453   2HB   TYR  64          HB1       TYR  64   2.347  -9.836  -9.615
  454    HD1  TYR  64           HD1      TYR  64   0.459 -12.945  -9.060
  455    HD2  TYR  64           HD2      TYR  64   0.689  -9.311 -11.339
  456    HE1  TYR  64           HE1      TYR  64  -1.868 -13.289  -9.844
  457    HE2  TYR  64           HE2      TYR  64  -1.639  -9.656 -12.123
  458    HH   TYR  64           HH       TYR  64  -3.223 -11.506 -12.412
  459    HA   PRO  65           HA       PRO  65   7.102 -10.500 -11.114
  460   1HB   PRO  65          HB2       PRO  65   7.488  -9.875 -13.751
  461   2HB   PRO  65          HB1       PRO  65   7.571 -11.534 -13.126
  462   1HG   PRO  65          HG2       PRO  65   5.349 -10.161 -14.556
  463   2HG   PRO  65          HG1       PRO  65   5.931 -11.826 -14.708
  464   1HD   PRO  65          HD2       PRO  65   3.703 -11.149 -13.300
  465   2HD   PRO  65          HD1       PRO  65   4.715 -12.557 -12.908
  466    H    ASN  66           HN       ASN  66   4.437  -8.754 -12.613
  467    HA   ASN  66           HA       ASN  66   5.766  -6.184 -11.821
  468   1HB   ASN  66          HB2       ASN  66   5.740  -6.795 -14.309
  469   2HB   ASN  66          HB1       ASN  66   3.988  -6.604 -14.235
  470   1HD2  ASN  66          HD21      ASN  66   6.301  -4.910 -15.498
  471   2HD2  ASN  66          HD22      ASN  66   5.944  -3.333 -14.983
  472    H    GLY  67           HN       GLY  67   4.018  -7.435 -10.059
  473   1HA   GLY  67          HA2       GLY  67   1.363  -6.173 -10.518
  474   2HA   GLY  67          HA1       GLY  67   1.709  -7.407  -9.305
  475    H    GLY  68           HN       GLY  68   4.292  -5.703  -8.801
  476   1HA   GLY  68          HA2       GLY  68   4.881  -3.818  -7.484
  477   2HA   GLY  68          HA1       GLY  68   3.186  -3.318  -7.497
  478    H    LEU  69           HN       LEU  69   3.804  -6.602  -6.727
  479    HA   LEU  69           HA       LEU  69   2.759  -6.201  -4.015
  480   1HB   LEU  69          HB2       LEU  69   3.484  -8.530  -5.791
  481   2HB   LEU  69          HB1       LEU  69   3.017  -8.775  -4.106
  482    HG   LEU  69           HG       LEU  69   1.305  -7.057  -5.872
  483   1HD1  LEU  69          HD11      LEU  69   0.021  -9.411  -6.058
  484   2HD1  LEU  69          HD12      LEU  69   1.682 -10.004  -6.034
  485   3HD1  LEU  69          HD13      LEU  69   1.171  -8.865  -7.279
  486   1HD2  LEU  69          HD21      LEU  69  -0.427  -8.196  -4.338
  487   2HD2  LEU  69          HD22      LEU  69   0.678  -7.048  -3.579
  488   3HD2  LEU  69          HD23      LEU  69   0.959  -8.782  -3.420
  489    H    THR  70           HN       THR  70   5.093  -4.903  -3.910
  490    HA   THR  70           HA       THR  70   7.406  -6.556  -3.311
  491    HB   THR  70           HB       THR  70   6.719  -3.692  -2.567
  492    HG1  THR  70           HG1      THR  70   6.847  -3.418  -4.629
  493   1HG2  THR  70          HG21      THR  70   8.633  -4.157  -1.338
  494   2HG2  THR  70          HG22      THR  70   9.338  -3.615  -2.860
  495   3HG2  THR  70          HG23      THR  70   9.221  -5.339  -2.508
  496    H    ARG  71           HN       ARG  71   8.046  -7.347  -1.284
  497    HA   ARG  71           HA       ARG  71   7.672  -8.111   0.937
  498   1HB   ARG  71          HB2       ARG  71   8.339  -5.544   0.853
  499   2HB   ARG  71          HB1       ARG  71   6.699  -5.319   1.462
  500   1HG   ARG  71          HG2       ARG  71   7.500  -7.304   3.102
  501   2HG   ARG  71          HG1       ARG  71   9.060  -6.538   2.794
  502   1HD   ARG  71          HD2       ARG  71   7.641  -4.313   3.254
  503   2HD   ARG  71          HD1       ARG  71   6.669  -5.446   4.214
  504    HE   ARG  71           HE       ARG  71   9.457  -5.913   4.712
  505   1HH1  ARG  71          HH21      ARG  71   7.207  -3.345   5.053
  506   2HH1  ARG  71          HH22      ARG  71   7.713  -2.926   6.655
  507   1HH2  ARG  71          HH11      ARG  71   9.991  -5.530   6.902
  508   2HH2  ARG  71          HH12      ARG  71   9.289  -4.164   7.703
  509    H    ASN  72           HN       ASN  72   5.565  -6.456   2.550
  510    HA   ASN  72           HA       ASN  72   3.284  -8.221   1.900
  511   1HB   ASN  72          HB2       ASN  72   2.504  -7.545   4.043
  512   2HB   ASN  72          HB1       ASN  72   4.255  -7.663   4.214
  513   1HD2  ASN  72          HD21      ASN  72   1.741  -5.198   3.359
  514   2HD2  ASN  72          HD22      ASN  72   2.552  -3.915   4.107
  515    H    TYR  73           HN       TYR  73   4.220  -5.664   0.310
  516    HA   TYR  73           HA       TYR  73   2.637  -3.454   0.409
  517   1HB   TYR  73          HB2       TYR  73   3.573  -5.232  -1.806
  518   2HB   TYR  73          HB1       TYR  73   2.461  -3.927  -2.221
  519    HD1  TYR  73           HD1      TYR  73   4.830  -3.759   0.608
  520    HD2  TYR  73           HD2      TYR  73   4.061  -2.583  -3.451
  521    HE1  TYR  73           HE1      TYR  73   6.693  -2.126   0.728
  522    HE2  TYR  73           HE2      TYR  73   5.924  -0.950  -3.331
  523    HH   TYR  73           HH       TYR  73   8.272  -1.008  -1.031
  524    H    CYS  74           HN       CYS  74   0.545  -2.856  -0.432
  525    HA   CYS  74           HA       CYS  74  -1.513  -4.975  -0.089
  526   1HB   CYS  74          HB2       CYS  74  -1.274  -2.027   0.160
  527   2HB   CYS  74          HB1       CYS  74  -2.841  -2.623  -0.384
  528    H    ARG  75           HN       ARG  75  -2.764  -5.682  -1.794
  529    HA   ARG  75           HA       ARG  75  -2.885  -4.108  -4.303
  530   1HB   ARG  75          HB2       ARG  75  -1.497  -6.746  -3.884
  531   2HB   ARG  75          HB1       ARG  75  -2.192  -6.362  -5.459
  532   1HG   ARG  75          HG2       ARG  75  -0.191  -4.641  -3.966
  533   2HG   ARG  75          HG1       ARG  75   0.186  -5.688  -5.332
  534   1HD   ARG  75          HD2       ARG  75  -1.595  -4.367  -6.641
  535   2HD   ARG  75          HD1       ARG  75  -1.511  -3.183  -5.320
  536    HE   ARG  75           HE       ARG  75   1.152  -3.798  -6.055
  537   1HH1  ARG  75          HH21      ARG  75  -1.065  -3.423  -8.446
  538   2HH1  ARG  75          HH22      ARG  75  -0.482  -1.904  -9.041
  539   1HH2  ARG  75          HH11      ARG  75   1.654  -1.374  -6.359
  540   2HH2  ARG  75          HH12      ARG  75   1.061  -0.745  -7.859
  541    H    ASN  76           HN       ASN  76  -4.691  -4.744  -5.612
  542    HA   ASN  76           HA       ASN  76  -6.611  -6.594  -4.246
  543   1HB   ASN  76          HB2       ASN  76  -7.377  -4.303  -4.372
  544   2HB   ASN  76          HB1       ASN  76  -6.937  -4.198  -6.075
  545   1HD2  ASN  76          HD21      ASN  76  -9.537  -3.576  -5.640
  546   2HD2  ASN  76          HD22      ASN  76 -10.573  -4.854  -6.057
  547    HA   PRO  77           HA       PRO  77  -5.571  -8.796  -8.086
  548   1HB   PRO  77          HB2       PRO  77  -5.830 -11.296  -7.020
  549   2HB   PRO  77          HB1       PRO  77  -4.351 -10.329  -6.863
  550   1HG   PRO  77          HG2       PRO  77  -6.473 -10.870  -4.877
  551   2HG   PRO  77          HG1       PRO  77  -4.742 -10.603  -4.637
  552   1HD   PRO  77          HD2       PRO  77  -6.751  -8.727  -4.194
  553   2HD   PRO  77          HD1       PRO  77  -5.021  -8.370  -4.376
  554    H    ASP  78           HN       ASP  78  -8.357  -7.983  -6.756
  555    HA   ASP  78           HA       ASP  78  -9.940  -9.844  -8.465
  556   1HB   ASP  78          HB2       ASP  78 -10.066 -10.596  -6.133
  557   2HB   ASP  78          HB1       ASP  78 -10.500  -8.969  -5.609
  558    H    ALA  79           HN       ALA  79 -11.380  -7.497  -6.306
  559    HA   ALA  79           HA       ALA  79 -11.319  -5.121  -7.750
  560   1HB   ALA  79          HB1       ALA  79 -12.735  -7.292  -9.079
  561   2HB   ALA  79          HB2       ALA  79 -12.237  -5.728  -9.725
  562   3HB   ALA  79          HB3       ALA  79 -13.767  -5.879  -8.859
  563    H    GLU  80           HN       GLU  80 -11.765  -5.890  -5.051
  564    HA   GLU  80           HA       GLU  80 -14.638  -5.412  -4.490
  565   1HB   GLU  80          HB2       GLU  80 -13.965  -5.947  -2.203
  566   2HB   GLU  80          HB1       GLU  80 -13.244  -7.125  -3.300
  567   1HG   GLU  80          HG2       GLU  80 -11.517  -4.817  -3.013
  568   2HG   GLU  80          HG1       GLU  80 -11.891  -5.513  -1.435
  569    H    ILE  81           HN       ILE  81 -14.549  -3.908  -2.193
  570    HA   ILE  81           HA       ILE  81 -14.521  -1.241  -2.992
  571    HB   ILE  81           HB       ILE  81 -14.178  -0.807  -0.516
  572   1HG1  ILE  81          HG12      ILE  81 -14.365  -3.279   0.625
  573   2HG1  ILE  81          HG11      ILE  81 -13.280  -3.617  -0.724
  574   1HG2  ILE  81          HG21      ILE  81 -16.160  -2.736  -1.647
  575   2HG2  ILE  81          HG22      ILE  81 -16.416  -1.114  -1.004
  576   3HG2  ILE  81          HG23      ILE  81 -16.145  -2.466   0.095
  577   1HD1  ILE  81          HD11      ILE  81 -11.599  -2.351   0.142
  578   2HD1  ILE  81          HD12      ILE  81 -12.449  -2.616   1.664
  579   3HD1  ILE  81          HD13      ILE  81 -12.708  -1.126   0.757
  580    H    SER  82           HN       SER  82 -11.784  -3.145  -1.733
  581    HA   SER  82           HA       SER  82  -9.868  -1.356  -3.040
  582   1HB   SER  82          HB2       SER  82  -9.177  -0.175  -1.185
  583   2HB   SER  82          HB1       SER  82 -10.828  -0.493  -0.662
  584    HG   SER  82           HG       SER  82  -8.449  -1.877   0.004
  585    HA   PRO  83           HA       PRO  83  -7.259  -4.862  -2.632
  586   1HB   PRO  83          HB2       PRO  83  -4.814  -3.823  -1.980
  587   2HB   PRO  83          HB1       PRO  83  -5.541  -3.642  -3.589
  588   1HG   PRO  83          HG2       PRO  83  -5.400  -1.694  -1.348
  589   2HG   PRO  83          HG1       PRO  83  -5.261  -1.424  -3.092
  590   1HD   PRO  83          HD2       PRO  83  -7.523  -0.902  -1.644
  591   2HD   PRO  83          HD1       PRO  83  -7.522  -1.281  -3.379
  592    H    TRP  84           HN       TRP  84  -6.265  -6.293  -1.104
  593    HA   TRP  84           HA       TRP  84  -6.460  -5.404   1.759
  594   1HB   TRP  84          HB2       TRP  84  -7.015  -7.951   2.045
  595   2HB   TRP  84          HB1       TRP  84  -8.272  -6.873   1.448
  596    HD1  TRP  84           HD1      TRP  84  -8.630  -6.831  -1.264
  597    HE1  TRP  84           HE1      TRP  84  -8.358  -8.731  -2.984
  598    HE3  TRP  84           HE3      TRP  84  -5.754 -10.066   1.445
  599    HZ2  TRP  84           HZ2      TRP  84  -7.089 -11.286  -3.184
  600    HZ3  TRP  84           HZ3      TRP  84  -5.028 -12.224   0.466
  601    HH2  TRP  84           HH2      TRP  84  -5.690 -12.837  -1.843
  602    H    CYS  85           HN       CYS  85  -5.293  -7.635   2.962
  603    HA   CYS  85           HA       CYS  85  -2.899  -8.546   1.627
  604   1HB   CYS  85          HB2       CYS  85  -1.333  -7.026   2.862
  605   2HB   CYS  85          HB1       CYS  85  -2.375  -6.161   1.736
  606    H    TYR  86           HN       TYR  86  -1.950 -10.161   2.873
  607    HA   TYR  86           HA       TYR  86  -3.243 -11.273   5.121
  608   1HB   TYR  86          HB2       TYR  86  -0.273 -11.373   4.510
  609   2HB   TYR  86          HB1       TYR  86  -1.248 -12.625   5.280
  610    HD1  TYR  86           HD1      TYR  86   0.357 -11.917   2.343
  611    HD2  TYR  86           HD2      TYR  86  -3.540 -13.069   3.735
  612    HE1  TYR  86           HE1      TYR  86  -0.150 -12.885   0.117
  613    HE2  TYR  86           HE2      TYR  86  -4.048 -14.037   1.509
  614    HH   TYR  86           HH       TYR  86  -3.347 -14.294  -0.586
  615    H    THR  87           HN       THR  87  -1.541 -11.539   7.234
  616    HA   THR  87           HA       THR  87  -1.041  -8.717   8.147
  617    HB   THR  87           HB       THR  87  -1.387 -10.298  10.399
  618    HG1  THR  87           HG1      THR  87  -2.326 -12.004   9.657
  619   1HG2  THR  87          HG21      THR  87  -2.447  -8.021   9.391
  620   2HG2  THR  87          HG22      THR  87  -3.070  -8.833  10.827
  621   3HG2  THR  87          HG23      THR  87  -3.839  -9.098   9.262
  622    H    MET  88           HN       MET  88   1.038  -8.335   8.864
  623    HA   MET  88           HA       MET  88   3.107 -10.326   8.640
  624   1HB   MET  88          HB2       MET  88   3.182  -7.765   8.452
  625   2HB   MET  88          HB1       MET  88   3.200  -7.750  10.216
  626   1HG   MET  88          HG2       MET  88   5.246  -9.016  10.284
  627   2HG   MET  88          HG1       MET  88   5.173  -9.332   8.551
  628   1HE   MET  88          HE1       MET  88   7.591  -7.297   7.369
  629   2HE   MET  88          HE2       MET  88   7.111  -8.865   8.014
  630   3HE   MET  88          HE3       MET  88   8.142  -7.804   8.972
  631    H    ASP  89           HN       ASP  89   0.730 -10.485  10.866
  632    HA   ASP  89           HA       ASP  89   2.580 -11.313  13.055
  633   1HB   ASP  89          HB2       ASP  89   1.045  -9.219  13.276
  634   2HB   ASP  89          HB1       ASP  89  -0.272 -10.386  13.399
  635    HA   PRO  90           HA       PRO  90   0.674 -15.238  12.508
  636   1HB   PRO  90          HB2       PRO  90   1.428 -16.362  14.887
  637   2HB   PRO  90          HB1       PRO  90   2.554 -16.104  13.540
  638   1HG   PRO  90          HG2       PRO  90   2.196 -14.531  16.034
  639   2HG   PRO  90          HG1       PRO  90   3.672 -14.892  15.126
  640   1HD   PRO  90          HD2       PRO  90   2.328 -12.488  15.025
  641   2HD   PRO  90          HD1       PRO  90   3.411 -13.089  13.752
  642    H    ASN  91           HN       ASN  91  -0.587 -12.860  14.346
  643    HA   ASN  91           HA       ASN  91  -2.564 -14.612  15.746
  644   1HB   ASN  91          HB2       ASN  91  -1.635 -11.745  16.069
  645   2HB   ASN  91          HB1       ASN  91  -3.044 -12.381  16.918
  646   1HD2  ASN  91          HD21      ASN  91   0.455 -13.090  16.417
  647   2HD2  ASN  91          HD22      ASN  91   0.686 -13.777  17.951
  648    H    VAL  92           HN       VAL  92  -2.165 -12.955  12.883
  649    HA   VAL  92           HA       VAL  92  -5.121 -12.537  12.617
  650    HB   VAL  92           HB       VAL  92  -2.872 -10.740  11.633
  651   1HG1  VAL  92          HG11      VAL  92  -5.895 -10.587  11.491
  652   2HG1  VAL  92          HG12      VAL  92  -4.744 -10.539  10.155
  653   3HG1  VAL  92          HG13      VAL  92  -4.863  -9.175  11.267
  654   1HG2  VAL  92          HG21      VAL  92  -4.224  -9.205  13.361
  655   2HG2  VAL  92          HG22      VAL  92  -2.904 -10.247  13.894
  656   3HG2  VAL  92          HG23      VAL  92  -4.577 -10.771  14.094
  657    H    ARG  93           HN       ARG  93  -5.928 -13.358  10.672
  658    HA   ARG  93           HA       ARG  93  -4.197 -14.932   8.982
  659   1HB   ARG  93          HB2       ARG  93  -6.835 -14.929   9.664
  660   2HB   ARG  93          HB1       ARG  93  -6.913 -14.184   8.066
  661   1HG   ARG  93          HG2       ARG  93  -5.405 -16.751   8.616
  662   2HG   ARG  93          HG1       ARG  93  -7.083 -16.719   8.075
  663   1HD   ARG  93          HD2       ARG  93  -6.522 -15.812   5.975
  664   2HD   ARG  93          HD1       ARG  93  -4.956 -15.207   6.552
  665    HE   ARG  93           HE       ARG  93  -5.177 -18.094   6.820
  666   1HH1  ARG  93          HH21      ARG  93  -4.919 -15.649   4.426
  667   2HH1  ARG  93          HH22      ARG  93  -3.741 -16.499   3.483
  668   1HH2  ARG  93          HH11      ARG  93  -3.469 -19.139   5.716
  669   2HH2  ARG  93          HH12      ARG  93  -2.919 -18.475   4.213
  670    H    TRP  94           HN       TRP  94  -6.306 -12.136   8.279
  671    HA   TRP  94           HA       TRP  94  -4.235 -10.874   6.622
  672   1HB   TRP  94          HB2       TRP  94  -5.385 -11.135   4.539
  673   2HB   TRP  94          HB1       TRP  94  -5.395 -12.736   5.277
  674    HD1  TRP  94           HD1      TRP  94  -7.686 -13.726   6.054
  675    HE1  TRP  94           HE1      TRP  94 -10.134 -13.002   5.693
  676    HE3  TRP  94           HE3      TRP  94  -6.954  -8.990   4.288
  677    HZ2  TRP  94           HZ2      TRP  94 -11.589 -10.716   4.775
  678    HZ3  TRP  94           HZ3      TRP  94  -8.885  -7.562   3.680
  679    HH2  TRP  94           HH2      TRP  94 -11.200  -8.418   3.921
  680    H    GLU  95           HN       GLU  95  -5.404  -8.829   5.498
  681    HA   GLU  95           HA       GLU  95  -7.765  -7.862   6.955
  682   1HB   GLU  95          HB2       GLU  95  -5.049  -7.446   7.903
  683   2HB   GLU  95          HB1       GLU  95  -5.849  -5.907   7.582
  684   1HG   GLU  95          HG2       GLU  95  -7.728  -6.533   8.998
  685   2HG   GLU  95          HG1       GLU  95  -7.051  -8.144   9.239
  686    H    TYR  96           HN       TYR  96  -8.468  -5.763   6.147
  687    HA   TYR  96           HA       TYR  96  -7.790  -5.328   3.345
  688   1HB   TYR  96          HB2       TYR  96  -9.759  -4.484   5.358
  689   2HB   TYR  96          HB1       TYR  96  -9.335  -3.202   4.224
  690    HD1  TYR  96           HD1      TYR  96 -11.685  -5.631   4.729
  691    HD2  TYR  96           HD2      TYR  96  -8.934  -4.342   1.691
  692    HE1  TYR  96           HE1      TYR  96 -13.104  -6.689   2.992
  693    HE2  TYR  96           HE2      TYR  96 -10.354  -5.400  -0.044
  694    HH   TYR  96           HH       TYR  96 -13.186  -6.024   0.031
  695    H    CYS  97           HN       CYS  97  -7.113  -3.111   2.576
  696    HA   CYS  97           HA       CYS  97  -4.965  -2.045   4.342
  697   1HB   CYS  97          HB2       CYS  97  -5.592  -1.503   1.425
  698   2HB   CYS  97          HB1       CYS  97  -4.074  -1.175   2.261
  699    H    ASN  98           HN       ASN  98  -4.848   0.210   4.817
  700    HA   ASN  98           HA       ASN  98  -7.247   1.609   5.368
  701   1HB   ASN  98          HB2       ASN  98  -4.340   2.255   5.063
  702   2HB   ASN  98          HB1       ASN  98  -5.472   3.603   5.181
  703   1HD2  ASN  98          HD21      ASN  98  -3.506   1.796   7.107
  704   2HD2  ASN  98          HD22      ASN  98  -4.390   1.835   8.556
  705    H    LEU  99           HN       LEU  99  -8.461   1.315   3.251
  706    HA   LEU  99           HA       LEU  99  -7.820   3.581   1.428
  707   1HB   LEU  99          HB2       LEU  99  -8.267   0.697   0.594
  708   2HB   LEU  99          HB1       LEU  99  -8.031   2.054  -0.505
  709    HG   LEU  99           HG       LEU  99  -6.023   1.174   1.586
  710   1HD1  LEU  99          HD11      LEU  99  -6.328  -0.473  -0.258
  711   2HD1  LEU  99          HD12      LEU  99  -4.736   0.286  -0.285
  712   3HD1  LEU  99          HD13      LEU  99  -5.981   0.806  -1.421
  713   1HD2  LEU  99          HD21      LEU  99  -4.958   3.109   1.122
  714   2HD2  LEU  99          HD22      LEU  99  -6.346   3.599   0.151
  715   3HD2  LEU  99          HD23      LEU  99  -4.999   2.748  -0.604
  716    H    THR 100           HN       THR 100  -9.616   4.586   0.705
  717    HA   THR 100           HA       THR 100 -12.270   3.268   0.792
  718    HB   THR 100           HB       THR 100 -13.006   5.557   1.778
  719    HG1  THR 100           HG1      THR 100 -11.449   6.734   2.723
  720   1HG2  THR 100          HG21      THR 100 -11.450   3.480   3.322
  721   2HG2  THR 100          HG22      THR 100 -13.199   3.601   3.132
  722   3HG2  THR 100          HG23      THR 100 -12.335   4.783   4.115
  723    H    GLN 101           HN       GLN 101 -13.792   4.503  -0.657
  724    HA   GLN 101           HA       GLN 101 -12.710   5.231  -3.136
  725   1HB   GLN 101          HB2       GLN 101 -15.224   5.420  -1.702
  726   2HB   GLN 101          HB1       GLN 101 -14.991   6.856  -2.700
  727   1HG   GLN 101          HG2       GLN 101 -14.927   5.635  -4.685
  728   2HG   GLN 101          HG1       GLN 101 -14.428   4.151  -3.874
  729   1HE2  GLN 101          HE21      GLN 101 -17.014   5.355  -5.479
  730   2HE2  GLN 101          HE22      GLN 101 -18.277   4.575  -4.654
  731    H    CYS 102           HN       CYS 102 -10.911   6.599  -3.041
  732    HA   CYS 102           HA       CYS 102 -10.208   8.695  -1.477
  733   1HB   CYS 102          HB2       CYS 102 -10.188   8.638  -4.511
  734   2HB   CYS 102          HB1       CYS 102  -9.165   9.673  -3.514
  735    HA   PRO 103           HA       PRO 103 -13.364  11.745  -1.661
  736   1HB   PRO 103          HB2       PRO 103 -11.904  13.957  -0.983
  737   2HB   PRO 103          HB1       PRO 103 -12.358  12.700   0.184
  738   1HG   PRO 103          HG2       PRO 103  -9.767  13.147  -1.202
  739   2HG   PRO 103          HG1       PRO 103 -10.084  12.614   0.455
  740   1HD   PRO 103          HD2       PRO 103  -9.358  10.930  -1.573
  741   2HD   PRO 103          HD1       PRO 103 -10.301  10.423  -0.155
  742    H    VAL 104           HN       VAL 104 -13.126  14.399  -2.416
  743    HA   VAL 104           HA       VAL 104 -13.346  14.361  -5.235
  744    HB   VAL 104           HB       VAL 104 -12.550  16.657  -3.418
  745   1HG1  VAL 104          HG11      VAL 104 -13.830  16.449  -6.143
  746   2HG1  VAL 104          HG12      VAL 104 -12.444  17.424  -5.652
  747   3HG1  VAL 104          HG13      VAL 104 -14.068  17.872  -5.129
  748   1HG2  VAL 104          HG21      VAL 104 -14.823  14.970  -3.288
  749   2HG2  VAL 104          HG22      VAL 104 -15.368  16.484  -4.009
  750   3HG2  VAL 104          HG23      VAL 104 -14.572  16.493  -2.436
  751    H    THR 105           HN       THR 105 -11.890  15.808  -6.678
  752    HA   THR 105           HA       THR 105  -8.995  15.523  -5.989
  753    HB   THR 105           HB       THR 105 -10.481  14.536  -8.439
  754    HG1  THR 105           HG1      THR 105 -10.077  13.319  -6.340
  755   1HG2  THR 105          HG21      THR 105  -7.533  15.003  -7.982
  756   2HG2  THR 105          HG22      THR 105  -8.529  15.556  -9.329
  757   3HG2  THR 105          HG23      THR 105  -8.123  13.846  -9.176
  758    H    GLU 106           HN       GLU 106 -11.218  16.691  -8.552
  759    HA   GLU 106           HA       GLU 106  -9.706  18.621  -9.801
  760   1HB   GLU 106          HB2       GLU 106 -12.341  17.882  -9.677
  761   2HB   GLU 106          HB1       GLU 106 -12.408  19.506  -8.991
  762   1HG   GLU 106          HG2       GLU 106 -11.109  18.788 -11.636
  763   2HG   GLU 106          HG1       GLU 106 -12.696  19.538 -11.455
  764    H    SER 107           HN       SER 107 -11.754  19.332  -6.940
  765    HA   SER 107           HA       SER 107  -9.814  21.511  -6.228
  766   1HB   SER 107          HB2       SER 107 -12.803  21.350  -6.374
  767   2HB   SER 107          HB1       SER 107 -12.079  22.420  -5.177
  768    HG   SER 107           HG       SER 107 -11.606  22.398  -7.980
  769    H    SER 108           HN       SER 108 -10.270  22.131  -3.770
  770    HA   SER 108           HA       SER 108 -11.008  19.816  -2.086
  771   1HB   SER 108          HB2       SER 108  -8.568  19.670  -2.966
  772   2HB   SER 108          HB1       SER 108  -8.241  21.005  -1.865
  773    HG   SER 108           HG       SER 108  -9.235  18.417  -1.260
  774    H    VAL 109           HN       VAL 109 -12.429  21.008  -0.817
  775    HA   VAL 109           HA       VAL 109 -11.287  23.043   0.978
  776    HB   VAL 109           HB       VAL 109 -11.765  24.407  -0.945
  777   1HG1  VAL 109          HG11      VAL 109 -14.393  24.258  -1.607
  778   2HG1  VAL 109          HG12      VAL 109 -14.094  22.582  -1.146
  779   3HG1  VAL 109          HG13      VAL 109 -13.135  23.329  -2.424
  780   1HG2  VAL 109          HG21      VAL 109 -14.276  24.708   0.699
  781   2HG2  VAL 109          HG22      VAL 109 -13.269  25.968  -0.017
  782   3HG2  VAL 109          HG23      VAL 109 -12.698  25.077   1.395
  783    H    LEU 110           HN       LEU 110 -12.349  22.889   2.934
  784    HA   LEU 110           HA       LEU 110 -15.000  21.481   2.960
  785   1HB   LEU 110          HB2       LEU 110 -14.255  20.564   5.116
  786   2HB   LEU 110          HB1       LEU 110 -13.056  20.216   3.869
  787    HG   LEU 110           HG       LEU 110 -12.610  22.798   5.175
  788   1HD1  LEU 110          HD11      LEU 110 -11.840  20.554   6.947
  789   2HD1  LEU 110          HD12      LEU 110 -13.560  20.942   6.927
  790   3HD1  LEU 110          HD13      LEU 110 -12.382  22.180   7.361
  791   1HD2  LEU 110          HD21      LEU 110 -10.446  21.047   5.555
  792   2HD2  LEU 110          HD22      LEU 110 -10.629  22.224   4.255
  793   3HD2  LEU 110          HD23      LEU 110 -11.161  20.560   4.019
  794    H    ALA 111           HN       ALA 111 -15.398  24.079   2.642
  795    HA   ALA 111           HA       ALA 111 -15.247  25.654   5.092
  796   1HB   ALA 111          HB1       ALA 111 -16.621  25.942   2.408
  797   2HB   ALA 111          HB2       ALA 111 -15.149  26.746   2.955
  798   3HB   ALA 111          HB3       ALA 111 -16.706  27.183   3.658
  799    H    THR 112           HN       THR 112 -16.406  23.874   6.399
  800    HA   THR 112           HA       THR 112 -19.328  23.699   5.951
  801    HB   THR 112           HB       THR 112 -18.521  22.445   8.362
  802    HG1  THR 112           HG1      THR 112 -16.825  21.141   7.020
  803   1HG2  THR 112          HG21      THR 112 -20.026  21.808   6.243
  804   2HG2  THR 112          HG22      THR 112 -19.379  20.579   7.329
  805   3HG2  THR 112          HG23      THR 112 -18.567  20.922   5.801
  806    H    SER 113           HN       SER 113 -17.596  24.053   9.038
  807    HA   SER 113           HA       SER 113 -19.652  25.612  10.270
  808   1HB   SER 113          HB2       SER 113 -18.239  24.547  11.765
  809   2HB   SER 113          HB1       SER 113 -16.808  24.850  10.784
  810    HG   SER 113           HG       SER 113 -18.258  26.891  12.115
  811    H    THR 114           HN       THR 114 -19.495  27.897  10.933
  812    HA   THR 114           HA       THR 114 -17.930  29.563   8.986
  813    HB   THR 114           HB       THR 114 -20.623  30.063  10.301
  814    HG1  THR 114           HG1      THR 114 -20.265  29.756   7.557
  815   1HG2  THR 114          HG21      THR 114 -18.880  31.953   9.424
  816   2HG2  THR 114          HG22      THR 114 -20.632  32.138   9.352
  817   3HG2  THR 114          HG23      THR 114 -19.743  31.599   7.927
  818    H    ALA 115           HN       ALA 115 -16.171  30.159  10.291
  819    HA   ALA 115           HA       ALA 115 -16.850  31.613  12.825
  820   1HB   ALA 115          HB1       ALA 115 -14.782  29.504  12.207
  821   2HB   ALA 115          HB2       ALA 115 -15.957  29.536  13.522
  822   3HB   ALA 115          HB3       ALA 115 -14.562  30.615  13.559
  823    H    VAL 116           HN       VAL 116 -15.086  33.176  13.442
  824    HA   VAL 116           HA       VAL 116 -13.820  34.344  10.991
  825    HB   VAL 116           HB       VAL 116 -15.503  35.732  12.095
  826   1HG1  VAL 116          HG11      VAL 116 -14.320  36.374  14.568
  827   2HG1  VAL 116          HG12      VAL 116 -14.259  34.615  14.462
  828   3HG1  VAL 116          HG13      VAL 116 -15.803  35.454  14.311
  829   1HG2  VAL 116          HG21      VAL 116 -12.801  36.470  11.676
  830   2HG2  VAL 116          HG22      VAL 116 -13.294  37.238  13.184
  831   3HG2  VAL 116          HG23      VAL 116 -14.206  37.535  11.704
  832    H    SER 117           HN       SER 117 -12.131  32.524  11.604
  833    HA   SER 117           HA       SER 117 -10.224  33.606  13.653
  834   1HB   SER 117          HB2       SER 117 -11.275  30.959  12.961
  835   2HB   SER 117          HB1       SER 117  -9.518  30.983  13.067
  836    HG   SER 117           HG       SER 117 -10.643  30.599  15.088
  837    H    GLU 118           HN       GLU 118  -8.061  33.904  13.005
  838    HA   GLU 118           HA       GLU 118  -7.051  32.917  10.449
  839   1HB   GLU 118          HB2       GLU 118  -8.695  35.096  10.316
  840   2HB   GLU 118          HB1       GLU 118  -7.126  35.878  10.504
  841   1HG   GLU 118          HG2       GLU 118  -6.334  34.237   8.650
  842   2HG   GLU 118          HG1       GLU 118  -8.053  34.027   8.316
  843    H    GLN 119           HN       GLN 119  -5.862  32.482  12.819
  844    HA   GLN 119           HA       GLN 119  -3.507  34.324  12.774
  845   1HB   GLN 119          HB2       GLN 119  -3.578  34.219  15.294
  846   2HB   GLN 119          HB1       GLN 119  -4.963  35.049  14.581
  847   1HG   GLN 119          HG2       GLN 119  -5.473  32.204  14.759
  848   2HG   GLN 119          HG1       GLN 119  -5.036  32.853  16.340
  849   1HE2  GLN 119          HE21      GLN 119  -7.756  32.006  15.213
  850   2HE2  GLN 119          HE22      GLN 119  -8.752  33.357  15.463
  Start of MODEL    7
    1   1H    ALA   1          HT1       ALA   1  29.065  -4.945   7.990
    2   2H    ALA   1          HT2       ALA   1  30.412  -5.004   9.024
    3   3H    ALA   1          HT3       ALA   1  30.626  -5.067   7.339
    4    HA   ALA   1           HA       ALA   1  31.114  -2.868   7.675
    5   1HB   ALA   1          HB1       ALA   1  28.334  -3.533   6.991
    6   2HB   ALA   1          HB2       ALA   1  29.464  -2.464   6.161
    7   3HB   ALA   1          HB3       ALA   1  28.535  -1.868   7.537
    8    H    ARG   2           HN       ARG   2  31.454  -1.323   9.256
    9    HA   ARG   2           HA       ARG   2  29.552  -1.091  11.523
   10   1HB   ARG   2          HB2       ARG   2  31.323  -1.552  13.150
   11   2HB   ARG   2          HB1       ARG   2  31.192  -2.912  12.034
   12   1HG   ARG   2          HG2       ARG   2  33.108  -0.663  11.458
   13   2HG   ARG   2          HG1       ARG   2  33.563  -1.958  12.567
   14   1HD   ARG   2          HD2       ARG   2  32.371  -3.154  10.247
   15   2HD   ARG   2          HD1       ARG   2  33.632  -2.022   9.718
   16    HE   ARG   2           HE       ARG   2  35.203  -3.191  11.240
   17   1HH1  ARG   2          HH11      ARG   2  32.926  -4.472  12.865
   18   2HH1  ARG   2          HH12      ARG   2  33.072  -6.126  12.371
   19   1HH2  ARG   2          HH21      ARG   2  35.064  -5.404   9.624
   20   2HH2  ARG   2          HH22      ARG   2  34.284  -6.654  10.534
   21    H    ILE   3           HN       ILE   3  30.071   0.804   9.503
   22    HA   ILE   3           HA       ILE   3  31.304   2.981  11.115
   23    HB   ILE   3           HB       ILE   3  32.149   2.021   8.371
   24   1HG1  ILE   3          HG12      ILE   3  33.224   1.030  10.400
   25   2HG1  ILE   3          HG11      ILE   3  34.361   1.946   9.411
   26   1HG2  ILE   3          HG21      ILE   3  32.916   4.618   9.738
   27   2HG2  ILE   3          HG22      ILE   3  31.810   4.496   8.370
   28   3HG2  ILE   3          HG23      ILE   3  33.503   4.043   8.177
   29   1HD1  ILE   3          HD11      ILE   3  33.504   2.426  12.156
   30   2HD1  ILE   3          HD12      ILE   3  33.281   3.850  11.141
   31   3HD1  ILE   3          HD13      ILE   3  34.874   3.106  11.278
   32    H    HIS   4           HN       HIS   4  29.697   4.506  11.148
   33    HA   HIS   4           HA       HIS   4  27.415   4.659   9.538
   34   1HB   HIS   4          HB2       HIS   4  28.739   6.160  11.538
   35   2HB   HIS   4          HB1       HIS   4  28.389   7.292  10.231
   36    HD1  HIS   4           HD1      HIS   4  25.751   6.757   9.220
   37    HD2  HIS   4           HD2      HIS   4  26.577   6.035  13.242
   38    HE1  HIS   4           HE1      HIS   4  23.518   6.717  10.413
   39    H    HIS   5           HN       HIS   5  27.656   4.502   7.298
   40    HA   HIS   5           HA       HIS   5  28.307   5.114   5.106
   41   1HB   HIS   5          HB2       HIS   5  28.084   7.674   6.692
   42   2HB   HIS   5          HB1       HIS   5  28.420   7.697   4.960
   43    HD1  HIS   5           HD1      HIS   5  26.610   6.261   3.467
   44    HD2  HIS   5           HD2      HIS   5  25.388   7.435   7.276
   45    HE1  HIS   5           HE1      HIS   5  24.085   6.072   3.498
   46    H    HIS   6           HN       HIS   6  30.063   6.820   4.019
   47    HA   HIS   6           HA       HIS   6  32.646   6.429   5.496
   48   1HB   HIS   6          HB2       HIS   6  33.547   5.928   3.143
   49   2HB   HIS   6          HB1       HIS   6  32.509   4.695   3.860
   50    HD1  HIS   6           HD1      HIS   6  32.369   7.560   1.373
   51    HD2  HIS   6           HD2      HIS   6  30.144   4.204   2.452
   52    HE1  HIS   6           HE1      HIS   6  30.533   7.331  -0.357
   53    H    HIS   7           HN       HIS   7  30.567   8.604   3.939
   54    HA   HIS   7           HA       HIS   7  32.834  10.523   3.500
   55   1HB   HIS   7          HB2       HIS   7  31.246   9.432   1.585
   56   2HB   HIS   7          HB1       HIS   7  30.288  10.852   2.008
   57    HD1  HIS   7           HD1      HIS   7  30.837  12.669   0.396
   58    HD2  HIS   7           HD2      HIS   7  34.239  10.527   1.500
   59    HE1  HIS   7           HE1      HIS   7  32.798  13.805  -0.736
   60    H    HIS   8           HN       HIS   8  32.088  12.847   3.691
   61    HA   HIS   8           HA       HIS   8  31.105  14.557   4.992
   62   1HB   HIS   8          HB2       HIS   8  28.855  12.561   4.617
   63   2HB   HIS   8          HB1       HIS   8  28.612  14.161   5.319
   64    HD1  HIS   8           HD1      HIS   8  29.284  16.234   3.743
   65    HD2  HIS   8           HD2      HIS   8  28.996  12.542   1.830
   66    HE1  HIS   8           HE1      HIS   8  29.145  16.722   1.261
   67    H    HIS   9           HN       HIS   9  29.489  14.621   7.146
   68    HA   HIS   9           HA       HIS   9  30.614  12.610   9.068
   69   1HB   HIS   9          HB2       HIS   9  30.357  15.624   9.270
   70   2HB   HIS   9          HB1       HIS   9  30.744  14.592  10.648
   71    HD1  HIS   9           HD1      HIS   9  32.723  12.636   9.506
   72    HD2  HIS   9           HD2      HIS   9  32.794  16.684   8.509
   73    HE1  HIS   9           HE1      HIS   9  35.074  13.136   8.708
   74    H    ILE  10           HN       ILE  10  28.005  14.925   8.354
   75    HA   ILE  10           HA       ILE  10  26.111  13.171   9.818
   76    HB   ILE  10           HB       ILE  10  27.103  14.803  11.432
   77   1HG1  ILE  10          HG12      ILE  10  24.696  15.956  11.845
   78   2HG1  ILE  10          HG11      ILE  10  24.219  14.697  10.705
   79   1HG2  ILE  10          HG21      ILE  10  25.621  17.029  10.115
   80   2HG2  ILE  10          HG22      ILE  10  27.159  16.552   9.395
   81   3HG2  ILE  10          HG23      ILE  10  27.099  17.077  11.078
   82   1HD1  ILE  10          HD11      ILE  10  24.256  13.218  12.399
   83   2HD1  ILE  10          HD12      ILE  10  24.898  14.438  13.499
   84   3HD1  ILE  10          HD13      ILE  10  25.998  13.466  12.521
   85    H    GLU  11           HN       GLU  11  25.204  12.851   7.671
   86    HA   GLU  11           HA       GLU  11  24.269  15.128   6.089
   87   1HB   GLU  11          HB2       GLU  11  24.585  12.246   5.903
   88   2HB   GLU  11          HB1       GLU  11  23.010  12.742   5.281
   89   1HG   GLU  11          HG2       GLU  11  25.476  14.262   4.478
   90   2HG   GLU  11          HG1       GLU  11  25.076  12.746   3.668
   91    H    GLY  12           HN       GLY  12  21.724  14.363   5.317
   92   1HA   GLY  12          HA2       GLY  12  20.156  14.411   7.865
   93   2HA   GLY  12          HA1       GLY  12  19.754  15.475   6.515
   94    H    ARG  13           HN       ARG  13  20.049  13.730   4.362
   95    HA   ARG  13           HA       ARG  13  17.848  11.764   4.895
   96   1HB   ARG  13          HB2       ARG  13  18.310  13.837   2.963
   97   2HB   ARG  13          HB1       ARG  13  18.244  12.290   2.118
   98   1HG   ARG  13          HG2       ARG  13  16.073  11.808   2.931
   99   2HG   ARG  13          HG1       ARG  13  16.180  13.041   4.189
  100   1HD   ARG  13          HD2       ARG  13  16.600  14.403   1.743
  101   2HD   ARG  13          HD1       ARG  13  15.212  13.328   1.483
  102    HE   ARG  13           HE       ARG  13  14.902  14.495   4.047
  103   1HH1  ARG  13          HH11      ARG  13  15.966  16.887   2.540
  104   2HH1  ARG  13          HH12      ARG  13  14.507  17.598   1.936
  105   1HH2  ARG  13          HH21      ARG  13  12.583  14.769   2.490
  106   2HH2  ARG  13          HH22      ARG  13  12.592  16.401   1.912
  107    H    ALA  14           HN       ALA  14  18.554   9.667   4.896
  108    HA   ALA  14           HA       ALA  14  21.169   8.820   4.166
  109   1HB   ALA  14          HB1       ALA  14  19.357   6.657   3.913
  110   2HB   ALA  14          HB2       ALA  14  18.667   7.742   5.119
  111   3HB   ALA  14          HB3       ALA  14  20.295   7.102   5.338
  112    HA   PRO  15           HA       PRO  15  19.401   7.241   0.039
  113   1HB   PRO  15          HB2       PRO  15  16.769   7.693  -0.541
  114   2HB   PRO  15          HB1       PRO  15  17.326   6.269   0.361
  115   1HG   PRO  15          HG2       PRO  15  16.063   8.766   1.358
  116   2HG   PRO  15          HG1       PRO  15  15.874   7.100   1.923
  117   1HD   PRO  15          HD2       PRO  15  17.432   8.990   3.166
  118   2HD   PRO  15          HD1       PRO  15  17.673   7.236   3.309
  119    H    THR  16           HN       THR  16  20.443   8.767  -1.242
  120    HA   THR  16           HA       THR  16  19.865  11.574  -1.269
  121    HB   THR  16           HB       THR  16  21.210   9.698  -3.239
  122    HG1  THR  16           HG1      THR  16  22.664   9.799  -1.744
  123   1HG2  THR  16          HG21      THR  16  20.311  12.142  -3.936
  124   2HG2  THR  16          HG22      THR  16  21.822  11.472  -4.551
  125   3HG2  THR  16          HG23      THR  16  21.845  12.600  -3.196
  126    H    GLU  17           HN       GLU  17  19.028   9.010  -3.635
  127    HA   GLU  17           HA       GLU  17  17.444  10.640  -5.334
  128   1HB   GLU  17          HB2       GLU  17  16.760   8.530  -6.263
  129   2HB   GLU  17          HB1       GLU  17  18.421   8.316  -5.710
  130   1HG   GLU  17          HG2       GLU  17  17.621   7.296  -3.626
  131   2HG   GLU  17          HG1       GLU  17  15.949   7.552  -4.126
  132    H    GLN  18           HN       GLN  18  15.093  10.801  -5.428
  133    HA   GLN  18           HA       GLN  18  13.489   9.750  -3.242
  134   1HB   GLN  18          HB2       GLN  18  14.393  12.607  -3.445
  135   2HB   GLN  18          HB1       GLN  18  12.841  12.235  -2.696
  136   1HG   GLN  18          HG2       GLN  18  14.170  10.495  -1.302
  137   2HG   GLN  18          HG1       GLN  18  15.597  11.394  -1.818
  138   1HE2  GLN  18          HE21      GLN  18  13.158  11.295   0.551
  139   2HE2  GLN  18          HE22      GLN  18  13.354  12.866   1.164
  140    H    SER  19           HN       SER  19  13.355   9.496  -6.102
  141    HA   SER  19           HA       SER  19  11.304  11.320  -7.125
  142   1HB   SER  19          HB2       SER  19  11.770  10.250  -9.131
  143   2HB   SER  19          HB1       SER  19  13.251   9.883  -8.252
  144    HG   SER  19           HG       SER  19  11.534   8.184  -9.269
  145    HA   PRO  20           HA       PRO  20   7.987   8.937  -5.366
  146   1HB   PRO  20          HB2       PRO  20   5.946  10.282  -6.597
  147   2HB   PRO  20          HB1       PRO  20   6.828  10.931  -5.200
  148   1HG   PRO  20          HG2       PRO  20   7.126  11.572  -8.090
  149   2HG   PRO  20          HG1       PRO  20   7.215  12.641  -6.681
  150   1HD   PRO  20          HD2       PRO  20   9.409  11.713  -8.017
  151   2HD   PRO  20          HD1       PRO  20   9.419  12.167  -6.298
  152    H    GLY  21           HN       GLY  21   7.283   6.971  -6.121
  153   1HA   GLY  21          HA2       GLY  21   7.531   6.248  -8.909
  154   2HA   GLY  21          HA1       GLY  21   6.815   5.243  -7.647
  155    H    VAL  22           HN       VAL  22   4.644   4.941  -7.770
  156    HA   VAL  22           HA       VAL  22   3.044   6.941  -9.337
  157    HB   VAL  22           HB       VAL  22   2.883   3.914  -9.194
  158   1HG1  VAL  22          HG11      VAL  22   1.218   4.844 -11.236
  159   2HG1  VAL  22          HG12      VAL  22   0.888   5.926  -9.884
  160   3HG1  VAL  22          HG13      VAL  22   0.695   4.184  -9.686
  161   1HG2  VAL  22          HG21      VAL  22   3.545   3.980 -11.508
  162   2HG2  VAL  22          HG22      VAL  22   4.675   5.008 -10.627
  163   3HG2  VAL  22          HG23      VAL  22   3.371   5.734 -11.568
  164    H    GLN  23           HN       GLN  23   1.745   7.990  -7.883
  165    HA   GLN  23           HA       GLN  23   0.440   8.351  -5.932
  166   1HB   GLN  23          HB2       GLN  23  -0.891   7.035  -7.721
  167   2HB   GLN  23          HB1       GLN  23  -0.649   5.632  -6.678
  168   1HG   GLN  23          HG2       GLN  23  -2.120   6.386  -5.112
  169   2HG   GLN  23          HG1       GLN  23  -1.588   8.059  -5.280
  170   1HE2  GLN  23          HE21      GLN  23  -3.769   8.911  -5.493
  171   2HE2  GLN  23          HE22      GLN  23  -4.715   8.610  -6.871
  172    H    ASP  24           HN       ASP  24   2.874   7.452  -5.081
  173    HA   ASP  24           HA       ASP  24   2.605   5.025  -3.449
  174   1HB   ASP  24          HB2       ASP  24   4.648   6.663  -4.553
  175   2HB   ASP  24          HB1       ASP  24   4.866   6.688  -2.802
  176    H    CYS  25           HN       CYS  25   0.591   6.698  -2.659
  177    HA   CYS  25           HA       CYS  25   1.304   7.215   0.128
  178   1HB   CYS  25          HB2       CYS  25   0.989   9.581   0.088
  179   2HB   CYS  25          HB1       CYS  25   2.023   9.227  -1.294
  180    H    TYR  26           HN       TYR  26  -0.824   8.417   1.157
  181    HA   TYR  26           HA       TYR  26  -3.297   7.531  -0.215
  182   1HB   TYR  26          HB2       TYR  26  -3.924   5.969   1.448
  183   2HB   TYR  26          HB1       TYR  26  -2.218   5.639   1.182
  184    HD1  TYR  26           HD1      TYR  26  -0.724   5.666   3.000
  185    HD2  TYR  26           HD2      TYR  26  -4.516   7.639   3.361
  186    HE1  TYR  26           HE1      TYR  26  -0.276   6.076   5.400
  187    HE2  TYR  26           HE2      TYR  26  -4.065   8.060   5.758
  188    HH   TYR  26           HH       TYR  26  -0.952   7.469   7.182
  189    H    HIS  27           HN       HIS  27  -5.257   8.175   1.195
  190    HA   HIS  27           HA       HIS  27  -4.619  10.712   2.671
  191   1HB   HIS  27          HB2       HIS  27  -6.899  11.401   1.725
  192   2HB   HIS  27          HB1       HIS  27  -5.598  11.232   0.547
  193    HD1  HIS  27           HD1      HIS  27  -5.639   9.100  -0.986
  194    HD2  HIS  27           HD2      HIS  27  -8.977   9.498   1.480
  195    HE1  HIS  27           HE1      HIS  27  -7.372   7.468  -1.855
  196    H    GLY  28           HN       GLY  28  -5.391  10.753   4.748
  197   1HA   GLY  28          HA2       GLY  28  -6.756  10.284   6.608
  198   2HA   GLY  28          HA1       GLY  28  -7.910   9.535   5.504
  199    H    ASP  29           HN       ASP  29  -7.521   7.298   4.866
  200    HA   ASP  29           HA       ASP  29  -5.596   5.811   6.586
  201   1HB   ASP  29          HB2       ASP  29  -8.574   5.457   6.297
  202   2HB   ASP  29          HB1       ASP  29  -7.541   4.165   6.909
  203    H    GLY  30           HN       GLY  30  -6.309   6.527   3.561
  204   1HA   GLY  30          HA2       GLY  30  -6.008   5.421   1.510
  205   2HA   GLY  30          HA1       GLY  30  -5.066   4.230   2.414
  206    H    GLN  31           HN       GLN  31  -8.129   4.571   3.796
  207    HA   GLN  31           HA       GLN  31  -8.937   1.898   3.172
  208   1HB   GLN  31          HB2       GLN  31  -9.590   3.654   5.034
  209   2HB   GLN  31          HB1       GLN  31 -10.864   4.089   3.893
  210   1HG   GLN  31          HG2       GLN  31 -10.805   1.256   3.997
  211   2HG   GLN  31          HG1       GLN  31 -10.741   1.825   5.666
  212   1HE2  GLN  31          HE21      GLN  31 -13.083   0.531   4.624
  213   2HE2  GLN  31          HE22      GLN  31 -14.337   1.674   4.558
  214    H    SER  32           HN       SER  32  -9.906   5.038   1.773
  215    HA   SER  32           HA       SER  32 -11.853   3.900  -0.052
  216   1HB   SER  32          HB2       SER  32 -10.343   6.529   0.042
  217   2HB   SER  32          HB1       SER  32 -11.699   6.207  -1.035
  218    HG   SER  32           HG       SER  32 -12.894   6.760   0.595
  219    H    TYR  33           HN       TYR  33  -8.520   3.639   0.006
  220    HA   TYR  33           HA       TYR  33  -7.698   4.119  -2.671
  221   1HB   TYR  33          HB2       TYR  33  -6.448   3.449  -0.465
  222   2HB   TYR  33          HB1       TYR  33  -6.725   1.797  -1.018
  223    HD1  TYR  33           HD1      TYR  33  -4.456   4.442  -1.092
  224    HD2  TYR  33           HD2      TYR  33  -6.212   1.485  -3.663
  225    HE1  TYR  33           HE1      TYR  33  -2.537   4.657  -2.645
  226    HE2  TYR  33           HE2      TYR  33  -4.292   1.700  -5.220
  227    HH   TYR  33           HH       TYR  33  -2.080   4.249  -5.062
  228    H    ARG  34           HN       ARG  34  -9.623   3.371  -3.915
  229    HA   ARG  34           HA       ARG  34 -10.071   0.439  -4.008
  230   1HB   ARG  34          HB2       ARG  34 -11.559   2.846  -4.442
  231   2HB   ARG  34          HB1       ARG  34 -11.568   1.922  -5.945
  232   1HG   ARG  34          HG2       ARG  34 -12.731   0.165  -5.023
  233   2HG   ARG  34          HG1       ARG  34 -12.027   0.403  -3.423
  234   1HD   ARG  34          HD2       ARG  34 -13.417   2.636  -3.434
  235   2HD   ARG  34          HD1       ARG  34 -14.374   1.807  -4.678
  236    HE   ARG  34           HE       ARG  34 -13.842   0.605  -1.984
  237   1HH1  ARG  34          HH21      ARG  34 -15.018  -0.968  -4.357
  238   2HH1  ARG  34          HH22      ARG  34 -16.703  -0.927  -3.959
  239   1HH2  ARG  34          HH11      ARG  34 -16.365   1.612  -1.626
  240   2HH2  ARG  34          HH12      ARG  34 -17.464   0.532  -2.417
  241    H    GLY  35           HN       GLY  35  -7.519   1.633  -4.996
  242   1HA   GLY  35          HA2       GLY  35  -7.759   1.239  -7.933
  243   2HA   GLY  35          HA1       GLY  35  -6.358   1.921  -7.104
  244    H    SER  36           HN       SER  36  -4.942   0.388  -8.137
  245    HA   SER  36           HA       SER  36  -5.162  -2.376  -6.992
  246   1HB   SER  36          HB2       SER  36  -3.844  -2.721  -9.351
  247   2HB   SER  36          HB1       SER  36  -5.592  -2.860  -9.188
  248    HG   SER  36           HG       SER  36  -4.288  -1.189 -10.697
  249    H    PHE  37           HN       PHE  37  -3.705  -0.627  -5.539
  250    HA   PHE  37           HA       PHE  37  -0.971  -0.247  -6.378
  251   1HB   PHE  37          HB2       PHE  37  -2.331   0.958  -4.580
  252   2HB   PHE  37          HB1       PHE  37  -2.048  -0.451  -3.558
  253    HD1  PHE  37           HD1      PHE  37  -0.110   1.834  -5.822
  254    HD2  PHE  37           HD2      PHE  37  -0.194  -0.396  -2.153
  255    HE1  PHE  37           HE1      PHE  37   2.140   2.702  -5.244
  256    HE2  PHE  37           HE2      PHE  37   2.056   0.472  -1.574
  257    HZ   PHE  37           HZ       PHE  37   3.223   2.021  -3.120
  258    H    SER  38           HN       SER  38  -1.038  -2.706  -7.163
  259    HA   SER  38           HA       SER  38  -0.682  -4.801  -5.233
  260   1HB   SER  38          HB2       SER  38   0.628  -4.890  -7.908
  261   2HB   SER  38          HB1       SER  38  -0.431  -6.067  -7.140
  262    HG   SER  38           HG       SER  38  -1.032  -4.076  -8.854
  263    H    THR  39           HN       THR  39   1.018  -2.648  -4.348
  264    HA   THR  39           HA       THR  39   3.697  -3.950  -4.660
  265    HB   THR  39           HB       THR  39   3.324  -0.966  -4.430
  266    HG1  THR  39           HG1      THR  39   3.444  -0.975  -6.749
  267   1HG2  THR  39          HG21      THR  39   5.442  -2.510  -5.921
  268   2HG2  THR  39          HG22      THR  39   5.562  -2.234  -4.183
  269   3HG2  THR  39          HG23      THR  39   5.519  -0.864  -5.293
  270    H    THR  40           HN       THR  40   4.631  -4.350  -2.663
  271    HA   THR  40           HA       THR  40   3.210  -3.405  -0.250
  272    HB   THR  40           HB       THR  40   4.679  -5.050   0.846
  273    HG1  THR  40           HG1      THR  40   6.567  -4.835  -0.233
  274   1HG2  THR  40          HG21      THR  40   2.863  -6.211   0.020
  275   2HG2  THR  40          HG22      THR  40   4.151  -7.004  -0.886
  276   3HG2  THR  40          HG23      THR  40   3.187  -5.739  -1.648
  277    H    VAL  41           HN       VAL  41   4.617  -2.680   1.631
  278    HA   VAL  41           HA       VAL  41   5.953  -0.250   1.085
  279    HB   VAL  41           HB       VAL  41   5.752  -2.200   3.360
  280   1HG1  VAL  41          HG11      VAL  41   7.706   0.082   3.137
  281   2HG1  VAL  41          HG12      VAL  41   7.954  -1.527   3.815
  282   3HG1  VAL  41          HG13      VAL  41   7.004  -0.335   4.701
  283   1HG2  VAL  41          HG21      VAL  41   4.961   0.677   2.846
  284   2HG2  VAL  41          HG22      VAL  41   4.808  -0.089   4.427
  285   3HG2  VAL  41          HG23      VAL  41   3.897  -0.713   3.053
  286    H    THR  42           HN       THR  42   7.282  -3.527   1.526
  287    HA   THR  42           HA       THR  42  10.059  -2.715   1.435
  288    HB   THR  42           HB       THR  42   8.710  -5.364   0.825
  289    HG1  THR  42           HG1      THR  42   8.126  -5.003   2.836
  290   1HG2  THR  42          HG21      THR  42  10.773  -6.254   0.679
  291   2HG2  THR  42          HG22      THR  42  11.295  -5.433   2.150
  292   3HG2  THR  42          HG23      THR  42  11.391  -4.604   0.598
  293    H    GLY  43           HN       GLY  43   7.725  -2.629  -0.956
  294   1HA   GLY  43          HA2       GLY  43   7.994  -2.153  -3.258
  295   2HA   GLY  43          HA1       GLY  43   9.736  -2.360  -3.058
  296    H    ARG  44           HN       ARG  44   8.114  -4.954  -1.684
  297    HA   ARG  44           HA       ARG  44   9.043  -6.806  -3.734
  298   1HB   ARG  44          HB2       ARG  44   8.776  -6.938  -1.098
  299   2HB   ARG  44          HB1       ARG  44   7.157  -7.503  -1.511
  300   1HG   ARG  44          HG2       ARG  44   8.000  -9.545  -1.927
  301   2HG   ARG  44          HG1       ARG  44   8.969  -8.856  -3.230
  302   1HD   ARG  44          HD2       ARG  44  10.624  -9.777  -1.836
  303   2HD   ARG  44          HD1       ARG  44  10.553  -8.105  -1.244
  304    HE   ARG  44           HE       ARG  44   8.570  -9.617   0.134
  305   1HH1  ARG  44          HH11      ARG  44  10.626 -11.692   0.337
  306   2HH1  ARG  44          HH12      ARG  44  11.565 -11.197   1.706
  307   1HH2  ARG  44          HH21      ARG  44  10.368  -7.942   1.683
  308   2HH2  ARG  44          HH22      ARG  44  11.418  -9.074   2.468
  309    H    THR  45           HN       THR  45   6.983  -8.680  -3.719
  310    HA   THR  45           HA       THR  45   4.808  -7.258  -5.219
  311    HB   THR  45           HB       THR  45   5.971 -10.040  -5.589
  312    HG1  THR  45           HG1      THR  45   6.185  -7.788  -7.284
  313   1HG2  THR  45          HG21      THR  45   3.643  -8.595  -6.707
  314   2HG2  THR  45          HG22      THR  45   3.925 -10.329  -6.555
  315   3HG2  THR  45          HG23      THR  45   4.655  -9.431  -7.885
  316    H    CYS  46           HN       CYS  46   2.967  -7.313  -3.971
  317    HA   CYS  46           HA       CYS  46   2.579  -9.107  -1.794
  318   1HB   CYS  46          HB2       CYS  46   1.401  -7.132  -1.580
  319   2HB   CYS  46          HB1       CYS  46   1.047  -7.044  -3.301
  320    H    GLN  47           HN       GLN  47   1.143 -10.909  -1.642
  321    HA   GLN  47           HA       GLN  47   0.813 -12.410  -4.164
  322   1HB   GLN  47          HB2       GLN  47   1.681 -13.639  -2.314
  323   2HB   GLN  47          HB1       GLN  47   0.483 -12.973  -1.210
  324   1HG   GLN  47          HG2       GLN  47  -0.842 -14.276  -3.417
  325   2HG   GLN  47          HG1       GLN  47   0.308 -15.387  -2.672
  326   1HE2  GLN  47          HE21      GLN  47  -1.747 -16.535  -1.903
  327   2HE2  GLN  47          HE22      GLN  47  -2.496 -15.969  -0.489
  328    H    SER  48           HN       SER  48  -1.110 -12.111  -5.289
  329    HA   SER  48           HA       SER  48  -3.361 -10.691  -4.556
  330   1HB   SER  48          HB2       SER  48  -3.633 -13.323  -5.989
  331   2HB   SER  48          HB1       SER  48  -4.383 -11.776  -6.371
  332    HG   SER  48           HG       SER  48  -2.783 -11.667  -7.746
  333    H    TRP  49           HN       TRP  49  -5.413 -11.315  -3.597
  334    HA   TRP  49           HA       TRP  49  -5.121 -13.061  -1.292
  335   1HB   TRP  49          HB2       TRP  49  -7.732 -12.007  -2.373
  336   2HB   TRP  49          HB1       TRP  49  -7.241 -12.227  -0.698
  337    HD1  TRP  49           HD1      TRP  49  -6.910  -9.813  -3.622
  338    HE1  TRP  49           HE1      TRP  49  -5.950  -7.598  -2.756
  339    HE3  TRP  49           HE3      TRP  49  -5.765 -11.125   1.130
  340    HZ2  TRP  49           HZ2      TRP  49  -4.855  -6.505  -0.379
  341    HZ3  TRP  49           HZ3      TRP  49  -4.768  -9.491   2.706
  342    HH2  TRP  49           HH2      TRP  49  -4.310  -7.171   1.953
  343    H    SER  50           HN       SER  50  -6.458 -13.365  -4.527
  344    HA   SER  50           HA       SER  50  -7.916 -15.840  -4.007
  345   1HB   SER  50          HB2       SER  50  -8.628 -14.367  -5.767
  346   2HB   SER  50          HB1       SER  50  -7.010 -14.318  -6.464
  347    HG   SER  50           HG       SER  50  -8.843 -15.864  -7.251
  348    H    SER  51           HN       SER  51  -4.680 -15.263  -3.954
  349    HA   SER  51           HA       SER  51  -3.607 -17.346  -5.655
  350   1HB   SER  51          HB2       SER  51  -2.664 -15.662  -3.343
  351   2HB   SER  51          HB1       SER  51  -1.636 -16.942  -3.980
  352    HG   SER  51           HG       SER  51  -1.251 -15.745  -5.663
  353    H    MET  52           HN       MET  52  -3.396 -19.528  -5.213
  354    HA   MET  52           HA       MET  52  -4.184 -20.431  -2.466
  355   1HB   MET  52          HB2       MET  52  -4.319 -22.055  -5.012
  356   2HB   MET  52          HB1       MET  52  -5.188 -22.323  -3.506
  357   1HG   MET  52          HG2       MET  52  -5.697 -19.699  -4.770
  358   2HG   MET  52          HG1       MET  52  -6.275 -21.090  -5.680
  359   1HE   MET  52          HE1       MET  52  -6.079 -19.160  -2.570
  360   2HE   MET  52          HE2       MET  52  -5.837 -20.703  -1.778
  361   3HE   MET  52          HE3       MET  52  -7.305 -19.790  -1.468
  362    H    THR  53           HN       THR  53  -1.469 -19.878  -4.110
  363    HA   THR  53           HA       THR  53  -0.164 -22.508  -3.732
  364    HB   THR  53           HB       THR  53   1.736 -20.565  -4.405
  365    HG1  THR  53           HG1      THR  53  -0.397 -20.071  -6.106
  366   1HG2  THR  53          HG21      THR  53   0.379 -22.826  -5.577
  367   2HG2  THR  53          HG22      THR  53   2.009 -22.228  -5.889
  368   3HG2  THR  53          HG23      THR  53   0.643 -21.580  -6.796
  369    HA   PRO  54           HA       PRO  54   2.343 -20.067  -0.523
  370   1HB   PRO  54          HB2       PRO  54   1.882 -17.392  -0.191
  371   2HB   PRO  54          HB1       PRO  54   3.026 -18.025  -1.391
  372   1HG   PRO  54          HG2       PRO  54   0.249 -17.031  -1.765
  373   2HG   PRO  54          HG1       PRO  54   1.667 -16.840  -2.807
  374   1HD   PRO  54          HD2       PRO  54  -0.337 -18.644  -3.273
  375   2HD   PRO  54          HD1       PRO  54   1.334 -18.840  -3.844
  376    H    HIS  55           HN       HIS  55   0.032 -17.511   0.031
  377    HA   HIS  55           HA       HIS  55  -1.019 -18.958   2.405
  378   1HB   HIS  55          HB2       HIS  55  -1.782 -16.161   1.598
  379   2HB   HIS  55          HB1       HIS  55  -1.511 -16.814   3.213
  380    HD1  HIS  55           HD1      HIS  55   0.373 -15.660   0.145
  381    HD2  HIS  55           HD2      HIS  55   1.150 -16.623   4.124
  382    HE1  HIS  55           HE1      HIS  55   2.789 -15.060   0.562
  383    H    TRP  56           HN       TRP  56  -3.057 -19.870   2.370
  384    HA   TRP  56           HA       TRP  56  -4.684 -19.543  -0.082
  385   1HB   TRP  56          HB2       TRP  56  -4.013 -21.717   1.219
  386   2HB   TRP  56          HB1       TRP  56  -5.353 -21.279   2.279
  387    HD1  TRP  56           HD1      TRP  56  -7.703 -20.653   0.806
  388    HE1  TRP  56           HE1      TRP  56  -8.738 -21.993  -1.103
  389    HE3  TRP  56           HE3      TRP  56  -3.621 -23.258  -0.668
  390    HZ2  TRP  56           HZ2      TRP  56  -7.931 -23.923  -3.039
  391    HZ3  TRP  56           HZ3      TRP  56  -3.769 -24.808  -2.573
  392    HH2  TRP  56           HH2      TRP  56  -5.908 -25.168  -3.765
  393    H    HIS  57           HN       HIS  57  -6.793 -18.746  -0.075
  394    HA   HIS  57           HA       HIS  57  -8.466 -17.223   0.586
  395   1HB   HIS  57          HB2       HIS  57  -8.118 -19.246   2.796
  396   2HB   HIS  57          HB1       HIS  57  -9.385 -18.023   2.887
  397    HD1  HIS  57           HD1      HIS  57 -10.019 -17.953  -0.202
  398    HD2  HIS  57           HD2      HIS  57  -9.797 -21.409   2.119
  399    HE1  HIS  57           HE1      HIS  57 -11.374 -19.717  -1.413
  400    H    GLN  58           HN       GLN  58  -8.114 -17.218   3.943
  401    HA   GLN  58           HA       GLN  58  -7.461 -15.480   5.406
  402   1HB   GLN  58          HB2       GLN  58  -5.265 -16.440   3.757
  403   2HB   GLN  58          HB1       GLN  58  -4.995 -14.772   4.257
  404   1HG   GLN  58          HG2       GLN  58  -4.449 -15.470   6.324
  405   2HG   GLN  58          HG1       GLN  58  -6.038 -16.217   6.496
  406   1HE2  GLN  58          HE21      GLN  58  -2.717 -16.916   6.349
  407   2HE2  GLN  58          HE22      GLN  58  -2.830 -18.577   6.020
  408    H    ARG  59           HN       ARG  59  -8.923 -13.779   4.935
  409    HA   ARG  59           HA       ARG  59  -9.655 -11.723   4.019
  410   1HB   ARG  59          HB2       ARG  59  -7.095 -11.568   5.001
  411   2HB   ARG  59          HB1       ARG  59  -6.881 -10.950   3.363
  412   1HG   ARG  59          HG2       ARG  59  -7.569  -8.975   4.266
  413   2HG   ARG  59          HG1       ARG  59  -9.180  -9.674   4.103
  414   1HD   ARG  59          HD2       ARG  59  -7.530 -10.207   6.577
  415   2HD   ARG  59          HD1       ARG  59  -8.520  -8.740   6.438
  416    HE   ARG  59           HE       ARG  59 -10.180 -10.846   5.616
  417   1HH1  ARG  59          HH21      ARG  59  -8.053 -10.931   8.237
  418   2HH1  ARG  59          HH22      ARG  59  -9.267 -11.259   9.427
  419   1HH2  ARG  59          HH11      ARG  59 -11.915 -10.845   7.225
  420   2HH2  ARG  59          HH12      ARG  59 -11.454 -11.213   8.854
  421    H    THR  60           HN       THR  60 -10.522 -12.908   2.106
  422    HA   THR  60           HA       THR  60  -9.052 -12.152  -0.394
  423    HB   THR  60           HB       THR  60  -8.629 -14.458  -0.277
  424    HG1  THR  60           HG1      THR  60 -10.484 -15.417  -1.542
  425   1HG2  THR  60          HG21      THR  60 -11.424 -14.845   0.819
  426   2HG2  THR  60          HG22      THR  60  -9.951 -14.832   1.790
  427   3HG2  THR  60          HG23      THR  60 -10.213 -16.109   0.602
  428    H    THR  61           HN       THR  61 -10.591 -12.326  -2.315
  429    HA   THR  61           HA       THR  61 -12.961 -10.778  -1.837
  430    HB   THR  61           HB       THR  61 -13.344 -11.861  -4.282
  431    HG1  THR  61           HG1      THR  61 -11.537 -13.309  -3.802
  432   1HG2  THR  61          HG21      THR  61 -12.693  -9.482  -3.466
  433   2HG2  THR  61          HG22      THR  61 -12.293  -9.940  -5.123
  434   3HG2  THR  61          HG23      THR  61 -11.047  -9.966  -3.875
  435    H    GLU  62           HN       GLU  62 -12.230 -14.106  -1.427
  436    HA   GLU  62           HA       GLU  62 -14.857 -15.156  -1.961
  437   1HB   GLU  62          HB2       GLU  62 -12.324 -16.153  -1.484
  438   2HB   GLU  62          HB1       GLU  62 -13.164 -16.532   0.020
  439   1HG   GLU  62          HG2       GLU  62 -14.073 -18.309  -1.021
  440   2HG   GLU  62          HG1       GLU  62 -14.984 -17.178  -2.022
  441    H    TYR  63           HN       TYR  63 -13.243 -13.587   0.650
  442    HA   TYR  63           HA       TYR  63 -15.530 -14.088   2.474
  443   1HB   TYR  63          HB2       TYR  63 -12.660 -13.606   2.697
  444   2HB   TYR  63          HB1       TYR  63 -13.583 -12.527   3.746
  445    HD1  TYR  63           HD1      TYR  63 -14.809 -15.847   2.711
  446    HD2  TYR  63           HD2      TYR  63 -12.914 -13.586   5.834
  447    HE1  TYR  63           HE1      TYR  63 -15.193 -17.715   4.296
  448    HE2  TYR  63           HE2      TYR  63 -13.298 -15.454   7.420
  449    HH   TYR  63           HH       TYR  63 -13.747 -18.356   6.762
  450    H    TYR  64           HN       TYR  64 -14.592 -11.940   0.083
  451    HA   TYR  64           HA       TYR  64 -16.397  -9.851   1.203
  452   1HB   TYR  64          HB2       TYR  64 -13.447  -9.673   0.804
  453   2HB   TYR  64          HB1       TYR  64 -14.402  -8.252   0.379
  454    HD1  TYR  64           HD1      TYR  64 -12.606  -9.662   2.971
  455    HD2  TYR  64           HD2      TYR  64 -16.427  -7.858   2.203
  456    HE1  TYR  64           HE1      TYR  64 -12.815  -9.082   5.373
  457    HE2  TYR  64           HE2      TYR  64 -16.637  -7.278   4.605
  458    HH   TYR  64           HH       TYR  64 -14.515  -8.555   6.996
  459    HA   PRO  65           HA       PRO  65 -17.178 -10.283  -3.226
  460   1HB   PRO  65          HB2       PRO  65 -19.771  -9.429  -3.072
  461   2HB   PRO  65          HB1       PRO  65 -19.284 -11.095  -2.699
  462   1HG   PRO  65          HG2       PRO  65 -19.927  -8.855  -0.857
  463   2HG   PRO  65          HG1       PRO  65 -20.268 -10.585  -0.697
  464   1HD   PRO  65          HD2       PRO  65 -18.226  -9.285   0.599
  465   2HD   PRO  65          HD1       PRO  65 -18.238 -11.025   0.239
  466    H    ASN  66           HN       ASN  66 -17.736  -7.581  -1.038
  467    HA   ASN  66           HA       ASN  66 -17.477  -5.684  -3.350
  468   1HB   ASN  66          HB2       ASN  66 -19.608  -5.900  -1.825
  469   2HB   ASN  66          HB1       ASN  66 -18.638  -4.998  -0.660
  470   1HD2  ASN  66          HD21      ASN  66 -17.589  -2.915  -1.626
  471   2HD2  ASN  66          HD22      ASN  66 -18.534  -2.028  -2.722
  472    H    GLY  67           HN       GLY  67 -15.135  -6.757  -2.208
  473   1HA   GLY  67          HA2       GLY  67 -14.165  -4.648  -0.341
  474   2HA   GLY  67          HA1       GLY  67 -13.368  -6.196  -0.630
  475    H    GLY  68           HN       GLY  68 -13.735  -5.950  -3.568
  476   1HA   GLY  68          HA2       GLY  68 -12.808  -4.724  -5.406
  477   2HA   GLY  68          HA1       GLY  68 -12.093  -3.590  -4.255
  478    H    LEU  69           HN       LEU  69 -11.616  -6.769  -3.251
  479    HA   LEU  69           HA       LEU  69  -8.758  -6.611  -3.696
  480   1HB   LEU  69          HB2       LEU  69 -10.705  -8.646  -2.600
  481   2HB   LEU  69          HB1       LEU  69  -8.978  -8.992  -2.709
  482    HG   LEU  69           HG       LEU  69 -10.306  -6.756  -1.166
  483   1HD1  LEU  69          HD11      LEU  69 -10.261  -8.991  -0.091
  484   2HD1  LEU  69          HD12      LEU  69  -9.218  -7.847   0.755
  485   3HD1  LEU  69          HD13      LEU  69  -8.513  -9.054  -0.322
  486   1HD2  LEU  69          HD21      LEU  69  -8.422  -5.581  -1.584
  487   2HD2  LEU  69          HD22      LEU  69  -7.628  -6.969  -2.313
  488   3HD2  LEU  69          HD23      LEU  69  -7.590  -6.753  -0.565
  489    H    THR  70           HN       THR  70  -9.468  -6.357  -6.148
  490    HA   THR  70           HA       THR  70  -9.908  -8.915  -7.546
  491    HB   THR  70           HB       THR  70  -9.547  -6.012  -8.295
  492    HG1  THR  70           HG1      THR  70 -11.639  -7.674  -9.097
  493   1HG2  THR  70          HG21      THR  70  -8.376  -7.330 -10.007
  494   2HG2  THR  70          HG22      THR  70  -9.876  -6.668 -10.655
  495   3HG2  THR  70          HG23      THR  70  -9.791  -8.367 -10.189
  496    H    ARG  71           HN       ARG  71  -8.202 -10.251  -8.033
  497    HA   ARG  71           HA       ARG  71  -6.006 -10.936  -8.597
  498   1HB   ARG  71          HB2       ARG  71  -6.656  -8.984 -10.256
  499   2HB   ARG  71          HB1       ARG  71  -5.456  -8.074  -9.339
  500   1HG   ARG  71          HG2       ARG  71  -3.989 -10.246  -9.729
  501   2HG   ARG  71          HG1       ARG  71  -5.080 -10.470 -11.097
  502   1HD   ARG  71          HD2       ARG  71  -4.209  -7.703 -10.949
  503   2HD   ARG  71          HD1       ARG  71  -2.817  -8.801 -11.041
  504    HE   ARG  71           HE       ARG  71  -4.916  -9.613 -12.861
  505   1HH1  ARG  71          HH21      ARG  71  -2.354  -7.351 -12.356
  506   2HH1  ARG  71          HH22      ARG  71  -2.039  -7.137 -14.045
  507   1HH2  ARG  71          HH11      ARG  71  -4.499  -9.356 -15.062
  508   2HH2  ARG  71          HH12      ARG  71  -3.252  -8.271 -15.575
  509    H    ASN  72           HN       ASN  72  -3.741  -8.909  -8.435
  510    HA   ASN  72           HA       ASN  72  -3.283  -9.153  -5.541
  511   1HB   ASN  72          HB2       ASN  72  -1.519  -9.944  -6.932
  512   2HB   ASN  72          HB1       ASN  72  -1.638  -8.547  -8.005
  513   1HD2  ASN  72          HD21      ASN  72  -1.901  -7.975  -4.586
  514   2HD2  ASN  72          HD22      ASN  72  -0.376  -7.273  -4.396
  515    H    TYR  73           HN       TYR  73  -5.119  -7.350  -5.469
  516    HA   TYR  73           HA       TYR  73  -3.950  -4.629  -5.916
  517   1HB   TYR  73          HB2       TYR  73  -6.749  -5.713  -5.448
  518   2HB   TYR  73          HB1       TYR  73  -6.390  -3.991  -5.534
  519    HD1  TYR  73           HD1      TYR  73  -4.030  -5.381  -7.628
  520    HD2  TYR  73           HD2      TYR  73  -8.270  -4.706  -7.452
  521    HE1  TYR  73           HE1      TYR  73  -4.150  -5.486 -10.102
  522    HE2  TYR  73           HE2      TYR  73  -8.388  -4.812  -9.927
  523    HH   TYR  73           HH       TYR  73  -7.222  -5.516 -11.793
  524    H    CYS  74           HN       CYS  74  -3.269  -3.510  -4.146
  525    HA   CYS  74           HA       CYS  74  -3.348  -4.595  -1.472
  526   1HB   CYS  74          HB2       CYS  74  -1.588  -3.131  -2.501
  527   2HB   CYS  74          HB1       CYS  74  -2.733  -1.792  -2.457
  528    H    ARG  75           HN       ARG  75  -4.803  -4.171   0.163
  529    HA   ARG  75           HA       ARG  75  -6.767  -1.949  -0.187
  530   1HB   ARG  75          HB2       ARG  75  -7.175  -4.813  -0.427
  531   2HB   ARG  75          HB1       ARG  75  -8.171  -4.148   0.867
  532   1HG   ARG  75          HG2       ARG  75  -9.407  -4.026  -1.234
  533   2HG   ARG  75          HG1       ARG  75  -8.983  -2.393  -0.719
  534   1HD   ARG  75          HD2       ARG  75  -7.548  -2.076  -2.480
  535   2HD   ARG  75          HD1       ARG  75  -6.993  -3.762  -2.458
  536    HE   ARG  75           HE       ARG  75  -8.980  -4.395  -3.699
  537   1HH1  ARG  75          HH11      ARG  75 -10.812  -2.293  -2.520
  538   2HH1  ARG  75          HH12      ARG  75 -11.072  -1.256  -3.883
  539   1HH2  ARG  75          HH21      ARG  75  -8.388  -2.512  -5.684
  540   2HH2  ARG  75          HH22      ARG  75  -9.698  -1.379  -5.673
  541    H    ASN  76           HN       ASN  76  -8.013  -1.634   1.935
  542    HA   ASN  76           HA       ASN  76  -6.296  -2.382   4.281
  543   1HB   ASN  76          HB2       ASN  76  -6.209   0.017   3.371
  544   2HB   ASN  76          HB1       ASN  76  -7.868   0.179   3.939
  545   1HD2  ASN  76          HD21      ASN  76  -6.678   1.895   5.377
  546   2HD2  ASN  76          HD22      ASN  76  -6.062   1.338   6.857
  547    HA   PRO  77           HA       PRO  77 -10.719  -3.686   4.916
  548   1HB   PRO  77          HB2       PRO  77 -10.136  -6.252   5.674
  549   2HB   PRO  77          HB1       PRO  77 -10.384  -5.780   3.981
  550   1HG   PRO  77          HG2       PRO  77  -7.844  -6.227   5.466
  551   2HG   PRO  77          HG1       PRO  77  -8.269  -6.662   3.804
  552   1HD   PRO  77          HD2       PRO  77  -6.736  -4.505   4.435
  553   2HD   PRO  77          HD1       PRO  77  -7.769  -4.579   2.990
  554    H    ASP  78           HN       ASP  78  -7.876  -3.265   6.666
  555    HA   ASP  78           HA       ASP  78  -9.139  -3.952   9.284
  556   1HB   ASP  78          HB2       ASP  78  -6.318  -3.414   8.321
  557   2HB   ASP  78          HB1       ASP  78  -6.715  -3.539  10.035
  558    H    ALA  79           HN       ALA  79  -8.442  -1.317   7.216
  559    HA   ALA  79           HA       ALA  79  -8.773   1.005   7.509
  560   1HB   ALA  79          HB1       ALA  79 -10.396  -0.424   9.409
  561   2HB   ALA  79          HB2       ALA  79 -10.719   1.133   8.644
  562   3HB   ALA  79          HB3       ALA  79  -9.811   1.064  10.154
  563    H    GLU  80           HN       GLU  80  -6.205  -0.059   8.165
  564    HA   GLU  80           HA       GLU  80  -5.413   1.219  10.727
  565   1HB   GLU  80          HB2       GLU  80  -3.536  -0.069   8.758
  566   2HB   GLU  80          HB1       GLU  80  -3.472  -0.079  10.518
  567   1HG   GLU  80          HG2       GLU  80  -5.885  -1.338   9.948
  568   2HG   GLU  80          HG1       GLU  80  -4.795  -1.942   8.699
  569    H    ILE  81           HN       ILE  81  -2.810   2.028   9.989
  570    HA   ILE  81           HA       ILE  81  -3.080   4.676   9.157
  571    HB   ILE  81           HB       ILE  81  -0.658   4.368   8.437
  572   1HG1  ILE  81          HG12      ILE  81  -0.153   1.819   9.465
  573   2HG1  ILE  81          HG11      ILE  81  -1.570   1.606   8.439
  574   1HG2  ILE  81          HG21      ILE  81  -1.352   3.060  11.077
  575   2HG2  ILE  81          HG22      ILE  81  -1.419   4.802  10.806
  576   3HG2  ILE  81          HG23      ILE  81   0.119   3.948  10.680
  577   1HD1  ILE  81          HD11      ILE  81  -0.147   3.160   6.798
  578   2HD1  ILE  81          HD12      ILE  81   0.071   1.410   6.832
  579   3HD1  ILE  81          HD13      ILE  81   1.193   2.456   7.703
  580    H    SER  82           HN       SER  82  -2.940   1.757   7.209
  581    HA   SER  82           HA       SER  82  -4.105   3.053   4.896
  582   1HB   SER  82          HB2       SER  82  -2.235   3.622   3.729
  583   2HB   SER  82          HB1       SER  82  -1.395   3.489   5.271
  584    HG   SER  82           HG       SER  82  -0.310   2.071   4.092
  585    HA   PRO  83           HA       PRO  83  -4.753  -1.107   3.680
  586   1HB   PRO  83          HB2       PRO  83  -4.162  -1.206   1.011
  587   2HB   PRO  83          HB1       PRO  83  -5.593  -0.378   1.656
  588   1HG   PRO  83          HG2       PRO  83  -3.009   0.752   0.734
  589   2HG   PRO  83          HG1       PRO  83  -4.647   1.398   0.570
  590   1HD   PRO  83          HD2       PRO  83  -2.825   2.272   2.428
  591   2HD   PRO  83          HD1       PRO  83  -4.587   2.413   2.612
  592    H    TRP  84           HN       TRP  84  -3.726  -3.144   3.317
  593    HA   TRP  84           HA       TRP  84  -0.747  -3.043   2.984
  594   1HB   TRP  84          HB2       TRP  84  -0.853  -5.082   4.575
  595   2HB   TRP  84          HB1       TRP  84  -1.137  -3.495   5.282
  596    HD1  TRP  84           HD1      TRP  84  -3.821  -2.799   5.537
  597    HE1  TRP  84           HE1      TRP  84  -5.801  -4.308   6.208
  598    HE3  TRP  84           HE3      TRP  84  -1.809  -7.386   4.547
  599    HZ2  TRP  84           HZ2      TRP  84  -6.442  -7.096   6.315
  600    HZ3  TRP  84           HZ3      TRP  84  -3.122  -9.449   4.943
  601    HH2  TRP  84           HH2      TRP  84  -5.436  -9.309   5.825
  602    H    CYS  85           HN       CYS  85  -0.364  -5.870   2.877
  603    HA   CYS  85           HA       CYS  85  -2.239  -7.118   1.052
  604   1HB   CYS  85          HB2       CYS  85  -0.979  -5.068  -0.095
  605   2HB   CYS  85          HB1       CYS  85   0.285  -6.276  -0.315
  606    H    TYR  86           HN       TYR  86  -1.736  -9.296   0.858
  607    HA   TYR  86           HA       TYR  86   0.230 -10.529   2.479
  608   1HB   TYR  86          HB2       TYR  86  -1.415 -11.295   0.075
  609   2HB   TYR  86          HB1       TYR  86  -0.236 -12.438   0.724
  610    HD1  TYR  86           HD1      TYR  86  -0.289 -12.713   3.358
  611    HD2  TYR  86           HD2      TYR  86  -3.572 -11.294   0.985
  612    HE1  TYR  86           HE1      TYR  86  -1.856 -13.305   5.183
  613    HE2  TYR  86           HE2      TYR  86  -5.145 -11.887   2.812
  614    HH   TYR  86           HH       TYR  86  -3.953 -13.238   5.892
  615    H    THR  87           HN       THR  87   1.833 -12.194   1.043
  616    HA   THR  87           HA       THR  87   3.426 -10.376  -0.743
  617    HB   THR  87           HB       THR  87   5.252 -12.081   0.368
  618    HG1  THR  87           HG1      THR  87   4.262 -12.989   1.962
  619   1HG2  THR  87          HG21      THR  87   4.771  -9.815   2.121
  620   2HG2  THR  87          HG22      THR  87   4.655  -9.360   0.421
  621   3HG2  THR  87          HG23      THR  87   6.123 -10.122   1.032
  622    H    MET  88           HN       MET  88   3.986 -11.262  -2.692
  623    HA   MET  88           HA       MET  88   3.003 -13.864  -3.509
  624   1HB   MET  88          HB2       MET  88   3.660 -11.518  -4.707
  625   2HB   MET  88          HB1       MET  88   5.109 -12.463  -5.058
  626   1HG   MET  88          HG2       MET  88   2.672 -14.014  -5.467
  627   2HG   MET  88          HG1       MET  88   2.708 -12.563  -6.469
  628   1HE   MET  88          HE1       MET  88   5.139 -12.729  -8.908
  629   2HE   MET  88          HE2       MET  88   3.660 -12.127  -8.163
  630   3HE   MET  88          HE3       MET  88   3.603 -13.562  -9.185
  631    H    ASP  89           HN       ASP  89   5.422 -13.403  -1.385
  632    HA   ASP  89           HA       ASP  89   7.145 -15.518  -2.602
  633   1HB   ASP  89          HB2       ASP  89   7.758 -13.127  -0.840
  634   2HB   ASP  89          HB1       ASP  89   8.926 -14.411  -1.153
  635    HA   PRO  90           HA       PRO  90   6.019 -17.841   0.965
  636   1HB   PRO  90          HB2       PRO  90   8.010 -19.714   0.833
  637   2HB   PRO  90          HB1       PRO  90   6.623 -19.700  -0.275
  638   1HG   PRO  90          HG2       PRO  90   9.412 -18.782  -0.724
  639   2HG   PRO  90          HG1       PRO  90   8.285 -19.563  -1.842
  640   1HD   PRO  90          HD2       PRO  90   8.838 -16.864  -1.819
  641   2HD   PRO  90          HD1       PRO  90   7.351 -17.581  -2.476
  642    H    ASN  91           HN       ASN  91   8.449 -15.674   0.901
  643    HA   ASN  91           HA       ASN  91   9.704 -16.569   3.460
  644   1HB   ASN  91          HB2       ASN  91  10.557 -15.217   1.026
  645   2HB   ASN  91          HB1       ASN  91  10.964 -14.264   2.454
  646   1HD2  ASN  91          HD21      ASN  91  11.289 -17.576   1.099
  647   2HD2  ASN  91          HD22      ASN  91  12.712 -17.948   1.948
  648    H    VAL  92           HN       VAL  92   7.229 -14.634   2.288
  649    HA   VAL  92           HA       VAL  92   7.338 -12.909   4.731
  650    HB   VAL  92           HB       VAL  92   6.579 -12.100   1.895
  651   1HG1  VAL  92          HG11      VAL  92   5.416 -10.851   3.705
  652   2HG1  VAL  92          HG12      VAL  92   6.561  -9.824   2.841
  653   3HG1  VAL  92          HG13      VAL  92   6.977 -10.466   4.428
  654   1HG2  VAL  92          HG21      VAL  92   8.713 -10.657   2.256
  655   2HG2  VAL  92          HG22      VAL  92   8.927 -12.361   1.858
  656   3HG2  VAL  92          HG23      VAL  92   9.106 -11.815   3.526
  657    H    ARG  93           HN       ARG  93   5.357 -12.846   5.796
  658    HA   ARG  93           HA       ARG  93   3.181 -14.506   4.850
  659   1HB   ARG  93          HB2       ARG  93   4.002 -14.039   7.253
  660   2HB   ARG  93          HB1       ARG  93   3.149 -12.502   7.113
  661   1HG   ARG  93          HG2       ARG  93   1.111 -13.923   6.390
  662   2HG   ARG  93          HG1       ARG  93   2.004 -15.293   7.053
  663   1HD   ARG  93          HD2       ARG  93   1.563 -14.662   9.193
  664   2HD   ARG  93          HD1       ARG  93   1.984 -12.971   8.855
  665    HE   ARG  93           HE       ARG  93  -0.373 -13.184   7.527
  666   1HH1  ARG  93          HH11      ARG  93  -0.179 -11.885  10.263
  667   2HH1  ARG  93          HH12      ARG  93  -1.396 -12.752  11.141
  668   1HH2  ARG  93          HH21      ARG  93  -1.609 -15.324   8.826
  669   2HH2  ARG  93          HH22      ARG  93  -2.205 -14.698  10.326
  670    H    TRP  94           HN       TRP  94   3.441 -11.046   5.664
  671    HA   TRP  94           HA       TRP  94   1.852 -10.289   3.300
  672   1HB   TRP  94          HB2       TRP  94   0.038  -9.354   4.577
  673   2HB   TRP  94          HB1       TRP  94   0.291 -10.979   5.211
  674    HD1  TRP  94           HD1      TRP  94   1.320 -11.228   7.623
  675    HE1  TRP  94           HE1      TRP  94   1.632  -9.561   9.564
  676    HE3  TRP  94           HE3      TRP  94   0.538  -6.834   5.144
  677    HZ2  TRP  94           HZ2      TRP  94   1.557  -6.736  10.008
  678    HZ3  TRP  94           HZ3      TRP  94   0.662  -4.671   6.349
  679    HH2  TRP  94           HH2      TRP  94   1.170  -4.618   8.775
  680    H    GLU  95           HN       GLU  95   1.648  -7.724   3.365
  681    HA   GLU  95           HA       GLU  95   3.713  -6.435   5.041
  682   1HB   GLU  95          HB2       GLU  95   4.916  -7.569   3.170
  683   2HB   GLU  95          HB1       GLU  95   3.982  -6.605   2.025
  684   1HG   GLU  95          HG2       GLU  95   6.063  -5.458   2.324
  685   2HG   GLU  95          HG1       GLU  95   4.860  -4.543   3.233
  686    H    TYR  96           HN       TYR  96   3.370  -4.225   5.210
  687    HA   TYR  96           HA       TYR  96   0.871  -3.095   4.366
  688   1HB   TYR  96          HB2       TYR  96   3.317  -2.361   5.812
  689   2HB   TYR  96          HB1       TYR  96   2.626  -1.003   4.925
  690    HD1  TYR  96           HD1      TYR  96  -0.130  -1.061   5.056
  691    HD2  TYR  96           HD2      TYR  96   2.610  -2.542   8.015
  692    HE1  TYR  96           HE1      TYR  96  -1.876  -0.810   6.798
  693    HE2  TYR  96           HE2      TYR  96   0.862  -2.293   9.758
  694    HH   TYR  96           HH       TYR  96  -2.391  -1.826   9.042
  695    H    CYS  97           HN       CYS  97   0.806  -1.056   2.942
  696    HA   CYS  97           HA       CYS  97   2.496  -1.524   0.520
  697   1HB   CYS  97          HB2       CYS  97  -0.254  -0.434   1.083
  698   2HB   CYS  97          HB1       CYS  97   0.553  -0.043  -0.437
  699    H    ASN  98           HN       ASN  98   3.699   0.196  -0.346
  700    HA   ASN  98           HA       ASN  98   4.720   2.234   1.321
  701   1HB   ASN  98          HB2       ASN  98   4.413   1.977  -1.682
  702   2HB   ASN  98          HB1       ASN  98   5.357   3.263  -0.929
  703   1HD2  ASN  98          HD21      ASN  98   5.664   0.195  -2.236
  704   2HD2  ASN  98          HD22      ASN  98   7.077  -0.300  -1.436
  705    H    LEU  99           HN       LEU  99   2.692   3.130   2.345
  706    HA   LEU  99           HA       LEU  99   1.547   5.282   0.622
  707   1HB   LEU  99          HB2       LEU  99   0.026   3.336   2.383
  708   2HB   LEU  99          HB1       LEU  99  -0.689   4.668   1.477
  709    HG   LEU  99           HG       LEU  99   0.908   2.447   0.185
  710   1HD1  LEU  99          HD11      LEU  99  -2.024   2.731   0.797
  711   2HD1  LEU  99          HD12      LEU  99  -0.987   1.316   0.980
  712   3HD1  LEU  99          HD13      LEU  99  -1.498   1.834  -0.627
  713   1HD2  LEU  99          HD21      LEU  99  -0.832   4.711  -0.824
  714   2HD2  LEU  99          HD22      LEU  99  -0.388   3.337  -1.836
  715   3HD2  LEU  99          HD23      LEU  99   0.864   4.404  -1.200
  716    H    THR 100           HN       THR 100   0.794   7.092   1.805
  717    HA   THR 100           HA       THR 100   0.981   7.236   4.711
  718    HB   THR 100           HB       THR 100   2.687   9.195   4.259
  719    HG1  THR 100           HG1      THR 100   4.071   8.568   2.508
  720   1HG2  THR 100          HG21      THR 100   4.151   7.815   5.294
  721   2HG2  THR 100          HG22      THR 100   4.156   6.690   3.937
  722   3HG2  THR 100          HG23      THR 100   2.896   6.582   5.166
  723    H    GLN 101           HN       GLN 101   0.161   9.401   5.416
  724    HA   GLN 101           HA       GLN 101  -2.041  10.371   3.964
  725   1HB   GLN 101          HB2       GLN 101  -0.263  11.295   6.152
  726   2HB   GLN 101          HB1       GLN 101  -1.184  12.570   5.349
  727   1HG   GLN 101          HG2       GLN 101  -3.240  11.666   5.972
  728   2HG   GLN 101          HG1       GLN 101  -2.585  10.038   6.151
  729   1HE2  GLN 101          HE21      GLN 101  -3.809  12.471   7.997
  730   2HE2  GLN 101          HE22      GLN 101  -2.923  12.235   9.426
  731    H    CYS 102           HN       CYS 102  -1.574  10.681   1.741
  732    HA   CYS 102           HA       CYS 102   0.556  11.721   0.404
  733   1HB   CYS 102          HB2       CYS 102  -2.344  12.528   0.016
  734   2HB   CYS 102          HB1       CYS 102  -1.084  12.610  -1.215
  735    HA   PRO 103           HA       PRO 103   0.907  15.721   2.429
  736   1HB   PRO 103          HB2       PRO 103   3.485  16.171   1.652
  737   2HB   PRO 103          HB1       PRO 103   3.063  15.122   3.018
  738   1HG   PRO 103          HG2       PRO 103   3.924  14.403   0.281
  739   2HG   PRO 103          HG1       PRO 103   4.197  13.561   1.812
  740   1HD   PRO 103          HD2       PRO 103   2.308  12.865  -0.109
  741   2HD   PRO 103          HD1       PRO 103   2.317  12.319   1.581
  742    H    VAL 104           HN       VAL 104   1.369  14.823  -0.906
  743    HA   VAL 104           HA       VAL 104   1.398  17.673  -1.780
  744    HB   VAL 104           HB       VAL 104   1.827  15.023  -3.193
  745   1HG1  VAL 104          HG11      VAL 104   2.574  16.394  -5.103
  746   2HG1  VAL 104          HG12      VAL 104   2.145  17.860  -4.222
  747   3HG1  VAL 104          HG13      VAL 104   0.886  16.727  -4.715
  748   1HG2  VAL 104          HG21      VAL 104   3.982  15.236  -2.564
  749   2HG2  VAL 104          HG22      VAL 104   3.503  16.590  -1.542
  750   3HG2  VAL 104          HG23      VAL 104   4.044  16.881  -3.195
  751    H    THR 105           HN       THR 105  -0.823  15.165  -1.238
  752    HA   THR 105           HA       THR 105  -2.604  15.432  -3.462
  753    HB   THR 105           HB       THR 105  -2.560  13.656  -1.663
  754    HG1  THR 105           HG1      THR 105  -4.419  14.236  -3.069
  755   1HG2  THR 105          HG21      THR 105  -2.388  15.444   0.178
  756   2HG2  THR 105          HG22      THR 105  -3.471  14.087   0.484
  757   3HG2  THR 105          HG23      THR 105  -4.129  15.643  -0.020
  758    H    GLU 106           HN       GLU 106  -4.934  16.357  -3.028
  759    HA   GLU 106           HA       GLU 106  -5.314  18.557  -1.261
  760   1HB   GLU 106          HB2       GLU 106  -4.930  20.407  -2.799
  761   2HB   GLU 106          HB1       GLU 106  -3.471  19.420  -2.747
  762   1HG   GLU 106          HG2       GLU 106  -5.255  18.375  -4.751
  763   2HG   GLU 106          HG1       GLU 106  -5.007  20.099  -5.029
  764    H    SER 107           HN       SER 107  -7.389  19.642  -1.694
  765    HA   SER 107           HA       SER 107  -9.020  18.544  -3.920
  766   1HB   SER 107          HB2       SER 107 -10.562  17.485  -2.486
  767   2HB   SER 107          HB1       SER 107  -9.012  17.107  -1.739
  768    HG   SER 107           HG       SER 107  -9.497  18.359  -0.107
  769    H    SER 108           HN       SER 108 -11.298  19.615  -3.793
  770    HA   SER 108           HA       SER 108 -10.979  22.450  -2.857
  771   1HB   SER 108          HB2       SER 108 -12.734  21.510  -5.122
  772   2HB   SER 108          HB1       SER 108 -12.045  23.110  -4.860
  773    HG   SER 108           HG       SER 108 -10.239  22.471  -5.751
  774    H    VAL 109           HN       VAL 109 -12.471  23.062  -1.340
  775    HA   VAL 109           HA       VAL 109 -14.870  21.329  -0.923
  776    HB   VAL 109           HB       VAL 109 -13.564  23.446   0.821
  777   1HG1  VAL 109          HG11      VAL 109 -15.471  23.247   2.012
  778   2HG1  VAL 109          HG12      VAL 109 -14.974  21.594   2.375
  779   3HG1  VAL 109          HG13      VAL 109 -16.034  21.915   1.003
  780   1HG2  VAL 109          HG21      VAL 109 -12.325  21.196   0.170
  781   2HG2  VAL 109          HG22      VAL 109 -13.437  20.495   1.347
  782   3HG2  VAL 109          HG23      VAL 109 -12.317  21.765   1.839
  783    H    LEU 110           HN       LEU 110 -16.304  22.238  -2.489
  784    HA   LEU 110           HA       LEU 110 -16.730  25.157  -2.562
  785   1HB   LEU 110          HB2       LEU 110 -17.842  22.736  -3.998
  786   2HB   LEU 110          HB1       LEU 110 -18.462  24.362  -4.289
  787    HG   LEU 110           HG       LEU 110 -15.550  24.299  -4.344
  788   1HD1  LEU 110          HD11      LEU 110 -15.167  22.475  -5.602
  789   2HD1  LEU 110          HD12      LEU 110 -16.275  23.092  -6.828
  790   3HD1  LEU 110          HD13      LEU 110 -16.879  22.059  -5.532
  791   1HD2  LEU 110          HD21      LEU 110 -16.588  26.178  -5.299
  792   2HD2  LEU 110          HD22      LEU 110 -17.827  25.208  -6.095
  793   3HD2  LEU 110          HD23      LEU 110 -16.178  25.217  -6.719
  794    H    ALA 111           HN       ALA 111 -18.370  26.194  -1.473
  795    HA   ALA 111           HA       ALA 111 -20.073  24.638   0.360
  796   1HB   ALA 111          HB1       ALA 111 -19.769  26.556   1.513
  797   2HB   ALA 111          HB2       ALA 111 -20.700  27.423   0.292
  798   3HB   ALA 111          HB3       ALA 111 -18.951  27.268   0.122
  799    H    THR 112           HN       THR 112 -20.340  25.111  -2.828
  800    HA   THR 112           HA       THR 112 -23.316  25.154  -2.730
  801    HB   THR 112           HB       THR 112 -21.682  26.892  -4.599
  802    HG1  THR 112           HG1      THR 112 -21.425  28.118  -2.929
  803   1HG2  THR 112          HG21      THR 112 -24.605  26.926  -3.801
  804   2HG2  THR 112          HG22      THR 112 -23.972  26.292  -5.320
  805   3HG2  THR 112          HG23      THR 112 -23.835  28.012  -4.957
  806    H    SER 113           HN       SER 113 -20.980  23.250  -3.420
  807    HA   SER 113           HA       SER 113 -21.305  22.763  -6.300
  808   1HB   SER 113          HB2       SER 113 -19.859  20.728  -5.558
  809   2HB   SER 113          HB1       SER 113 -19.158  22.337  -5.409
  810    HG   SER 113           HG       SER 113 -18.971  20.984  -3.506
  811    H    THR 114           HN       THR 114 -23.809  22.628  -4.980
  812    HA   THR 114           HA       THR 114 -24.370  19.683  -4.889
  813    HB   THR 114           HB       THR 114 -25.767  22.089  -3.675
  814    HG1  THR 114           HG1      THR 114 -24.578  21.640  -2.024
  815   1HG2  THR 114          HG21      THR 114 -26.676  19.649  -2.555
  816   2HG2  THR 114          HG22      THR 114 -26.762  19.466  -4.306
  817   3HG2  THR 114          HG23      THR 114 -27.601  20.801  -3.517
  818    H    ALA 115           HN       ALA 115 -25.576  18.906  -6.577
  819    HA   ALA 115           HA       ALA 115 -27.603  20.636  -7.873
  820   1HB   ALA 115          HB1       ALA 115 -26.117  19.450  -9.977
  821   2HB   ALA 115          HB2       ALA 115 -24.938  20.157  -8.872
  822   3HB   ALA 115          HB3       ALA 115 -26.207  21.164  -9.568
  823    H    VAL 116           HN       VAL 116 -28.202  19.036 -10.042
  824    HA   VAL 116           HA       VAL 116 -28.771  16.357  -8.809
  825    HB   VAL 116           HB       VAL 116 -30.491  18.153 -10.550
  826   1HG1  VAL 116          HG11      VAL 116 -32.103  16.461 -10.629
  827   2HG1  VAL 116          HG12      VAL 116 -31.419  15.609  -9.245
  828   3HG1  VAL 116          HG13      VAL 116 -30.607  15.544 -10.809
  829   1HG2  VAL 116          HG21      VAL 116 -30.171  18.669  -8.046
  830   2HG2  VAL 116          HG22      VAL 116 -31.041  17.164  -7.746
  831   3HG2  VAL 116          HG23      VAL 116 -31.831  18.482  -8.612
  832    H    SER 117           HN       SER 117 -26.858  15.552  -9.994
  833    HA   SER 117           HA       SER 117 -27.140  15.514 -12.970
  834   1HB   SER 117          HB2       SER 117 -24.970  15.530 -10.990
  835   2HB   SER 117          HB1       SER 117 -24.725  14.352 -12.276
  836    HG   SER 117           HG       SER 117 -24.061  16.715 -12.538
  837    H    GLU 118           HN       GLU 118 -27.946  13.658 -13.866
  838    HA   GLU 118           HA       GLU 118 -27.403  11.051 -12.519
  839   1HB   GLU 118          HB2       GLU 118 -29.967  12.483 -12.884
  840   2HB   GLU 118          HB1       GLU 118 -30.002  10.776 -13.328
  841   1HG   GLU 118          HG2       GLU 118 -29.691  10.072 -11.175
  842   2HG   GLU 118          HG1       GLU 118 -28.620  11.418 -10.783
  843    H    GLN 119           HN       GLN 119 -26.202  10.130 -14.178
  844    HA   GLN 119           HA       GLN 119 -27.008  10.515 -16.998
  845   1HB   GLN 119          HB2       GLN 119 -24.733   9.116 -15.564
  846   2HB   GLN 119          HB1       GLN 119 -24.895   9.139 -17.320
  847   1HG   GLN 119          HG2       GLN 119 -24.660  11.508 -17.415
  848   2HG   GLN 119          HG1       GLN 119 -24.896  11.675 -15.675
  849   1HE2  GLN 119          HE21      GLN 119 -22.672  12.884 -16.109
  850   2HE2  GLN 119          HE22      GLN 119 -21.279  11.928 -15.940
  Start of MODEL    8
    1   1H    ALA   1          HT1       ALA   1  23.283  25.357  -1.977
    2   2H    ALA   1          HT2       ALA   1  21.808  26.057  -1.508
    3   3H    ALA   1          HT3       ALA   1  21.863  24.430  -1.995
    4    HA   ALA   1           HA       ALA   1  21.833  25.118   0.553
    5   1HB   ALA   1          HB1       ALA   1  21.753  22.863   0.347
    6   2HB   ALA   1          HB2       ALA   1  23.515  22.885   0.416
    7   3HB   ALA   1          HB3       ALA   1  22.694  22.906  -1.144
    8    H    ARG   2           HN       ARG   2  23.322  25.509   2.255
    9    HA   ARG   2           HA       ARG   2  26.112  26.215   1.397
   10   1HB   ARG   2          HB2       ARG   2  25.846  27.943   3.290
   11   2HB   ARG   2          HB1       ARG   2  24.910  28.232   1.823
   12   1HG   ARG   2          HG2       ARG   2  22.910  27.792   2.847
   13   2HG   ARG   2          HG1       ARG   2  23.602  26.550   3.892
   14   1HD   ARG   2          HD2       ARG   2  24.469  28.168   5.420
   15   2HD   ARG   2          HD1       ARG   2  24.205  29.496   4.273
   16    HE   ARG   2           HE       ARG   2  21.717  28.922   4.488
   17   1HH1  ARG   2          HH11      ARG   2  22.792  30.374   6.903
   18   2HH1  ARG   2          HH12      ARG   2  22.192  29.394   8.198
   19   1HH2  ARG   2          HH21      ARG   2  21.468  26.683   6.164
   20   2HH2  ARG   2          HH22      ARG   2  21.446  27.303   7.780
   21    H    ILE   3           HN       ILE   3  26.095  23.718   2.162
   22    HA   ILE   3           HA       ILE   3  27.221  23.738   4.903
   23    HB   ILE   3           HB       ILE   3  24.725  23.347   5.024
   24   1HG1  ILE   3          HG12      ILE   3  25.765  20.738   5.866
   25   2HG1  ILE   3          HG11      ILE   3  26.801  22.077   6.360
   26   1HG2  ILE   3          HG21      ILE   3  25.210  20.610   3.913
   27   2HG2  ILE   3          HG22      ILE   3  24.962  21.940   2.781
   28   3HG2  ILE   3          HG23      ILE   3  23.717  21.547   3.967
   29   1HD1  ILE   3          HD11      ILE   3  23.831  21.805   6.907
   30   2HD1  ILE   3          HD12      ILE   3  24.797  23.226   7.308
   31   3HD1  ILE   3          HD13      ILE   3  25.132  21.682   8.093
   32    H    HIS   4           HN       HIS   4  28.842  23.399   2.818
   33    HA   HIS   4           HA       HIS   4  30.325  21.898   1.752
   34   1HB   HIS   4          HB2       HIS   4  30.324  21.393   4.327
   35   2HB   HIS   4          HB1       HIS   4  29.476  19.920   3.858
   36    HD1  HIS   4           HD1      HIS   4  32.152  21.495   1.716
   37    HD2  HIS   4           HD2      HIS   4  31.694  18.207   4.238
   38    HE1  HIS   4           HE1      HIS   4  34.209  20.054   1.394
   39    H    HIS   5           HN       HIS   5  29.398  21.308  -0.218
   40    HA   HIS   5           HA       HIS   5  27.129  19.424  -0.313
   41   1HB   HIS   5          HB2       HIS   5  28.007  21.544  -1.823
   42   2HB   HIS   5          HB1       HIS   5  28.565  20.174  -2.782
   43    HD1  HIS   5           HD1      HIS   5  26.121  22.106  -3.533
   44    HD2  HIS   5           HD2      HIS   5  25.817  18.290  -1.882
   45    HE1  HIS   5           HE1      HIS   5  23.811  21.251  -4.124
   46    H    HIS   6           HN       HIS   6  28.272  17.542   0.621
   47    HA   HIS   6           HA       HIS   6  29.844  16.087  -1.453
   48   1HB   HIS   6          HB2       HIS   6  31.165  17.430   0.419
   49   2HB   HIS   6          HB1       HIS   6  30.746  16.030   1.408
   50    HD1  HIS   6           HD1      HIS   6  31.516  15.862  -2.289
   51    HD2  HIS   6           HD2      HIS   6  33.269  14.783   1.336
   52    HE1  HIS   6           HE1      HIS   6  33.539  14.451  -2.864
   53    H    HIS   7           HN       HIS   7  28.791  14.151  -1.699
   54    HA   HIS   7           HA       HIS   7  26.767  13.145   0.019
   55   1HB   HIS   7          HB2       HIS   7  28.045  12.502  -2.419
   56   2HB   HIS   7          HB1       HIS   7  28.177  11.060  -1.412
   57    HD1  HIS   7           HD1      HIS   7  25.623  10.893   0.067
   58    HD2  HIS   7           HD2      HIS   7  25.727  12.215  -3.886
   59    HE1  HIS   7           HE1      HIS   7  23.287  10.570  -0.859
   60    H    HIS   8           HN       HIS   8  26.827  11.651   1.730
   61    HA   HIS   8           HA       HIS   8  29.071  11.540   3.445
   62   1HB   HIS   8          HB2       HIS   8  26.655   9.754   3.047
   63   2HB   HIS   8          HB1       HIS   8  27.766   9.565   4.405
   64    HD1  HIS   8           HD1      HIS   8  28.289  12.275   5.416
   65    HD2  HIS   8           HD2      HIS   8  24.522  11.244   3.958
   66    HE1  HIS   8           HE1      HIS   8  26.656  13.939   6.408
   67    H    HIS   9           HN       HIS   9  28.071   9.317   0.853
   68    HA   HIS   9           HA       HIS   9  30.567   7.726   1.323
   69   1HB   HIS   9          HB2       HIS   9  28.014   6.893   1.251
   70   2HB   HIS   9          HB1       HIS   9  28.362   6.824  -0.477
   71    HD1  HIS   9           HD1      HIS   9  28.014   4.125   0.304
   72    HD2  HIS   9           HD2      HIS   9  31.603   6.019   1.258
   73    HE1  HIS   9           HE1      HIS   9  29.697   2.287   0.752
   74    H    ILE  10           HN       ILE  10  30.512   6.518  -1.280
   75    HA   ILE  10           HA       ILE  10  31.535   8.801  -2.913
   76    HB   ILE  10           HB       ILE  10  32.959   6.805  -2.243
   77   1HG1  ILE  10          HG12      ILE  10  32.464   7.257  -5.205
   78   2HG1  ILE  10          HG11      ILE  10  33.548   8.199  -4.181
   79   1HG2  ILE  10          HG21      ILE  10  31.187   5.374  -4.246
   80   2HG2  ILE  10          HG22      ILE  10  31.104   5.140  -2.500
   81   3HG2  ILE  10          HG23      ILE  10  32.564   4.689  -3.382
   82   1HD1  ILE  10          HD11      ILE  10  34.757   6.464  -5.507
   83   2HD1  ILE  10          HD12      ILE  10  33.814   5.220  -4.686
   84   3HD1  ILE  10          HD13      ILE  10  34.932   6.229  -3.768
   85    H    GLU  11           HN       GLU  11  30.962   8.848  -5.211
   86    HA   GLU  11           HA       GLU  11  28.479   7.305  -5.885
   87   1HB   GLU  11          HB2       GLU  11  28.474   9.900  -5.202
   88   2HB   GLU  11          HB1       GLU  11  28.890  10.083  -6.907
   89   1HG   GLU  11          HG2       GLU  11  26.702   8.172  -6.362
   90   2HG   GLU  11          HG1       GLU  11  26.331   9.854  -5.983
   91    H    GLY  12           HN       GLY  12  28.711   6.206  -7.787
   92   1HA   GLY  12          HA2       GLY  12  30.542   7.312  -9.860
   93   2HA   GLY  12          HA1       GLY  12  30.730   5.631  -9.356
   94    H    ARG  13           HN       ARG  13  30.106   4.683 -11.323
   95    HA   ARG  13           HA       ARG  13  27.398   5.374 -12.379
   96   1HB   ARG  13          HB2       ARG  13  28.248   4.108 -14.370
   97   2HB   ARG  13          HB1       ARG  13  29.282   5.469 -13.932
   98   1HG   ARG  13          HG2       ARG  13  30.085   3.126 -12.454
   99   2HG   ARG  13          HG1       ARG  13  30.039   2.756 -14.179
  100   1HD   ARG  13          HD2       ARG  13  31.951   3.921 -14.500
  101   2HD   ARG  13          HD1       ARG  13  31.212   5.369 -13.786
  102    HE   ARG  13           HE       ARG  13  31.899   3.406 -11.762
  103   1HH1  ARG  13          HH11      ARG  13  34.481   3.684 -13.196
  104   2HH1  ARG  13          HH12      ARG  13  35.196   5.061 -12.425
  105   1HH2  ARG  13          HH21      ARG  13  32.217   6.150 -11.020
  106   2HH2  ARG  13          HH22      ARG  13  33.912   6.458 -11.192
  107    H    ALA  14           HN       ALA  14  26.398   4.154 -10.537
  108    HA   ALA  14           HA       ALA  14  26.062   1.300 -11.257
  109   1HB   ALA  14          HB1       ALA  14  26.976   2.275  -8.529
  110   2HB   ALA  14          HB2       ALA  14  27.988   1.426  -9.698
  111   3HB   ALA  14          HB3       ALA  14  26.618   0.601  -8.953
  112    HA   PRO  15           HA       PRO  15  22.167   3.320  -9.969
  113   1HB   PRO  15          HB2       PRO  15  20.605   1.952 -11.751
  114   2HB   PRO  15          HB1       PRO  15  21.495   3.426 -12.182
  115   1HG   PRO  15          HG2       PRO  15  22.175   0.581 -12.722
  116   2HG   PRO  15          HG1       PRO  15  22.387   2.006 -13.750
  117   1HD   PRO  15          HD2       PRO  15  24.415   0.849 -12.336
  118   2HD   PRO  15          HD1       PRO  15  24.381   2.570 -12.780
  119    H    THR  16           HN       THR  16  22.676   1.916  -7.994
  120    HA   THR  16           HA       THR  16  20.824  -0.435  -7.940
  121    HB   THR  16           HB       THR  16  22.815  -1.274  -6.328
  122    HG1  THR  16           HG1      THR  16  24.327  -0.097  -8.341
  123   1HG2  THR  16          HG21      THR  16  23.662  -1.763  -9.044
  124   2HG2  THR  16          HG22      THR  16  21.903  -1.829  -8.940
  125   3HG2  THR  16          HG23      THR  16  22.886  -2.869  -7.911
  126    H    GLU  17           HN       GLU  17  21.190   2.527  -6.806
  127    HA   GLU  17           HA       GLU  17  21.436   2.652  -4.066
  128   1HB   GLU  17          HB2       GLU  17  19.700   4.463  -4.242
  129   2HB   GLU  17          HB1       GLU  17  20.939   4.557  -5.494
  130   1HG   GLU  17          HG2       GLU  17  19.159   2.946  -6.742
  131   2HG   GLU  17          HG1       GLU  17  18.055   3.881  -5.733
  132    H    GLN  18           HN       GLN  18  20.569   1.339  -2.506
  133    HA   GLN  18           HA       GLN  18  18.397  -0.435  -2.836
  134   1HB   GLN  18          HB2       GLN  18  20.262   0.414  -0.842
  135   2HB   GLN  18          HB1       GLN  18  18.659   0.375  -0.106
  136   1HG   GLN  18          HG2       GLN  18  18.383  -1.936  -1.173
  137   2HG   GLN  18          HG1       GLN  18  20.115  -1.877  -1.502
  138   1HE2  GLN  18          HE21      GLN  18  19.654  -3.895   0.136
  139   2HE2  GLN  18          HE22      GLN  18  19.933  -3.523   1.769
  140    H    SER  19           HN       SER  19  16.709   0.934  -3.841
  141    HA   SER  19           HA       SER  19  15.518   3.075  -2.189
  142   1HB   SER  19          HB2       SER  19  14.778   3.774  -4.220
  143   2HB   SER  19          HB1       SER  19  15.812   2.520  -4.898
  144    HG   SER  19           HG       SER  19  14.017   1.094  -4.729
  145    HA   PRO  20           HA       PRO  20  12.737   0.100  -0.387
  146   1HB   PRO  20          HB2       PRO  20  11.291   1.897   1.090
  147   2HB   PRO  20          HB1       PRO  20  12.898   1.318   1.570
  148   1HG   PRO  20          HG2       PRO  20  12.116   3.891   0.309
  149   2HG   PRO  20          HG1       PRO  20  13.365   3.555   1.515
  150   1HD   PRO  20          HD2       PRO  20  13.865   3.952  -1.154
  151   2HD   PRO  20          HD1       PRO  20  14.926   3.038  -0.061
  152    H    GLY  21           HN       GLY  21  10.741   3.010  -0.550
  153   1HA   GLY  21          HA2       GLY  21   9.205   3.489  -2.427
  154   2HA   GLY  21          HA1       GLY  21   9.171   1.757  -2.761
  155    H    VAL  22           HN       VAL  22   7.765   4.308  -0.915
  156    HA   VAL  22           HA       VAL  22   5.945   2.316   0.401
  157    HB   VAL  22           HB       VAL  22   6.910   4.991   1.464
  158   1HG1  VAL  22          HG11      VAL  22   4.656   3.895   2.203
  159   2HG1  VAL  22          HG12      VAL  22   5.771   4.459   3.447
  160   3HG1  VAL  22          HG13      VAL  22   5.687   2.743   3.051
  161   1HG2  VAL  22          HG21      VAL  22   7.912   2.170   1.825
  162   2HG2  VAL  22          HG22      VAL  22   8.134   3.370   3.098
  163   3HG2  VAL  22          HG23      VAL  22   8.838   3.636   1.503
  164    H    GLN  23           HN       GLN  23   4.584   2.720  -1.569
  165    HA   GLN  23           HA       GLN  23   3.574   5.337  -2.169
  166   1HB   GLN  23          HB2       GLN  23   2.606   2.540  -2.807
  167   2HB   GLN  23          HB1       GLN  23   2.017   4.004  -3.594
  168   1HG   GLN  23          HG2       GLN  23   4.063   4.412  -4.662
  169   2HG   GLN  23          HG1       GLN  23   4.967   3.418  -3.519
  170   1HE2  GLN  23          HE21      GLN  23   2.417   3.103  -6.050
  171   2HE2  GLN  23          HE22      GLN  23   2.895   1.552  -6.546
  172    H    ASP  24           HN       ASP  24   3.191   5.251   0.524
  173    HA   ASP  24           HA       ASP  24   0.688   4.145   1.407
  174   1HB   ASP  24          HB2       ASP  24   1.082   5.698   3.316
  175   2HB   ASP  24          HB1       ASP  24   2.545   4.812   2.883
  176    H    CYS  25           HN       CYS  25  -0.886   4.752  -0.182
  177    HA   CYS  25           HA       CYS  25  -2.060   7.424   0.231
  178   1HB   CYS  25          HB2       CYS  25  -0.396   6.682  -2.090
  179   2HB   CYS  25          HB1       CYS  25  -1.932   7.447  -2.493
  180    H    TYR  26           HN       TYR  26  -4.208   7.577  -0.725
  181    HA   TYR  26           HA       TYR  26  -5.288   5.267  -2.190
  182   1HB   TYR  26          HB2       TYR  26  -6.718   4.467  -0.442
  183   2HB   TYR  26          HB1       TYR  26  -5.111   4.613   0.261
  184    HD1  TYR  26           HD1      TYR  26  -8.321   6.499  -0.163
  185    HD2  TYR  26           HD2      TYR  26  -4.782   5.896   2.184
  186    HE1  TYR  26           HE1      TYR  26  -9.212   8.024   1.577
  187    HE2  TYR  26           HE2      TYR  26  -5.666   7.422   3.925
  188    HH   TYR  26           HH       TYR  26  -8.307   8.139   4.563
  189    H    HIS  27           HN       HIS  27  -7.818   5.573  -2.336
  190    HA   HIS  27           HA       HIS  27  -8.428   8.509  -2.457
  191   1HB   HIS  27          HB2       HIS  27  -7.907   7.535  -4.669
  192   2HB   HIS  27          HB1       HIS  27  -9.137   6.296  -4.415
  193    HD1  HIS  27           HD1      HIS  27 -10.318   7.342  -6.597
  194    HD2  HIS  27           HD2      HIS  27 -10.238   9.811  -3.239
  195    HE1  HIS  27           HE1      HIS  27 -12.013   9.176  -7.017
  196    H    GLY  28           HN       GLY  28 -10.239   8.997  -1.270
  197   1HA   GLY  28          HA2       GLY  28 -12.241   8.706  -0.075
  198   2HA   GLY  28          HA1       GLY  28 -12.669   7.522  -1.313
  199    H    ASP  29           HN       ASP  29 -11.993   5.306  -0.995
  200    HA   ASP  29           HA       ASP  29 -11.312   4.647   1.839
  201   1HB   ASP  29          HB2       ASP  29 -13.395   3.690  -0.057
  202   2HB   ASP  29          HB1       ASP  29 -12.696   2.500   1.043
  203    H    GLY  30           HN       GLY  30  -9.737   4.923  -0.784
  204   1HA   GLY  30          HA2       GLY  30  -7.933   3.800  -1.772
  205   2HA   GLY  30          HA1       GLY  30  -7.906   2.779  -0.334
  206    H    GLN  31           HN       GLN  31 -11.004   2.662  -1.590
  207    HA   GLN  31           HA       GLN  31 -10.838  -0.085  -2.352
  208   1HB   GLN  31          HB2       GLN  31 -12.914   0.960  -1.688
  209   2HB   GLN  31          HB1       GLN  31 -12.791   2.145  -2.988
  210   1HG   GLN  31          HG2       GLN  31 -14.350   0.488  -3.740
  211   2HG   GLN  31          HG1       GLN  31 -12.849   0.189  -4.615
  212   1HE2  GLN  31          HE21      GLN  31 -15.224  -1.331  -2.735
  213   2HE2  GLN  31          HE22      GLN  31 -14.351  -2.723  -2.308
  214    H    SER  32           HN       SER  32 -10.039   2.806  -4.078
  215    HA   SER  32           HA       SER  32 -10.034   1.361  -6.693
  216   1HB   SER  32          HB2       SER  32 -10.925   3.836  -5.960
  217   2HB   SER  32          HB1       SER  32  -9.291   4.225  -6.489
  218    HG   SER  32           HG       SER  32  -9.763   3.164  -8.453
  219    H    TYR  33           HN       TYR  33  -8.045   1.099  -4.372
  220    HA   TYR  33           HA       TYR  33  -5.568   2.338  -5.286
  221   1HB   TYR  33          HB2       TYR  33  -6.013   1.822  -2.941
  222   2HB   TYR  33          HB1       TYR  33  -6.229   0.116  -3.328
  223    HD1  TYR  33           HD1      TYR  33  -4.446  -1.093  -2.427
  224    HD2  TYR  33           HD2      TYR  33  -3.674   2.637  -4.413
  225    HE1  TYR  33           HE1      TYR  33  -2.009  -1.459  -2.167
  226    HE2  TYR  33           HE2      TYR  33  -1.235   2.271  -4.153
  227    HH   TYR  33           HH       TYR  33   0.344   0.981  -3.267
  228    H    ARG  34           HN       ARG  34  -3.841   1.299  -6.371
  229    HA   ARG  34           HA       ARG  34  -4.357  -0.523  -8.434
  230   1HB   ARG  34          HB2       ARG  34  -2.350   0.874  -8.223
  231   2HB   ARG  34          HB1       ARG  34  -1.831  -0.054  -6.816
  232   1HG   ARG  34          HG2       ARG  34  -1.106  -1.814  -8.076
  233   2HG   ARG  34          HG1       ARG  34  -2.418  -1.647  -9.244
  234   1HD   ARG  34          HD2       ARG  34  -0.754   0.685  -9.434
  235   2HD   ARG  34          HD1       ARG  34   0.274  -0.759  -9.537
  236    HE   ARG  34           HE       ARG  34  -1.548  -1.579 -11.219
  237   1HH1  ARG  34          HH11      ARG  34  -2.430   1.489 -10.690
  238   2HH1  ARG  34          HH12      ARG  34  -2.070   2.113 -12.266
  239   1HH2  ARG  34          HH21      ARG  34  -0.293  -0.696 -13.260
  240   2HH2  ARG  34          HH22      ARG  34  -0.856   0.875 -13.720
  241    H    GLY  35           HN       GLY  35  -3.653  -1.177  -5.041
  242   1HA   GLY  35          HA2       GLY  35  -4.088  -3.193  -3.865
  243   2HA   GLY  35          HA1       GLY  35  -4.491  -3.965  -5.398
  244    H    SER  36           HN       SER  36  -1.593  -2.470  -3.908
  245    HA   SER  36           HA       SER  36  -0.082  -4.973  -4.353
  246   1HB   SER  36          HB2       SER  36   0.267  -4.063  -6.485
  247   2HB   SER  36          HB1       SER  36   0.236  -2.406  -5.888
  248    HG   SER  36           HG       SER  36   2.259  -4.348  -5.412
  249    H    PHE  37           HN       PHE  37  -0.895  -2.951  -2.154
  250    HA   PHE  37           HA       PHE  37   1.737  -1.945  -1.259
  251   1HB   PHE  37          HB2       PHE  37  -0.591  -0.791  -1.150
  252   2HB   PHE  37          HB1       PHE  37  -0.872  -1.830   0.247
  253    HD1  PHE  37           HD1      PHE  37   1.203   0.909  -1.114
  254    HD2  PHE  37           HD2      PHE  37   0.342  -1.530   2.311
  255    HE1  PHE  37           HE1      PHE  37   2.531   2.446   0.313
  256    HE2  PHE  37           HE2      PHE  37   1.671   0.003   3.740
  257    HZ   PHE  37           HZ       PHE  37   2.764   1.991   2.741
  258    H    SER  38           HN       SER  38   2.586  -4.217  -1.037
  259    HA   SER  38           HA       SER  38   1.585  -6.154   0.782
  260   1HB   SER  38          HB2       SER  38   3.736  -7.134   0.459
  261   2HB   SER  38          HB1       SER  38   3.389  -6.256  -1.029
  262    HG   SER  38           HG       SER  38   4.514  -4.455   0.199
  263    H    THR  39           HN       THR  39   2.597  -3.053   1.666
  264    HA   THR  39           HA       THR  39   3.855  -3.965   4.207
  265    HB   THR  39           HB       THR  39   3.490  -1.230   2.935
  266    HG1  THR  39           HG1      THR  39   5.741  -2.939   3.157
  267   1HG2  THR  39          HG21      THR  39   3.819  -1.619   5.559
  268   2HG2  THR  39          HG22      THR  39   4.623  -0.299   4.710
  269   3HG2  THR  39          HG23      THR  39   5.503  -1.787   5.062
  270    H    THR  40           HN       THR  40   2.536  -4.140   5.980
  271    HA   THR  40           HA       THR  40  -0.213  -3.128   5.858
  272    HB   THR  40           HB       THR  40  -0.324  -4.315   8.072
  273    HG1  THR  40           HG1      THR  40   1.463  -5.098   8.946
  274   1HG2  THR  40          HG21      THR  40  -0.862  -5.733   6.300
  275   2HG2  THR  40          HG22      THR  40   0.494  -6.586   7.038
  276   3HG2  THR  40          HG23      THR  40   0.747  -5.616   5.587
  277    H    VAL  41           HN       VAL  41  -1.097  -1.941   7.825
  278    HA   VAL  41           HA       VAL  41   0.028   0.602   8.177
  279    HB   VAL  41           HB       VAL  41  -1.887  -1.165   9.674
  280   1HG1  VAL  41          HG11      VAL  41  -0.663   0.084  11.442
  281   2HG1  VAL  41          HG12      VAL  41  -2.338   0.615  11.302
  282   3HG1  VAL  41          HG13      VAL  41  -1.043   1.595  10.616
  283   1HG2  VAL  41          HG21      VAL  41  -2.047   1.522   8.277
  284   2HG2  VAL  41          HG22      VAL  41  -3.404   0.760   9.108
  285   3HG2  VAL  41          HG23      VAL  41  -2.686  -0.016   7.698
  286    H    THR  42           HN       THR  42   0.594  -2.361  10.070
  287    HA   THR  42           HA       THR  42   2.227  -1.044  12.092
  288    HB   THR  42           HB       THR  42   2.628  -3.913  11.699
  289    HG1  THR  42           HG1      THR  42   0.504  -4.507  11.863
  290   1HG2  THR  42          HG21      THR  42   2.318  -2.029  13.784
  291   2HG2  THR  42          HG22      THR  42   2.661  -3.752  13.939
  292   3HG2  THR  42          HG23      THR  42   0.993  -3.181  13.953
  293    H    GLY  43           HN       GLY  43   2.795  -1.873   8.861
  294   1HA   GLY  43          HA2       GLY  43   4.829  -1.505   7.671
  295   2HA   GLY  43          HA1       GLY  43   5.688  -1.436   9.210
  296    H    ARG  44           HN       ARG  44   3.680  -4.099   9.276
  297    HA   ARG  44           HA       ARG  44   5.898  -5.965   9.130
  298   1HB   ARG  44          HB2       ARG  44   3.572  -5.930  10.415
  299   2HB   ARG  44          HB1       ARG  44   3.016  -6.774   8.969
  300   1HG   ARG  44          HG2       ARG  44   3.808  -8.661   9.929
  301   2HG   ARG  44          HG1       ARG  44   5.418  -8.036   9.571
  302   1HD   ARG  44          HD2       ARG  44   5.299  -8.592  11.953
  303   2HD   ARG  44          HD1       ARG  44   5.364  -6.826  11.788
  304    HE   ARG  44           HE       ARG  44   2.654  -7.981  11.798
  305   1HH1  ARG  44          HH11      ARG  44   4.924  -7.873  14.191
  306   2HH1  ARG  44          HH12      ARG  44   4.090  -6.754  15.216
  307   1HH2  ARG  44          HH21      ARG  44   1.700  -5.948  12.837
  308   2HH2  ARG  44          HH22      ARG  44   2.266  -5.663  14.449
  309    H    THR  45           HN       THR  45   5.002  -8.136   7.754
  310    HA   THR  45           HA       THR  45   5.015  -7.179   4.922
  311    HB   THR  45           HB       THR  45   5.560  -9.983   5.877
  312    HG1  THR  45           HG1      THR  45   7.818  -8.601   5.676
  313   1HG2  THR  45          HG21      THR  45   5.759 -10.025   3.596
  314   2HG2  THR  45          HG22      THR  45   7.377  -9.428   3.963
  315   3HG2  THR  45          HG23      THR  45   6.107  -8.299   3.491
  316    H    CYS  46           HN       CYS  46   3.160  -7.477   3.743
  317    HA   CYS  46           HA       CYS  46   0.794  -8.617   4.844
  318   1HB   CYS  46          HB2       CYS  46   1.709  -7.228   2.500
  319   2HB   CYS  46          HB1       CYS  46   0.668  -8.566   2.011
  320    H    GLN  47           HN       GLN  47  -0.077 -10.693   4.625
  321    HA   GLN  47           HA       GLN  47   1.728 -12.782   3.560
  322   1HB   GLN  47          HB2       GLN  47   0.767 -13.239   5.686
  323   2HB   GLN  47          HB1       GLN  47  -0.833 -12.712   5.168
  324   1HG   GLN  47          HG2       GLN  47  -0.631 -15.198   5.291
  325   2HG   GLN  47          HG1       GLN  47  -1.009 -14.631   3.664
  326   1HE2  GLN  47          HE21      GLN  47   1.778 -15.620   5.713
  327   2HE2  GLN  47          HE22      GLN  47   2.726 -16.174   4.419
  328    H    SER  48           HN       SER  48   1.311 -13.833   1.595
  329    HA   SER  48           HA       SER  48  -0.291 -12.870  -0.447
  330   1HB   SER  48          HB2       SER  48   1.299 -15.077   0.041
  331   2HB   SER  48          HB1       SER  48  -0.279 -15.804  -0.253
  332    HG   SER  48           HG       SER  48   0.792 -13.789  -1.924
  333    H    TRP  49           HN       TRP  49  -2.489 -13.185  -1.099
  334    HA   TRP  49           HA       TRP  49  -4.437 -13.570   0.991
  335   1HB   TRP  49          HB2       TRP  49  -4.586 -13.585  -2.040
  336   2HB   TRP  49          HB1       TRP  49  -6.001 -13.554  -0.989
  337    HD1  TRP  49           HD1      TRP  49  -3.435 -11.344  -2.533
  338    HE1  TRP  49           HE1      TRP  49  -3.749  -8.937  -1.713
  339    HE3  TRP  49           HE3      TRP  49  -6.726 -12.104   1.235
  340    HZ2  TRP  49           HZ2      TRP  49  -5.193  -7.503   0.268
  341    HZ3  TRP  49           HZ3      TRP  49  -7.578 -10.213   2.595
  342    HH2  TRP  49           HH2      TRP  49  -6.810  -7.902   2.113
  343    H    SER  50           HN       SER  50  -3.146 -15.625  -1.579
  344    HA   SER  50           HA       SER  50  -4.874 -17.902  -0.979
  345   1HB   SER  50          HB2       SER  50  -3.868 -17.251  -3.196
  346   2HB   SER  50          HB1       SER  50  -2.292 -17.701  -2.553
  347    HG   SER  50           HG       SER  50  -4.525 -19.447  -2.539
  348    H    SER  51           HN       SER  51  -2.781 -16.682   1.075
  349    HA   SER  51           HA       SER  51  -0.826 -18.748   1.538
  350   1HB   SER  51          HB2       SER  51  -0.319 -17.434   3.444
  351   2HB   SER  51          HB1       SER  51  -0.960 -16.265   2.292
  352    HG   SER  51           HG       SER  51  -2.346 -17.548   4.416
  353    H    MET  52           HN       MET  52  -1.331 -20.786   2.226
  354    HA   MET  52           HA       MET  52  -3.757 -21.127   3.953
  355   1HB   MET  52          HB2       MET  52  -2.378 -23.208   2.237
  356   2HB   MET  52          HB1       MET  52  -4.005 -23.268   2.907
  357   1HG   MET  52          HG2       MET  52  -3.507 -20.923   1.197
  358   2HG   MET  52          HG1       MET  52  -3.427 -22.467   0.355
  359   1HE   MET  52          HE1       MET  52  -6.838 -20.665   2.731
  360   2HE   MET  52          HE2       MET  52  -5.212 -20.045   2.470
  361   3HE   MET  52          HE3       MET  52  -5.457 -21.425   3.520
  362    H    THR  53           HN       THR  53  -0.767 -20.587   4.599
  363    HA   THR  53           HA       THR  53  -0.139 -23.063   6.125
  364    HB   THR  53           HB       THR  53   1.903 -21.188   6.463
  365    HG1  THR  53           HG1      THR  53   1.299 -21.147   3.742
  366   1HG2  THR  53          HG21      THR  53   2.909 -22.581   4.492
  367   2HG2  THR  53          HG22      THR  53   1.410 -23.502   4.611
  368   3HG2  THR  53          HG23      THR  53   2.495 -23.402   5.997
  369    HA   PRO  54           HA       PRO  54  -0.054 -19.918   9.661
  370   1HB   PRO  54          HB2       PRO  54  -0.392 -17.251   9.148
  371   2HB   PRO  54          HB1       PRO  54   1.190 -18.052   9.102
  372   1HG   PRO  54          HG2       PRO  54  -0.590 -17.252   6.863
  373   2HG   PRO  54          HG1       PRO  54   1.177 -17.234   6.967
  374   1HD   PRO  54          HD2       PRO  54  -0.276 -19.159   5.650
  375   2HD   PRO  54          HD1       PRO  54   1.363 -19.401   6.292
  376    H    HIS  55           HN       HIS  55  -2.004 -17.388   8.253
  377    HA   HIS  55           HA       HIS  55  -4.393 -18.476   9.639
  378   1HB   HIS  55          HB2       HIS  55  -4.449 -15.931   8.071
  379   2HB   HIS  55          HB1       HIS  55  -5.104 -16.271   9.672
  380    HD1  HIS  55           HD1      HIS  55  -1.940 -15.297   7.907
  381    HD2  HIS  55           HD2      HIS  55  -3.267 -15.875  11.815
  382    HE1  HIS  55           HE1      HIS  55  -0.113 -14.428   9.413
  383    H    TRP  56           HN       TRP  56  -5.323 -20.073   8.355
  384    HA   TRP  56           HA       TRP  56  -5.413 -19.882   5.447
  385   1HB   TRP  56          HB2       TRP  56  -5.264 -21.967   6.882
  386   2HB   TRP  56          HB1       TRP  56  -6.949 -21.696   7.327
  387    HD1  TRP  56           HD1      TRP  56  -8.331 -20.990   4.751
  388    HE1  TRP  56           HE1      TRP  56  -8.478 -22.558   2.753
  389    HE3  TRP  56           HE3      TRP  56  -4.367 -23.972   5.759
  390    HZ2  TRP  56           HZ2      TRP  56  -7.084 -24.803   1.689
  391    HZ3  TRP  56           HZ3      TRP  56  -3.777 -25.797   4.217
  392    HH2  TRP  56           HH2      TRP  56  -5.123 -26.241   2.189
  393    H    HIS  57           HN       HIS  57  -7.070 -19.088   4.198
  394    HA   HIS  57           HA       HIS  57  -9.673 -18.474   5.528
  395   1HB   HIS  57          HB2       HIS  57  -9.593 -16.247   4.817
  396   2HB   HIS  57          HB1       HIS  57  -7.895 -16.549   5.171
  397    HD1  HIS  57           HD1      HIS  57  -7.339 -18.263   2.552
  398    HD2  HIS  57           HD2      HIS  57  -9.154 -14.512   2.640
  399    HE1  HIS  57           HE1      HIS  57  -7.022 -17.260   0.249
  400    H    GLN  58           HN       GLN  58 -11.279 -17.767   3.609
  401    HA   GLN  58           HA       GLN  58 -10.837 -19.659   1.322
  402   1HB   GLN  58          HB2       GLN  58 -12.434 -20.314   3.249
  403   2HB   GLN  58          HB1       GLN  58 -13.502 -19.063   2.613
  404   1HG   GLN  58          HG2       GLN  58 -13.680 -20.166   0.492
  405   2HG   GLN  58          HG1       GLN  58 -12.371 -21.279   0.891
  406   1HE2  GLN  58          HE21      GLN  58 -15.788 -20.566   1.457
  407   2HE2  GLN  58          HE22      GLN  58 -16.144 -22.018   2.260
  408    H    ARG  59           HN       ARG  59 -10.496 -16.653   1.592
  409    HA   ARG  59           HA       ARG  59 -12.463 -15.851  -0.530
  410   1HB   ARG  59          HB2       ARG  59 -11.427 -14.514   1.950
  411   2HB   ARG  59          HB1       ARG  59 -11.893 -13.509   0.578
  412   1HG   ARG  59          HG2       ARG  59 -14.005 -15.247   0.707
  413   2HG   ARG  59          HG1       ARG  59 -13.585 -15.084   2.412
  414   1HD   ARG  59          HD2       ARG  59 -13.548 -12.510   1.003
  415   2HD   ARG  59          HD1       ARG  59 -15.145 -13.287   0.989
  416    HE   ARG  59           HE       ARG  59 -14.180 -13.636   3.594
  417   1HH1  ARG  59          HH21      ARG  59 -13.932 -10.826   1.715
  418   2HH1  ARG  59          HH22      ARG  59 -14.737  -9.799   2.854
  419   1HH2  ARG  59          HH11      ARG  59 -15.624 -12.397   4.972
  420   2HH2  ARG  59          HH12      ARG  59 -15.693 -10.689   4.698
  421    H    THR  60           HN       THR  60  -9.727 -17.021  -0.793
  422    HA   THR  60           HA       THR  60  -7.644 -15.233  -1.331
  423    HB   THR  60           HB       THR  60  -7.453 -17.654  -1.538
  424    HG1  THR  60           HG1      THR  60  -6.088 -16.377  -2.860
  425   1HG2  THR  60          HG21      THR  60  -9.335 -17.341  -3.881
  426   2HG2  THR  60          HG22      THR  60  -9.726 -18.101  -2.339
  427   3HG2  THR  60          HG23      THR  60  -8.539 -18.843  -3.413
  428    H    THR  61           HN       THR  61  -6.903 -14.908  -3.756
  429    HA   THR  61           HA       THR  61  -8.820 -13.092  -4.996
  430    HB   THR  61           HB       THR  61  -6.768 -13.379  -6.762
  431    HG1  THR  61           HG1      THR  61  -5.417 -14.715  -5.867
  432   1HG2  THR  61          HG21      THR  61  -6.708 -11.886  -4.130
  433   2HG2  THR  61          HG22      THR  61  -7.429 -11.311  -5.633
  434   3HG2  THR  61          HG23      THR  61  -5.683 -11.533  -5.521
  435    H    GLU  62           HN       GLU  62  -8.206 -16.457  -5.080
  436    HA   GLU  62           HA       GLU  62  -8.772 -17.045  -7.809
  437   1HB   GLU  62          HB2       GLU  62  -7.899 -18.470  -5.757
  438   2HB   GLU  62          HB1       GLU  62  -9.616 -18.791  -5.511
  439   1HG   GLU  62          HG2       GLU  62  -9.843 -19.830  -7.628
  440   2HG   GLU  62          HG1       GLU  62  -8.315 -19.168  -8.208
  441    H    TYR  63           HN       TYR  63 -10.676 -16.133  -5.071
  442    HA   TYR  63           HA       TYR  63 -13.221 -16.880  -6.316
  443   1HB   TYR  63          HB2       TYR  63 -12.185 -15.897  -3.732
  444   2HB   TYR  63          HB1       TYR  63 -13.778 -15.270  -4.158
  445    HD1  TYR  63           HD1      TYR  63 -15.389 -17.148  -5.249
  446    HD2  TYR  63           HD2      TYR  63 -12.133 -17.902  -2.551
  447    HE1  TYR  63           HE1      TYR  63 -16.416 -19.315  -4.616
  448    HE2  TYR  63           HE2      TYR  63 -13.160 -20.069  -1.917
  449    HH   TYR  63           HH       TYR  63 -16.375 -20.958  -2.974
  450    H    TYR  64           HN       TYR  64 -10.982 -14.352  -6.565
  451    HA   TYR  64           HA       TYR  64 -13.086 -12.550  -7.728
  452   1HB   TYR  64          HB2       TYR  64 -10.774 -11.956  -5.865
  453   2HB   TYR  64          HB1       TYR  64 -11.607 -10.693  -6.771
  454    HD1  TYR  64           HD1      TYR  64 -11.813 -13.048  -3.983
  455    HD2  TYR  64           HD2      TYR  64 -14.015 -10.231  -6.363
  456    HE1  TYR  64           HE1      TYR  64 -13.599 -12.992  -2.263
  457    HE2  TYR  64           HE2      TYR  64 -15.802 -10.175  -4.644
  458    HH   TYR  64           HH       TYR  64 -16.394 -12.294  -2.537
  459    HA   PRO  65           HA       PRO  65 -10.002 -13.218 -10.974
  460   1HB   PRO  65          HB2       PRO  65 -11.668 -12.489 -13.020
  461   2HB   PRO  65          HB1       PRO  65 -11.681 -14.108 -12.293
  462   1HG   PRO  65          HG2       PRO  65 -13.521 -11.815 -11.838
  463   2HG   PRO  65          HG1       PRO  65 -13.876 -13.547 -11.935
  464   1HD   PRO  65          HD2       PRO  65 -13.705 -12.169  -9.584
  465   2HD   PRO  65          HD1       PRO  65 -13.367 -13.907  -9.734
  466    H    ASN  66           HN       ASN  66 -11.761 -10.429  -9.955
  467    HA   ASN  66           HA       ASN  66  -9.829  -8.677 -11.440
  468   1HB   ASN  66          HB2       ASN  66 -12.791  -8.689 -11.204
  469   2HB   ASN  66          HB1       ASN  66 -12.018  -7.105 -11.113
  470   1HD2  ASN  66          HD21      ASN  66 -13.066  -9.546 -13.287
  471   2HD2  ASN  66          HD22      ASN  66 -12.304  -8.952 -14.683
  472    H    GLY  67           HN       GLY  67  -9.436  -9.695  -8.772
  473   1HA   GLY  67          HA2       GLY  67 -10.303  -7.723  -6.822
  474   2HA   GLY  67          HA1       GLY  67  -9.086  -8.973  -6.556
  475    H    GLY  68           HN       GLY  68  -7.199  -8.397  -8.458
  476   1HA   GLY  68          HA2       GLY  68  -5.646  -6.725  -9.191
  477   2HA   GLY  68          HA1       GLY  68  -6.509  -5.532  -8.218
  478    H    LEU  69           HN       LEU  69  -6.281  -8.100  -6.231
  479    HA   LEU  69           HA       LEU  69  -3.755  -7.079  -5.008
  480   1HB   LEU  69          HB2       LEU  69  -4.820  -8.093  -2.938
  481   2HB   LEU  69          HB1       LEU  69  -5.721  -6.763  -3.654
  482    HG   LEU  69           HG       LEU  69  -6.428  -9.371  -4.782
  483   1HD1  LEU  69          HD11      LEU  69  -7.815  -9.908  -2.692
  484   2HD1  LEU  69          HD12      LEU  69  -6.758  -8.788  -1.831
  485   3HD1  LEU  69          HD13      LEU  69  -6.086 -10.235  -2.581
  486   1HD2  LEU  69          HD21      LEU  69  -8.072  -7.223  -3.406
  487   2HD2  LEU  69          HD22      LEU  69  -8.662  -8.455  -4.522
  488   3HD2  LEU  69          HD23      LEU  69  -7.608  -7.168  -5.107
  489    H    THR  70           HN       THR  70  -2.710  -8.581  -6.640
  490    HA   THR  70           HA       THR  70  -3.004 -11.467  -6.306
  491    HB   THR  70           HB       THR  70  -1.108  -9.609  -7.754
  492    HG1  THR  70           HG1      THR  70  -3.412 -10.995  -8.298
  493   1HG2  THR  70          HG21      THR  70  -1.100 -12.638  -7.712
  494   2HG2  THR  70          HG22      THR  70   0.179 -11.584  -7.110
  495   3HG2  THR  70          HG23      THR  70  -0.176 -11.642  -8.836
  496    H    ARG  71           HN       ARG  71  -1.322 -12.879  -5.443
  497    HA   ARG  71           HA       ARG  71   0.242 -13.498  -3.779
  498   1HB   ARG  71          HB2       ARG  71   1.349 -11.729  -5.522
  499   2HB   ARG  71          HB1       ARG  71   1.566 -10.847  -4.010
  500   1HG   ARG  71          HG2       ARG  71   2.569 -12.957  -3.035
  501   2HG   ARG  71          HG1       ARG  71   2.542 -13.639  -4.661
  502   1HD   ARG  71          HD2       ARG  71   4.203 -12.207  -5.439
  503   2HD   ARG  71          HD1       ARG  71   3.805 -10.943  -4.258
  504    HE   ARG  71           HE       ARG  71   4.667 -12.700  -2.526
  505   1HH1  ARG  71          HH11      ARG  71   5.461 -14.341  -5.096
  506   2HH1  ARG  71          HH12      ARG  71   7.174 -14.086  -5.072
  507   1HH2  ARG  71          HH21      ARG  71   7.025 -11.496  -2.774
  508   2HH2  ARG  71          HH22      ARG  71   8.059 -12.475  -3.759
  509    H    ASN  72           HN       ASN  72   1.587 -11.230  -2.190
  510    HA   ASN  72           HA       ASN  72  -0.439 -11.107  -0.052
  511   1HB   ASN  72          HB2       ASN  72   1.469 -10.054   1.154
  512   2HB   ASN  72          HB1       ASN  72   1.934 -11.576   0.391
  513   1HD2  ASN  72          HD21      ASN  72   1.857  -8.042  -0.357
  514   2HD2  ASN  72          HD22      ASN  72   3.280  -8.064  -1.280
  515    H    TYR  73           HN       TYR  73  -0.340  -9.435  -2.780
  516    HA   TYR  73           HA       TYR  73  -0.005  -6.700  -2.302
  517   1HB   TYR  73          HB2       TYR  73  -1.886  -8.383  -3.948
  518   2HB   TYR  73          HB1       TYR  73  -2.120  -6.638  -3.917
  519    HD1  TYR  73           HD1      TYR  73  -1.610  -6.919  -6.444
  520    HD2  TYR  73           HD2      TYR  73   1.293  -7.573  -3.344
  521    HE1  TYR  73           HE1      TYR  73   0.218  -6.641  -8.096
  522    HE2  TYR  73           HE2      TYR  73   3.120  -7.294  -4.997
  523    HH   TYR  73           HH       TYR  73   2.415  -6.806  -8.450
  524    H    CYS  74           HN       CYS  74  -1.139  -5.171  -1.196
  525    HA   CYS  74           HA       CYS  74  -3.297  -6.048   0.637
  526   1HB   CYS  74          HB2       CYS  74  -1.311  -4.772   1.403
  527   2HB   CYS  74          HB1       CYS  74  -1.754  -3.453   0.322
  528    H    ARG  75           HN       ARG  75  -5.416  -5.349   0.408
  529    HA   ARG  75           HA       ARG  75  -6.051  -3.143  -1.466
  530   1HB   ARG  75          HB2       ARG  75  -6.165  -5.987  -2.058
  531   2HB   ARG  75          HB1       ARG  75  -7.754  -5.243  -2.228
  532   1HG   ARG  75          HG2       ARG  75  -5.967  -3.412  -3.389
  533   2HG   ARG  75          HG1       ARG  75  -5.429  -4.992  -3.954
  534   1HD   ARG  75          HD2       ARG  75  -7.938  -5.440  -4.467
  535   2HD   ARG  75          HD1       ARG  75  -8.122  -3.679  -4.339
  536    HE   ARG  75           HE       ARG  75  -5.997  -4.815  -6.104
  537   1HH1  ARG  75          HH11      ARG  75  -9.156  -3.537  -5.892
  538   2HH1  ARG  75          HH12      ARG  75  -9.011  -2.549  -7.307
  539   1HH2  ARG  75          HH21      ARG  75  -5.660  -3.280  -7.803
  540   2HH2  ARG  75          HH22      ARG  75  -7.034  -2.403  -8.387
  541    H    ASN  76           HN       ASN  76  -8.719  -3.315  -1.624
  542    HA   ASN  76           HA       ASN  76  -9.702  -3.697   1.184
  543   1HB   ASN  76          HB2       ASN  76  -9.164  -1.309   0.077
  544   2HB   ASN  76          HB1       ASN  76 -10.794  -1.534  -0.557
  545   1HD2  ASN  76          HD21      ASN  76 -10.924   0.489   1.076
  546   2HD2  ASN  76          HD22      ASN  76 -11.411   0.089   2.652
  547    HA   PRO  77           HA       PRO  77 -12.400  -6.042  -1.661
  548   1HB   PRO  77          HB2       PRO  77 -12.893  -8.065   0.110
  549   2HB   PRO  77          HB1       PRO  77 -11.452  -8.017  -0.925
  550   1HG   PRO  77          HG2       PRO  77 -11.738  -7.335   1.953
  551   2HG   PRO  77          HG1       PRO  77 -10.401  -8.126   1.107
  552   1HD   PRO  77          HD2       PRO  77 -10.401  -5.489   1.863
  553   2HD   PRO  77          HD1       PRO  77  -9.433  -6.145   0.524
  554    H    ASP  78           HN       ASP  78 -12.881  -4.165   1.030
  555    HA   ASP  78           HA       ASP  78 -15.832  -4.676   0.965
  556   1HB   ASP  78          HB2       ASP  78 -14.837  -5.739   2.937
  557   2HB   ASP  78          HB1       ASP  78 -14.040  -4.226   3.372
  558    H    ALA  79           HN       ALA  79 -13.595  -2.511   0.139
  559    HA   ALA  79           HA       ALA  79 -13.601  -0.161  -0.121
  560   1HB   ALA  79          HB1       ALA  79 -15.777   0.732  -0.507
  561   2HB   ALA  79          HB2       ALA  79 -16.523  -0.404   0.617
  562   3HB   ALA  79          HB3       ALA  79 -15.905  -0.974  -0.933
  563    H    GLU  80           HN       GLU  80 -13.035  -1.259   2.562
  564    HA   GLU  80           HA       GLU  80 -14.391   0.298   4.590
  565   1HB   GLU  80          HB2       GLU  80 -12.488  -1.778   4.367
  566   2HB   GLU  80          HB1       GLU  80 -11.676  -0.480   5.242
  567   1HG   GLU  80          HG2       GLU  80 -13.031  -0.685   7.065
  568   2HG   GLU  80          HG1       GLU  80 -14.462  -1.019   6.088
  569    H    ILE  81           HN       ILE  81 -12.839   1.775   6.033
  570    HA   ILE  81           HA       ILE  81 -12.343   4.224   4.850
  571    HB   ILE  81           HB       ILE  81 -12.199   3.605   7.260
  572   1HG1  ILE  81          HG12      ILE  81 -11.197   5.747   6.327
  573   2HG1  ILE  81          HG11      ILE  81 -10.514   5.208   7.860
  574   1HG2  ILE  81          HG21      ILE  81  -9.449   2.570   6.552
  575   2HG2  ILE  81          HG22      ILE  81 -10.844   1.545   6.890
  576   3HG2  ILE  81          HG23      ILE  81 -10.189   2.588   8.153
  577   1HD1  ILE  81          HD11      ILE  81  -8.491   5.339   6.862
  578   2HD1  ILE  81          HD12      ILE  81  -9.213   5.514   5.264
  579   3HD1  ILE  81          HD13      ILE  81  -8.953   3.909   5.942
  580    H    SER  82           HN       SER  82 -10.117   1.475   5.040
  581    HA   SER  82           HA       SER  82  -8.681   2.449   2.638
  582   1HB   SER  82          HB2       SER  82  -6.507   2.147   3.990
  583   2HB   SER  82          HB1       SER  82  -7.473   3.572   4.362
  584    HG   SER  82           HG       SER  82  -8.032   1.212   5.740
  585    HA   PRO  83           HA       PRO  83  -8.246  -1.848   1.915
  586   1HB   PRO  83          HB2       PRO  83  -5.764  -2.046   0.781
  587   2HB   PRO  83          HB1       PRO  83  -7.159  -1.340  -0.059
  588   1HG   PRO  83          HG2       PRO  83  -4.886   0.010   1.302
  589   2HG   PRO  83          HG1       PRO  83  -5.738   0.453  -0.185
  590   1HD   PRO  83          HD2       PRO  83  -6.169   1.659   2.229
  591   2HD   PRO  83          HD1       PRO  83  -7.384   1.568   0.940
  592    H    TRP  84           HN       TRP  84  -7.283  -3.778   2.740
  593    HA   TRP  84           HA       TRP  84  -5.066  -3.468   4.713
  594   1HB   TRP  84          HB2       TRP  84  -6.457  -4.868   6.293
  595   2HB   TRP  84          HB1       TRP  84  -7.122  -3.265   5.986
  596    HD1  TRP  84           HD1      TRP  84  -9.377  -3.091   4.672
  597    HE1  TRP  84           HE1      TRP  84 -11.138  -4.832   3.954
  598    HE3  TRP  84           HE3      TRP  84  -6.748  -7.393   5.485
  599    HZ2  TRP  84           HZ2      TRP  84 -11.398  -7.673   3.755
  600    HZ3  TRP  84           HZ3      TRP  84  -7.776  -9.600   5.026
  601    HH2  TRP  84           HH2      TRP  84 -10.095  -9.746   4.161
  602    H    CYS  85           HN       CYS  85  -4.989  -6.111   5.619
  603    HA   CYS  85           HA       CYS  85  -5.413  -8.110   3.632
  604   1HB   CYS  85          HB2       CYS  85  -3.927  -7.368   2.088
  605   2HB   CYS  85          HB1       CYS  85  -3.229  -6.214   3.214
  606    H    TYR  86           HN       TYR  86  -3.919 -10.064   4.046
  607    HA   TYR  86           HA       TYR  86  -3.870 -10.637   6.882
  608   1HB   TYR  86          HB2       TYR  86  -2.773 -12.046   4.427
  609   2HB   TYR  86          HB1       TYR  86  -2.899 -12.785   6.024
  610    HD1  TYR  86           HD1      TYR  86  -4.395 -13.098   3.075
  611    HD2  TYR  86           HD2      TYR  86  -5.447 -11.778   7.024
  612    HE1  TYR  86           HE1      TYR  86  -6.768 -13.670   2.636
  613    HE2  TYR  86           HE2      TYR  86  -7.818 -12.349   6.587
  614    HH   TYR  86           HH       TYR  86  -9.314 -12.810   4.906
  615    H    THR  87           HN       THR  87  -1.792 -11.583   7.885
  616    HA   THR  87           HA       THR  87   0.518  -9.776   7.248
  617    HB   THR  87           HB       THR  87   0.968 -10.816   9.736
  618    HG1  THR  87           HG1      THR  87  -0.807 -11.788  10.243
  619   1HG2  THR  87          HG21      THR  87   0.560  -8.687  10.500
  620   2HG2  THR  87          HG22      THR  87  -0.931  -8.523   9.573
  621   3HG2  THR  87          HG23      THR  87   0.632  -8.364   8.768
  622    H    MET  88           HN       MET  88   2.408 -10.769   6.595
  623    HA   MET  88           HA       MET  88   2.578 -13.543   5.974
  624   1HB   MET  88          HB2       MET  88   3.988 -11.242   5.499
  625   2HB   MET  88          HB1       MET  88   5.076 -12.093   6.595
  626   1HG   MET  88          HG2       MET  88   4.441 -14.146   4.989
  627   2HG   MET  88          HG1       MET  88   4.202 -12.828   3.841
  628   1HE   MET  88          HE1       MET  88   5.837 -14.927   3.279
  629   2HE   MET  88          HE2       MET  88   7.589 -14.747   3.324
  630   3HE   MET  88          HE3       MET  88   6.633 -13.724   2.255
  631    H    ASP  89           HN       ASP  89   2.616 -12.093   9.054
  632    HA   ASP  89           HA       ASP  89   4.358 -14.206  10.210
  633   1HB   ASP  89          HB2       ASP  89   3.428 -11.454  10.952
  634   2HB   ASP  89          HB1       ASP  89   3.856 -12.566  12.252
  635    HA   PRO  90           HA       PRO  90   0.679 -16.267  11.506
  636   1HB   PRO  90          HB2       PRO  90   1.840 -17.911  13.369
  637   2HB   PRO  90          HB1       PRO  90   1.972 -18.185  11.619
  638   1HG   PRO  90          HG2       PRO  90   3.934 -16.954  13.493
  639   2HG   PRO  90          HG1       PRO  90   4.210 -18.059  12.137
  640   1HD   PRO  90          HD2       PRO  90   4.641 -15.377  11.972
  641   2HD   PRO  90          HD1       PRO  90   4.163 -16.369  10.577
  642    H    ASN  91           HN       ASN  91   2.475 -14.074  13.303
  643    HA   ASN  91           HA       ASN  91   0.996 -14.420  15.839
  644   1HB   ASN  91          HB2       ASN  91   3.124 -12.552  14.769
  645   2HB   ASN  91          HB1       ASN  91   2.387 -12.312  16.354
  646   1HD2  ASN  91          HD21      ASN  91   4.728 -14.183  14.587
  647   2HD2  ASN  91          HD22      ASN  91   5.181 -15.204  15.865
  648    H    VAL  92           HN       VAL  92   0.559 -12.861  12.830
  649    HA   VAL  92           HA       VAL  92  -1.455 -10.995  14.045
  650    HB   VAL  92           HB       VAL  92   0.280 -10.702  11.562
  651   1HG1  VAL  92          HG11      VAL  92  -1.913  -9.041  12.794
  652   2HG1  VAL  92          HG12      VAL  92  -1.643  -9.436  11.097
  653   3HG1  VAL  92          HG13      VAL  92  -0.613  -8.253  11.901
  654   1HG2  VAL  92          HG21      VAL  92   1.424 -10.524  13.825
  655   2HG2  VAL  92          HG22      VAL  92   0.380  -9.142  14.161
  656   3HG2  VAL  92          HG23      VAL  92   1.528  -9.076  12.823
  657    H    ARG  93           HN       ARG  93  -3.534 -11.392  13.328
  658    HA   ARG  93           HA       ARG  93  -4.056 -13.472  11.392
  659   1HB   ARG  93          HB2       ARG  93  -5.461 -13.026  13.369
  660   2HB   ARG  93          HB1       ARG  93  -5.829 -11.418  12.746
  661   1HG   ARG  93          HG2       ARG  93  -6.767 -12.543  10.679
  662   2HG   ARG  93          HG1       ARG  93  -6.604 -14.080  11.530
  663   1HD   ARG  93          HD2       ARG  93  -8.212 -11.699  12.532
  664   2HD   ARG  93          HD1       ARG  93  -8.894 -13.168  11.805
  665    HE   ARG  93           HE       ARG  93  -7.398 -13.089  14.390
  666   1HH1  ARG  93          HH11      ARG  93  -7.485 -15.590  12.480
  667   2HH1  ARG  93          HH12      ARG  93  -8.689 -16.528  13.299
  668   1HH2  ARG  93          HH21      ARG  93  -9.774 -13.895  15.276
  669   2HH2  ARG  93          HH22      ARG  93  -9.986 -15.567  14.881
  670    H    TRP  94           HN       TRP  94  -4.638  -9.964  11.495
  671    HA   TRP  94           HA       TRP  94  -4.088  -9.678   8.625
  672   1HB   TRP  94          HB2       TRP  94  -6.328  -9.005   8.025
  673   2HB   TRP  94          HB1       TRP  94  -6.476 -10.537   8.886
  674    HD1  TRP  94           HD1      TRP  94  -7.791 -10.558  11.111
  675    HE1  TRP  94           HE1      TRP  94  -9.075  -8.773  12.457
  676    HE3  TRP  94           HE3      TRP  94  -6.300  -6.349   8.637
  677    HZ2  TRP  94           HZ2      TRP  94  -9.421  -5.933  12.480
  678    HZ3  TRP  94           HZ3      TRP  94  -7.118  -4.119   9.341
  679    HH2  TRP  94           HH2      TRP  94  -8.676  -3.905  11.257
  680    H    GLU  95           HN       GLU  95  -4.316  -7.247   8.044
  681    HA   GLU  95           HA       GLU  95  -4.553  -5.372  10.282
  682   1HB   GLU  95          HB2       GLU  95  -2.041  -6.663   9.600
  683   2HB   GLU  95          HB1       GLU  95  -1.912  -4.912   9.437
  684   1HG   GLU  95          HG2       GLU  95  -2.836  -6.446  11.883
  685   2HG   GLU  95          HG1       GLU  95  -1.354  -5.502  11.722
  686    H    TYR  96           HN       TYR  96  -4.849  -3.273   9.512
  687    HA   TYR  96           HA       TYR  96  -5.399  -2.824   6.738
  688   1HB   TYR  96          HB2       TYR  96  -5.044  -1.219   9.243
  689   2HB   TYR  96          HB1       TYR  96  -5.055  -0.347   7.710
  690    HD1  TYR  96           HD1      TYR  96  -7.016  -0.727   6.110
  691    HD2  TYR  96           HD2      TYR  96  -7.054  -1.994  10.214
  692    HE1  TYR  96           HE1      TYR  96  -9.490  -0.887   6.038
  693    HE2  TYR  96           HE2      TYR  96  -9.527  -2.155  10.141
  694    HH   TYR  96           HH       TYR  96 -11.398  -1.079   8.754
  695    H    CYS  97           HN       CYS  97  -4.120  -0.991   5.508
  696    HA   CYS  97           HA       CYS  97  -1.200  -1.575   5.838
  697   1HB   CYS  97          HB2       CYS  97  -2.979  -1.003   3.465
  698   2HB   CYS  97          HB1       CYS  97  -1.220  -0.932   3.347
  699    H    ASN  98           HN       ASN  98   0.133   0.318   4.743
  700    HA   ASN  98           HA       ASN  98  -0.545   2.763   6.240
  701   1HB   ASN  98          HB2       ASN  98   1.763   1.583   4.764
  702   2HB   ASN  98          HB1       ASN  98   1.742   3.333   4.984
  703   1HD2  ASN  98          HD21      ASN  98   3.421   1.119   6.330
  704   2HD2  ASN  98          HD22      ASN  98   3.225   1.410   7.991
  705    H    LEU  99           HN       LEU  99  -2.545   2.969   4.526
  706    HA   LEU  99           HA       LEU  99  -1.531   4.360   2.085
  707   1HB   LEU  99          HB2       LEU  99  -4.416   3.751   2.672
  708   2HB   LEU  99          HB1       LEU  99  -3.607   3.858   1.115
  709    HG   LEU  99           HG       LEU  99  -3.837   1.580   1.293
  710   1HD1  LEU  99          HD11      LEU  99  -1.277   2.481   1.637
  711   2HD1  LEU  99          HD12      LEU  99  -1.712   0.798   1.338
  712   3HD1  LEU  99          HD13      LEU  99  -1.443   1.360   2.988
  713   1HD2  LEU  99          HD21      LEU  99  -4.155   2.212   4.095
  714   2HD2  LEU  99          HD22      LEU  99  -3.173   0.769   3.879
  715   3HD2  LEU  99          HD23      LEU  99  -4.783   0.843   3.182
  716    H    THR 100           HN       THR 100  -1.866   6.540   1.833
  717    HA   THR 100           HA       THR 100  -3.255   7.990   4.048
  718    HB   THR 100           HB       THR 100  -1.840   9.834   3.414
  719    HG1  THR 100           HG1      THR 100  -0.417   9.525   1.584
  720   1HG2  THR 100          HG21      THR 100  -0.149   8.853   4.520
  721   2HG2  THR 100          HG22      THR 100   0.339   8.025   3.041
  722   3HG2  THR 100          HG23      THR 100  -0.824   7.270   4.131
  723    H    GLN 101           HN       GLN 101  -4.657   9.819   3.334
  724    HA   GLN 101           HA       GLN 101  -6.366   9.107   1.132
  725   1HB   GLN 101          HB2       GLN 101  -6.541  10.721   3.301
  726   2HB   GLN 101          HB1       GLN 101  -6.235  11.932   2.054
  727   1HG   GLN 101          HG2       GLN 101  -8.077  10.557   0.730
  728   2HG   GLN 101          HG1       GLN 101  -8.563  10.069   2.354
  729   1HE2  GLN 101          HE21      GLN 101  -9.894  11.521   3.464
  730   2HE2  GLN 101          HE22      GLN 101 -10.121  13.148   3.034
  731    H    CYS 102           HN       CYS 102  -5.250   8.981  -0.858
  732    HA   CYS 102           HA       CYS 102  -3.735  11.391  -1.682
  733   1HB   CYS 102          HB2       CYS 102  -3.247   8.609  -1.826
  734   2HB   CYS 102          HB1       CYS 102  -3.446   9.186  -3.480
  735    HA   PRO 103           HA       PRO 103  -7.686  11.326  -4.165
  736   1HB   PRO 103          HB2       PRO 103  -8.352  13.944  -3.713
  737   2HB   PRO 103          HB1       PRO 103  -8.850  12.621  -2.638
  738   1HG   PRO 103          HG2       PRO 103  -6.617  14.569  -2.332
  739   2HG   PRO 103          HG1       PRO 103  -7.734  13.934  -1.114
  740   1HD   PRO 103          HD2       PRO 103  -5.186  13.033  -1.401
  741   2HD   PRO 103          HD1       PRO 103  -6.519  12.018  -0.804
  742    H    VAL 104           HN       VAL 104  -5.871  11.164  -5.826
  743    HA   VAL 104           HA       VAL 104  -5.385  13.836  -7.104
  744    HB   VAL 104           HB       VAL 104  -3.566  11.408  -7.078
  745   1HG1  VAL 104          HG11      VAL 104  -3.525  14.077  -8.349
  746   2HG1  VAL 104          HG12      VAL 104  -2.688  12.596  -8.813
  747   3HG1  VAL 104          HG13      VAL 104  -2.025  13.620  -7.540
  748   1HG2  VAL 104          HG21      VAL 104  -3.716  12.217  -4.812
  749   2HG2  VAL 104          HG22      VAL 104  -3.613  13.895  -5.345
  750   3HG2  VAL 104          HG23      VAL 104  -2.207  12.838  -5.482
  751    H    THR 105           HN       THR 105  -7.025  10.988  -7.418
  752    HA   THR 105           HA       THR 105  -6.529  10.621 -10.323
  753    HB   THR 105           HB       THR 105  -8.491   9.161  -8.547
  754    HG1  THR 105           HG1      THR 105  -5.704   9.110  -8.593
  755   1HG2  THR 105          HG21      THR 105  -8.732   7.874 -10.370
  756   2HG2  THR 105          HG22      THR 105  -7.001   7.536 -10.373
  757   3HG2  THR 105          HG23      THR 105  -7.628   8.931 -11.249
  758    H    GLU 106           HN       GLU 106  -7.993  13.006  -9.009
  759    HA   GLU 106           HA       GLU 106 -10.723  13.086  -9.313
  760   1HB   GLU 106          HB2       GLU 106  -8.705  14.881  -9.034
  761   2HB   GLU 106          HB1       GLU 106  -9.220  15.251 -10.681
  762   1HG   GLU 106          HG2       GLU 106 -10.874  16.485  -9.768
  763   2HG   GLU 106          HG1       GLU 106 -11.612  14.963  -9.265
  764    H    SER 107           HN       SER 107 -12.174  12.875 -11.002
  765    HA   SER 107           HA       SER 107 -11.358  11.759 -13.519
  766   1HB   SER 107          HB2       SER 107 -13.815  12.706 -12.162
  767   2HB   SER 107          HB1       SER 107 -13.889  12.696 -13.922
  768    HG   SER 107           HG       SER 107 -13.873  10.625 -12.151
  769    H    SER 108           HN       SER 108 -13.449  14.585 -13.545
  770    HA   SER 108           HA       SER 108 -11.712  15.799 -15.637
  771   1HB   SER 108          HB2       SER 108 -14.487  15.415 -15.222
  772   2HB   SER 108          HB1       SER 108 -14.211  17.151 -15.115
  773    HG   SER 108           HG       SER 108 -13.376  15.410 -17.203
  774    H    VAL 109           HN       VAL 109 -11.075  18.031 -15.464
  775    HA   VAL 109           HA       VAL 109 -11.583  19.429 -12.893
  776    HB   VAL 109           HB       VAL 109  -9.601  17.907 -12.637
  777   1HG1  VAL 109          HG11      VAL 109  -7.567  18.407 -13.897
  778   2HG1  VAL 109          HG12      VAL 109  -8.383  19.726 -14.738
  779   3HG1  VAL 109          HG13      VAL 109  -8.880  18.058 -15.022
  780   1HG2  VAL 109          HG21      VAL 109  -7.988  19.847 -12.006
  781   2HG2  VAL 109          HG22      VAL 109  -9.553  19.780 -11.197
  782   3HG2  VAL 109          HG23      VAL 109  -9.297  20.907 -12.528
  783    H    LEU 110           HN       LEU 110 -11.274  21.697 -13.076
  784    HA   LEU 110           HA       LEU 110 -10.237  22.776 -15.649
  785   1HB   LEU 110          HB2       LEU 110 -13.027  23.067 -14.514
  786   2HB   LEU 110          HB1       LEU 110 -12.380  24.196 -15.705
  787    HG   LEU 110           HG       LEU 110 -12.426  21.199 -16.124
  788   1HD1  LEU 110          HD11      LEU 110 -14.286  22.206 -17.844
  789   2HD1  LEU 110          HD12      LEU 110 -14.531  23.253 -16.445
  790   3HD1  LEU 110          HD13      LEU 110 -14.680  21.503 -16.275
  791   1HD2  LEU 110          HD21      LEU 110 -10.834  22.170 -17.574
  792   2HD2  LEU 110          HD22      LEU 110 -11.806  23.622 -17.810
  793   3HD2  LEU 110          HD23      LEU 110 -12.296  22.103 -18.558
  794    H    ALA 111           HN       ALA 111 -12.235  24.326 -13.152
  795    HA   ALA 111           HA       ALA 111 -10.499  26.574 -12.836
  796   1HB   ALA 111          HB1       ALA 111 -12.928  26.436 -12.283
  797   2HB   ALA 111          HB2       ALA 111 -11.975  27.056 -10.935
  798   3HB   ALA 111          HB3       ALA 111 -12.534  25.384 -10.924
  799    H    THR 112           HN       THR 112  -9.965  26.965 -10.206
  800    HA   THR 112           HA       THR 112  -7.679  25.218  -9.722
  801    HB   THR 112           HB       THR 112  -7.757  27.669  -9.281
  802    HG1  THR 112           HG1      THR 112  -7.294  27.147  -6.791
  803   1HG2  THR 112          HG21      THR 112  -9.130  27.607  -6.765
  804   2HG2  THR 112          HG22      THR 112 -10.198  26.954  -8.007
  805   3HG2  THR 112          HG23      THR 112  -9.508  28.566  -8.196
  806    H    SER 113           HN       SER 113  -7.379  24.122  -7.573
  807    HA   SER 113           HA       SER 113  -9.338  22.198  -6.973
  808   1HB   SER 113          HB2       SER 113  -7.633  23.201  -4.754
  809   2HB   SER 113          HB1       SER 113  -7.798  21.566  -5.388
  810    HG   SER 113           HG       SER 113  -5.818  23.110  -5.820
  811    H    THR 114           HN       THR 114 -10.745  22.033  -5.033
  812    HA   THR 114           HA       THR 114 -11.418  24.548  -3.630
  813    HB   THR 114           HB       THR 114 -13.357  23.068  -5.437
  814    HG1  THR 114           HG1      THR 114 -12.896  24.538  -6.864
  815   1HG2  THR 114          HG21      THR 114 -14.302  24.090  -3.325
  816   2HG2  THR 114          HG22      THR 114 -14.967  24.743  -4.822
  817   3HG2  THR 114          HG23      THR 114 -13.756  25.657  -3.923
  818    H    ALA 115           HN       ALA 115 -11.758  23.941  -1.539
  819    HA   ALA 115           HA       ALA 115 -12.548  21.127  -0.955
  820   1HB   ALA 115          HB1       ALA 115 -11.951  22.201   1.432
  821   2HB   ALA 115          HB2       ALA 115 -11.112  23.365   0.408
  822   3HB   ALA 115          HB3       ALA 115 -10.692  21.654   0.325
  823    H    VAL 116           HN       VAL 116 -13.170  23.825   1.200
  824    HA   VAL 116           HA       VAL 116 -16.120  23.395   0.833
  825    HB   VAL 116           HB       VAL 116 -16.212  23.799   3.317
  826   1HG1  VAL 116          HG11      VAL 116 -14.400  21.578   3.401
  827   2HG1  VAL 116          HG12      VAL 116 -15.313  21.500   1.893
  828   3HG1  VAL 116          HG13      VAL 116 -16.164  21.553   3.437
  829   1HG2  VAL 116          HG21      VAL 116 -13.446  23.173   3.843
  830   2HG2  VAL 116          HG22      VAL 116 -14.386  24.555   4.403
  831   3HG2  VAL 116          HG23      VAL 116 -13.540  24.632   2.858
  832    H    SER 117           HN       SER 117 -16.853  25.266  -0.127
  833    HA   SER 117           HA       SER 117 -15.551  27.858   0.451
  834   1HB   SER 117          HB2       SER 117 -17.983  27.385  -1.262
  835   2HB   SER 117          HB1       SER 117 -16.703  28.575  -1.476
  836    HG   SER 117           HG       SER 117 -16.880  26.131  -2.496
  837    H    GLU 118           HN       GLU 118 -16.278  29.078   2.141
  838    HA   GLU 118           HA       GLU 118 -18.478  28.549   3.803
  839   1HB   GLU 118          HB2       GLU 118 -16.753  30.879   3.108
  840   2HB   GLU 118          HB1       GLU 118 -18.222  31.228   4.021
  841   1HG   GLU 118          HG2       GLU 118 -17.241  29.008   5.327
  842   2HG   GLU 118          HG1       GLU 118 -15.764  29.864   4.883
  843    H    GLN 119           HN       GLN 119 -18.355  30.345   0.755
  844    HA   GLN 119           HA       GLN 119 -21.298  30.197   0.547
  845   1HB   GLN 119          HB2       GLN 119 -20.664  32.245   1.904
  846   2HB   GLN 119          HB1       GLN 119 -19.840  32.854   0.468
  847   1HG   GLN 119          HG2       GLN 119 -21.799  33.298  -0.635
  848   2HG   GLN 119          HG1       GLN 119 -22.632  31.916   0.077
  849   1HE2  GLN 119          HE21      GLN 119 -23.195  32.175   2.490
  850   2HE2  GLN 119          HE22      GLN 119 -23.608  33.728   3.036
  Start of MODEL    9
    1   1H    ALA   1          HT1       ALA   1  19.904  16.306  -8.281
    2   2H    ALA   1          HT2       ALA   1  20.082  17.826  -9.018
    3   3H    ALA   1          HT3       ALA   1  18.558  17.321  -8.462
    4    HA   ALA   1           HA       ALA   1  19.124  17.600  -6.226
    5   1HB   ALA   1          HB1       ALA   1  21.780  18.124  -6.004
    6   2HB   ALA   1          HB2       ALA   1  21.791  17.095  -7.436
    7   3HB   ALA   1          HB3       ALA   1  21.114  16.494  -5.922
    8    H    ARG   2           HN       ARG   2  21.677  19.397  -7.950
    9    HA   ARG   2           HA       ARG   2  22.011  21.728  -8.168
   10   1HB   ARG   2          HB2       ARG   2  19.224  21.026  -8.808
   11   2HB   ARG   2          HB1       ARG   2  19.445  22.727  -8.396
   12   1HG   ARG   2          HG2       ARG   2  20.680  23.155 -10.264
   13   2HG   ARG   2          HG1       ARG   2  21.499  21.594 -10.200
   14   1HD   ARG   2          HD2       ARG   2  19.144  20.630 -10.871
   15   2HD   ARG   2          HD1       ARG   2  18.849  22.284 -11.447
   16    HE   ARG   2           HE       ARG   2  21.079  20.532 -12.395
   17   1HH1  ARG   2          HH21      ARG   2  18.512  21.746 -13.822
   18   2HH1  ARG   2          HH22      ARG   2  19.300  22.880 -14.867
   19   1HH2  ARG   2          HH11      ARG   2  22.350  22.672 -13.230
   20   2HH2  ARG   2          HH12      ARG   2  21.473  23.405 -14.532
   21    H    ILE   3           HN       ILE   3  20.649  23.917  -7.247
   22    HA   ILE   3           HA       ILE   3  20.929  23.637  -4.311
   23    HB   ILE   3           HB       ILE   3  20.397  26.066  -6.052
   24   1HG1  ILE   3          HG12      ILE   3  23.105  25.276  -5.007
   25   2HG1  ILE   3          HG11      ILE   3  22.511  24.564  -6.507
   26   1HG2  ILE   3          HG21      ILE   3  21.150  25.600  -3.191
   27   2HG2  ILE   3          HG22      ILE   3  20.046  26.792  -3.877
   28   3HG2  ILE   3          HG23      ILE   3  21.789  27.025  -4.010
   29   1HD1  ILE   3          HD11      ILE   3  22.266  26.728  -7.531
   30   2HD1  ILE   3          HD12      ILE   3  23.874  26.680  -6.808
   31   3HD1  ILE   3          HD13      ILE   3  22.570  27.549  -6.000
   32    H    HIS   4           HN       HIS   4  18.886  22.399  -4.028
   33    HA   HIS   4           HA       HIS   4  16.457  24.151  -4.250
   34   1HB   HIS   4          HB2       HIS   4  17.014  21.746  -5.502
   35   2HB   HIS   4          HB1       HIS   4  16.057  21.244  -4.108
   36    HD1  HIS   4           HD1      HIS   4  14.350  20.716  -6.267
   37    HD2  HIS   4           HD2      HIS   4  14.862  24.690  -5.117
   38    HE1  HIS   4           HE1      HIS   4  12.385  21.997  -7.223
   39    H    HIS   5           HN       HIS   5  18.429  22.107  -2.228
   40    HA   HIS   5           HA       HIS   5  17.192  23.052   0.199
   41   1HB   HIS   5          HB2       HIS   5  15.572  21.340  -1.014
   42   2HB   HIS   5          HB1       HIS   5  16.646  20.142  -0.290
   43    HD1  HIS   5           HD1      HIS   5  13.556  21.201   0.503
   44    HD2  HIS   5           HD2      HIS   5  17.113  21.585   2.643
   45    HE1  HIS   5           HE1      HIS   5  12.901  21.544   2.926
   46    H    HIS   6           HN       HIS   6  19.351  23.286   0.919
   47    HA   HIS   6           HA       HIS   6  20.772  20.719   1.517
   48   1HB   HIS   6          HB2       HIS   6  21.511  22.240  -0.532
   49   2HB   HIS   6          HB1       HIS   6  22.277  23.194   0.738
   50    HD1  HIS   6           HD1      HIS   6  23.915  21.760   2.386
   51    HD2  HIS   6           HD2      HIS   6  22.969  20.001  -1.273
   52    HE1  HIS   6           HE1      HIS   6  25.627  19.932   2.006
   53    H    HIS   7           HN       HIS   7  19.463  21.509   3.594
   54    HA   HIS   7           HA       HIS   7  20.778  23.686   5.085
   55   1HB   HIS   7          HB2       HIS   7  18.269  22.910   4.999
   56   2HB   HIS   7          HB1       HIS   7  18.789  21.711   6.184
   57    HD1  HIS   7           HD1      HIS   7  17.298  22.993   7.977
   58    HD2  HIS   7           HD2      HIS   7  20.513  25.182   6.478
   59    HE1  HIS   7           HE1      HIS   7  17.610  24.965   9.535
   60    H    HIS   8           HN       HIS   8  22.924  22.374   4.907
   61    HA   HIS   8           HA       HIS   8  24.548  20.994   5.938
   62   1HB   HIS   8          HB2       HIS   8  22.650  21.801   8.154
   63   2HB   HIS   8          HB1       HIS   8  24.154  20.936   8.473
   64    HD1  HIS   8           HD1      HIS   8  26.398  22.165   7.666
   65    HD2  HIS   8           HD2      HIS   8  22.970  24.536   7.690
   66    HE1  HIS   8           HE1      HIS   8  27.188  24.567   7.524
   67    H    HIS   9           HN       HIS   9  22.501  19.529   4.596
   68    HA   HIS   9           HA       HIS   9  22.245  17.145   6.401
   69   1HB   HIS   9          HB2       HIS   9  20.287  18.720   4.871
   70   2HB   HIS   9          HB1       HIS   9  20.171  16.985   4.579
   71    HD1  HIS   9           HD1      HIS   9  20.624  15.687   7.178
   72    HD2  HIS   9           HD2      HIS   9  18.565  19.304   6.940
   73    HE1  HIS   9           HE1      HIS   9  19.244  15.867   9.294
   74    H    ILE  10           HN       ILE  10  23.884  15.859   5.537
   75    HA   ILE  10           HA       ILE  10  23.643  15.184   2.629
   76    HB   ILE  10           HB       ILE  10  25.489  16.810   3.121
   77   1HG1  ILE  10          HG12      ILE  10  27.173  15.631   1.861
   78   2HG1  ILE  10          HG11      ILE  10  26.551  14.067   2.387
   79   1HG2  ILE  10          HG21      ILE  10  26.048  14.764   5.173
   80   2HG2  ILE  10          HG22      ILE  10  26.469  16.476   5.146
   81   3HG2  ILE  10          HG23      ILE  10  27.469  15.308   4.281
   82   1HD1  ILE  10          HD11      ILE  10  24.581  14.288   1.082
   83   2HD1  ILE  10          HD12      ILE  10  25.877  14.855   0.029
   84   3HD1  ILE  10          HD13      ILE  10  24.834  16.018   0.848
   85    H    GLU  11           HN       GLU  11  22.703  13.809   5.104
   86    HA   GLU  11           HA       GLU  11  24.524  11.474   5.330
   87   1HB   GLU  11          HB2       GLU  11  22.158  12.611   6.786
   88   2HB   GLU  11          HB1       GLU  11  22.560  10.909   7.012
   89   1HG   GLU  11          HG2       GLU  11  25.025  12.142   7.217
   90   2HG   GLU  11          HG1       GLU  11  23.947  13.299   8.000
   91    H    GLY  12           HN       GLY  12  23.980  10.913   2.976
   92   1HA   GLY  12          HA2       GLY  12  21.870   8.892   2.960
   93   2HA   GLY  12          HA1       GLY  12  21.540  10.255   1.890
   94    H    ARG  13           HN       ARG  13  22.480   7.264   1.576
   95    HA   ARG  13           HA       ARG  13  24.887   7.756  -0.118
   96   1HB   ARG  13          HB2       ARG  13  23.525   5.332   1.076
   97   2HB   ARG  13          HB1       ARG  13  24.827   5.181  -0.105
   98   1HG   ARG  13          HG2       ARG  13  26.253   6.621   1.383
   99   2HG   ARG  13          HG1       ARG  13  24.972   6.552   2.594
  100   1HD   ARG  13          HD2       ARG  13  25.953   3.961   1.445
  101   2HD   ARG  13          HD1       ARG  13  26.957   4.784   2.655
  102    HE   ARG  13           HE       ARG  13  24.110   4.626   3.355
  103   1HH1  ARG  13          HH21      ARG  13  27.110   4.382   4.646
  104   2HH1  ARG  13          HH22      ARG  13  26.834   2.941   5.566
  105   1HH2  ARG  13          HH11      ARG  13  23.795   2.237   4.052
  106   2HH2  ARG  13          HH12      ARG  13  24.960   1.725   5.227
  107    H    ALA  14           HN       ALA  14  21.671   6.187  -0.291
  108    HA   ALA  14           HA       ALA  14  21.849   5.780  -3.179
  109   1HB   ALA  14          HB1       ALA  14  19.179   5.665  -2.098
  110   2HB   ALA  14          HB2       ALA  14  20.300   4.917  -0.961
  111   3HB   ALA  14          HB3       ALA  14  20.208   4.332  -2.622
  112    HA   PRO  15           HA       PRO  15  20.363   9.759  -4.357
  113   1HB   PRO  15          HB2       PRO  15  19.442   9.130  -6.856
  114   2HB   PRO  15          HB1       PRO  15  21.169   9.269  -6.470
  115   1HG   PRO  15          HG2       PRO  15  19.486   6.833  -6.758
  116   2HG   PRO  15          HG1       PRO  15  21.160   7.114  -7.260
  117   1HD   PRO  15          HD2       PRO  15  20.469   5.721  -5.016
  118   2HD   PRO  15          HD1       PRO  15  22.003   6.602  -5.195
  119    H    THR  16           HN       THR  16  18.233   6.950  -4.955
  120    HA   THR  16           HA       THR  16  15.973   8.365  -3.708
  121    HB   THR  16           HB       THR  16  15.840   9.308  -5.905
  122    HG1  THR  16           HG1      THR  16  13.865   8.654  -6.395
  123   1HG2  THR  16          HG21      THR  16  16.029   7.987  -7.940
  124   2HG2  THR  16          HG22      THR  16  16.146   6.499  -7.001
  125   3HG2  THR  16          HG23      THR  16  17.445   7.691  -6.932
  126    H    GLU  17           HN       GLU  17  16.218   6.431  -2.324
  127    HA   GLU  17           HA       GLU  17  16.254   3.759  -2.926
  128   1HB   GLU  17          HB2       GLU  17  14.600   5.341  -0.951
  129   2HB   GLU  17          HB1       GLU  17  14.644   3.577  -0.924
  130   1HG   GLU  17          HG2       GLU  17  17.277   4.013  -1.023
  131   2HG   GLU  17          HG1       GLU  17  16.801   5.537  -0.273
  132    H    GLN  18           HN       GLN  18  14.994   2.385  -4.122
  133    HA   GLN  18           HA       GLN  18  12.889   3.128  -5.784
  134   1HB   GLN  18          HB2       GLN  18  13.951   0.630  -4.573
  135   2HB   GLN  18          HB1       GLN  18  12.345   0.519  -5.296
  136   1HG   GLN  18          HG2       GLN  18  13.210   1.435  -7.404
  137   2HG   GLN  18          HG1       GLN  18  14.813   1.603  -6.687
  138   1HE2  GLN  18          HE21      GLN  18  16.161  -0.245  -6.670
  139   2HE2  GLN  18          HE22      GLN  18  15.665  -1.780  -7.198
  140    H    SER  19           HN       SER  19  12.813   2.501  -2.355
  141    HA   SER  19           HA       SER  19  10.068   1.831  -1.990
  142   1HB   SER  19          HB2       SER  19  12.192   3.210  -0.350
  143   2HB   SER  19          HB1       SER  19  10.574   2.952   0.297
  144    HG   SER  19           HG       SER  19  11.611   1.134   0.839
  145    HA   PRO  20           HA       PRO  20   7.954   5.597  -2.762
  146   1HB   PRO  20          HB2       PRO  20   5.952   5.473  -0.901
  147   2HB   PRO  20          HB1       PRO  20   5.990   4.446  -2.348
  148   1HG   PRO  20          HG2       PRO  20   6.730   3.790   0.457
  149   2HG   PRO  20          HG1       PRO  20   5.910   2.796  -0.757
  150   1HD   PRO  20          HD2       PRO  20   8.553   2.533  -0.116
  151   2HD   PRO  20          HD1       PRO  20   7.872   2.095  -1.697
  152    H    GLY  21           HN       GLY  21   6.831   7.463  -1.232
  153   1HA   GLY  21          HA2       GLY  21   8.942   8.863   0.010
  154   2HA   GLY  21          HA1       GLY  21   7.233   9.203   0.290
  155    H    VAL  22           HN       VAL  22   6.187   8.208   2.088
  156    HA   VAL  22           HA       VAL  22   7.819   6.519   3.901
  157    HB   VAL  22           HB       VAL  22   8.444   8.809   4.465
  158   1HG1  VAL  22          HG11      VAL  22   5.516   9.375   4.965
  159   2HG1  VAL  22          HG12      VAL  22   6.300   9.755   3.431
  160   3HG1  VAL  22          HG13      VAL  22   6.851  10.527   4.918
  161   1HG2  VAL  22          HG21      VAL  22   6.552   8.502   6.667
  162   2HG2  VAL  22          HG22      VAL  22   8.310   8.359   6.678
  163   3HG2  VAL  22          HG23      VAL  22   7.315   6.970   6.241
  164    H    GLN  23           HN       GLN  23   6.374   4.880   4.304
  165    HA   GLN  23           HA       GLN  23   4.344   3.789   4.831
  166   1HB   GLN  23          HB2       GLN  23   4.587   6.296   6.369
  167   2HB   GLN  23          HB1       GLN  23   2.944   5.657   6.283
  168   1HG   GLN  23          HG2       GLN  23   3.478   3.736   7.442
  169   2HG   GLN  23          HG1       GLN  23   5.143   3.723   6.861
  170   1HE2  GLN  23          HE21      GLN  23   4.665   3.368   9.617
  171   2HE2  GLN  23          HE22      GLN  23   5.185   4.746  10.461
  172    H    ASP  24           HN       ASP  24   3.273   3.577   2.840
  173    HA   ASP  24           HA       ASP  24   2.098   5.630   1.279
  174   1HB   ASP  24          HB2       ASP  24   2.455   2.935   1.132
  175   2HB   ASP  24          HB1       ASP  24   0.716   3.016   1.418
  176    H    CYS  25           HN       CYS  25  -0.589   4.806   1.021
  177    HA   CYS  25           HA       CYS  25  -1.921   5.088   3.619
  178   1HB   CYS  25          HB2       CYS  25  -2.611   7.318   3.412
  179   2HB   CYS  25          HB1       CYS  25  -0.969   7.374   2.779
  180    H    TYR  26           HN       TYR  26  -4.394   5.792   3.020
  181    HA   TYR  26           HA       TYR  26  -5.340   4.577   0.507
  182   1HB   TYR  26          HB2       TYR  26  -6.547   2.784   1.635
  183   2HB   TYR  26          HB1       TYR  26  -4.845   2.689   2.083
  184    HD1  TYR  26           HD1      TYR  26  -4.168   2.854   4.344
  185    HD2  TYR  26           HD2      TYR  26  -8.156   3.984   3.219
  186    HE1  TYR  26           HE1      TYR  26  -4.786   3.051   6.737
  187    HE2  TYR  26           HE2      TYR  26  -8.775   4.181   5.612
  188    HH   TYR  26           HH       TYR  26  -7.481   2.880   7.956
  189    H    HIS  27           HN       HIS  27  -7.663   4.963   0.222
  190    HA   HIS  27           HA       HIS  27  -8.601   7.287   1.834
  191   1HB   HIS  27          HB2       HIS  27  -8.565   7.683  -0.510
  192   2HB   HIS  27          HB1       HIS  27  -9.237   6.093  -0.871
  193    HD1  HIS  27           HD1      HIS  27 -10.201   9.552   0.165
  194    HD2  HIS  27           HD2      HIS  27 -12.071   5.878  -0.455
  195    HE1  HIS  27           HE1      HIS  27 -12.691  10.013   0.127
  196    H    GLY  28           HN       GLY  28 -10.825   7.299   2.630
  197   1HA   GLY  28          HA2       GLY  28 -12.532   6.270   3.889
  198   2HA   GLY  28          HA1       GLY  28 -12.734   5.275   2.445
  199    H    ASP  29           HN       ASP  29 -12.514   3.129   2.814
  200    HA   ASP  29           HA       ASP  29 -10.714   2.276   5.043
  201   1HB   ASP  29          HB2       ASP  29 -13.442   1.447   4.133
  202   2HB   ASP  29          HB1       ASP  29 -12.408   0.228   4.879
  203    H    GLY  30           HN       GLY  30  -9.298   2.549   2.889
  204   1HA   GLY  30          HA2       GLY  30  -7.968   1.393   1.337
  205   2HA   GLY  30          HA1       GLY  30  -8.534  -0.102   2.092
  206    H    GLN  31           HN       GLN  31 -11.123   1.871   1.196
  207    HA   GLN  31           HA       GLN  31 -11.904   0.003  -0.935
  208   1HB   GLN  31          HB2       GLN  31 -13.113   2.446   0.384
  209   2HB   GLN  31          HB1       GLN  31 -13.935   1.554  -0.897
  210   1HG   GLN  31          HG2       GLN  31 -12.939   0.304   1.678
  211   2HG   GLN  31          HG1       GLN  31 -14.604   0.817   1.405
  212   1HE2  GLN  31          HE21      GLN  31 -15.781  -0.287  -0.432
  213   2HE2  GLN  31          HE22      GLN  31 -15.328  -1.864  -0.865
  214    H    SER  32           HN       SER  32 -11.817   0.419  -3.123
  215    HA   SER  32           HA       SER  32 -11.454   1.596  -5.142
  216   1HB   SER  32          HB2       SER  32 -12.544   3.579  -5.072
  217   2HB   SER  32          HB1       SER  32 -12.710   3.332  -3.337
  218    HG   SER  32           HG       SER  32 -10.989   4.599  -2.981
  219    H    TYR  33           HN       TYR  33  -9.315   1.268  -2.722
  220    HA   TYR  33           HA       TYR  33  -7.262   3.105  -2.866
  221   1HB   TYR  33          HB2       TYR  33  -7.350   0.942  -1.592
  222   2HB   TYR  33          HB1       TYR  33  -6.960   0.093  -3.087
  223    HD1  TYR  33           HD1      TYR  33  -5.417   3.284  -3.108
  224    HD2  TYR  33           HD2      TYR  33  -5.003  -0.664  -1.460
  225    HE1  TYR  33           HE1      TYR  33  -3.006   3.702  -2.711
  226    HE2  TYR  33           HE2      TYR  33  -2.591  -0.242  -1.065
  227    HH   TYR  33           HH       TYR  33  -0.961   2.492  -2.386
  228    H    ARG  34           HN       ARG  34  -7.099   4.139  -4.925
  229    HA   ARG  34           HA       ARG  34  -6.776   2.680  -7.408
  230   1HB   ARG  34          HB2       ARG  34  -7.389   5.226  -6.640
  231   2HB   ARG  34          HB1       ARG  34  -5.709   5.432  -7.135
  232   1HG   ARG  34          HG2       ARG  34  -6.269   4.270  -9.292
  233   2HG   ARG  34          HG1       ARG  34  -7.963   4.281  -8.801
  234   1HD   ARG  34          HD2       ARG  34  -8.188   6.429  -9.486
  235   2HD   ARG  34          HD1       ARG  34  -6.809   6.929  -8.487
  236    HE   ARG  34           HE       ARG  34  -6.085   5.462 -10.929
  237   1HH1  ARG  34          HH21      ARG  34  -5.383   8.077  -8.999
  238   2HH1  ARG  34          HH22      ARG  34  -4.992   9.166 -10.288
  239   1HH2  ARG  34          HH11      ARG  34  -6.125   7.044 -12.784
  240   2HH2  ARG  34          HH12      ARG  34  -5.411   8.582 -12.430
  241    H    GLY  35           HN       GLY  35  -4.932   1.660  -8.076
  242   1HA   GLY  35          HA2       GLY  35  -2.482   2.078  -8.581
  243   2HA   GLY  35          HA1       GLY  35  -2.336   2.562  -6.891
  244    H    SER  36           HN       SER  36  -0.748   0.506  -7.899
  245    HA   SER  36           HA       SER  36  -2.003  -1.992  -6.821
  246   1HB   SER  36          HB2       SER  36   0.582  -1.908  -8.331
  247   2HB   SER  36          HB1       SER  36  -0.689  -3.126  -8.368
  248    HG   SER  36           HG       SER  36  -0.479  -1.653 -10.245
  249    H    PHE  37           HN       PHE  37  -1.477  -0.895  -4.629
  250    HA   PHE  37           HA       PHE  37   1.377  -0.817  -3.907
  251   1HB   PHE  37          HB2       PHE  37  -0.464   0.764  -3.121
  252   2HB   PHE  37          HB1       PHE  37  -1.057  -0.570  -2.128
  253    HD1  PHE  37           HD1      PHE  37  -0.480  -0.152   0.104
  254    HD2  PHE  37           HD2      PHE  37   2.409   0.563  -2.993
  255    HE1  PHE  37           HE1      PHE  37   1.235   0.360   1.821
  256    HE2  PHE  37           HE2      PHE  37   4.123   1.076  -1.276
  257    HZ   PHE  37           HZ       PHE  37   3.537   0.976   1.129
  258    H    SER  38           HN       SER  38   1.075  -3.345  -4.685
  259    HA   SER  38           HA       SER  38   0.038  -5.199  -2.754
  260   1HB   SER  38          HB2       SER  38   1.901  -6.591  -4.088
  261   2HB   SER  38          HB1       SER  38   0.383  -6.110  -4.841
  262    HG   SER  38           HG       SER  38   2.951  -5.248  -5.300
  263    H    THR  39           HN       THR  39   1.508  -3.330  -1.201
  264    HA   THR  39           HA       THR  39   3.930  -4.902  -0.402
  265    HB   THR  39           HB       THR  39   3.541  -2.060   0.413
  266    HG1  THR  39           HG1      THR  39   4.643  -1.874  -1.902
  267   1HG2  THR  39          HG21      THR  39   5.839  -2.054   0.473
  268   2HG2  THR  39          HG22      THR  39   5.982  -3.122  -0.922
  269   3HG2  THR  39          HG23      THR  39   5.577  -3.788   0.659
  270    H    THR  40           HN       THR  40   3.768  -5.825   1.607
  271    HA   THR  40           HA       THR  40   1.397  -5.342   3.252
  272    HB   THR  40           HB       THR  40   2.557  -7.101   4.666
  273    HG1  THR  40           HG1      THR  40   4.564  -7.514   4.266
  274   1HG2  THR  40          HG21      THR  40   2.557  -8.823   2.720
  275   2HG2  THR  40          HG22      THR  40   2.044  -7.463   1.721
  276   3HG2  THR  40          HG23      THR  40   1.053  -7.978   3.086
  277    H    VAL  41           HN       VAL  41   1.412  -4.517   5.397
  278    HA   VAL  41           HA       VAL  41   2.890  -2.215   5.970
  279    HB   VAL  41           HB       VAL  41   1.519  -4.318   7.651
  280   1HG1  VAL  41          HG11      VAL  41   2.929  -3.504   9.304
  281   2HG1  VAL  41          HG12      VAL  41   1.626  -2.319   9.395
  282   3HG1  VAL  41          HG13      VAL  41   3.110  -1.934   8.523
  283   1HG2  VAL  41          HG21      VAL  41  -0.129  -2.467   7.925
  284   2HG2  VAL  41          HG22      VAL  41   0.104  -2.911   6.234
  285   3HG2  VAL  41          HG23      VAL  41   0.867  -1.456   6.877
  286    H    THR  42           HN       THR  42   3.808  -5.578   6.408
  287    HA   THR  42           HA       THR  42   6.061  -5.046   8.181
  288    HB   THR  42           HB       THR  42   5.218  -7.385   6.441
  289    HG1  THR  42           HG1      THR  42   5.155  -7.080   9.251
  290   1HG2  THR  42          HG21      THR  42   7.640  -6.903   8.056
  291   2HG2  THR  42          HG22      THR  42   7.367  -8.060   6.753
  292   3HG2  THR  42          HG23      THR  42   6.823  -8.430   8.390
  293    H    GLY  43           HN       GLY  43   5.527  -4.512   4.878
  294   1HA   GLY  43          HA2       GLY  43   7.107  -3.529   3.376
  295   2HA   GLY  43          HA1       GLY  43   8.408  -4.042   4.450
  296    H    ARG  44           HN       ARG  44   5.958  -6.349   3.586
  297    HA   ARG  44           HA       ARG  44   8.001  -7.844   1.996
  298   1HB   ARG  44          HB2       ARG  44   6.443  -8.533   4.146
  299   2HB   ARG  44          HB1       ARG  44   5.468  -9.134   2.805
  300   1HG   ARG  44          HG2       ARG  44   6.916 -10.816   2.376
  301   2HG   ARG  44          HG1       ARG  44   8.309  -9.737   2.469
  302   1HD   ARG  44          HD2       ARG  44   8.250 -11.557   4.253
  303   2HD   ARG  44          HD1       ARG  44   8.355  -9.905   4.894
  304    HE   ARG  44           HE       ARG  44   5.657 -11.106   4.521
  305   1HH1  ARG  44          HH21      ARG  44   7.993 -11.425   6.829
  306   2HH1  ARG  44          HH22      ARG  44   7.111 -10.674   8.116
  307   1HH2  ARG  44          HH11      ARG  44   4.591  -9.486   6.054
  308   2HH2  ARG  44          HH12      ARG  44   5.186  -9.577   7.677
  309    H    THR  45           HN       THR  45   6.452  -9.501   0.504
  310    HA   THR  45           HA       THR  45   4.953  -7.616  -1.283
  311    HB   THR  45           HB       THR  45   6.202 -10.290  -1.966
  312    HG1  THR  45           HG1      THR  45   8.052  -9.249  -2.372
  313   1HG2  THR  45          HG21      THR  45   5.238  -7.896  -3.535
  314   2HG2  THR  45          HG22      THR  45   4.693  -9.569  -3.661
  315   3HG2  THR  45          HG23      THR  45   6.298  -9.117  -4.238
  316    H    CYS  46           HN       CYS  46   2.761  -7.915  -1.143
  317    HA   CYS  46           HA       CYS  46   1.477 -10.088   0.133
  318   1HB   CYS  46          HB2       CYS  46   0.818  -7.720  -1.466
  319   2HB   CYS  46          HB1       CYS  46  -0.364  -9.020  -1.628
  320    H    GLN  47           HN       GLN  47   0.446 -11.944  -0.721
  321    HA   GLN  47           HA       GLN  47   1.557 -12.953  -3.261
  322   1HB   GLN  47          HB2       GLN  47   1.592 -14.423  -1.375
  323   2HB   GLN  47          HB1       GLN  47  -0.090 -14.083  -0.989
  324   1HG   GLN  47          HG2       GLN  47   0.051 -16.259  -2.075
  325   2HG   GLN  47          HG1       GLN  47  -0.748 -15.124  -3.164
  326   1HE2  GLN  47          HE21      GLN  47   2.401 -16.704  -2.524
  327   2HE2  GLN  47          HE22      GLN  47   2.995 -16.516  -4.103
  328    H    SER  48           HN       SER  48   0.173 -13.734  -4.992
  329    HA   SER  48           HA       SER  48  -1.987 -12.212  -5.858
  330   1HB   SER  48          HB2       SER  48  -0.802 -14.830  -6.372
  331   2HB   SER  48          HB1       SER  48  -2.537 -14.830  -6.671
  332    HG   SER  48           HG       SER  48  -1.519 -14.138  -8.526
  333    H    TRP  49           HN       TRP  49  -4.263 -12.301  -5.461
  334    HA   TRP  49           HA       TRP  49  -5.116 -13.262  -2.893
  335   1HB   TRP  49          HB2       TRP  49  -6.613 -12.519  -5.430
  336   2HB   TRP  49          HB1       TRP  49  -7.378 -12.737  -3.856
  337    HD1  TRP  49           HD1      TRP  49  -5.070 -10.378  -5.768
  338    HE1  TRP  49           HE1      TRP  49  -4.889  -8.178  -4.462
  339    HE3  TRP  49           HE3      TRP  49  -7.469 -11.665  -1.499
  340    HZ2  TRP  49           HZ2      TRP  49  -5.632  -7.096  -1.946
  341    HZ3  TRP  49           HZ3      TRP  49  -7.729 -10.048   0.363
  342    HH2  TRP  49           HH2      TRP  49  -6.809  -7.753   0.143
  343    H    SER  50           HN       SER  50  -5.326 -14.540  -6.182
  344    HA   SER  50           HA       SER  50  -6.773 -16.963  -5.437
  345   1HB   SER  50          HB2       SER  50  -6.802 -15.682  -7.629
  346   2HB   SER  50          HB1       SER  50  -5.181 -16.302  -7.928
  347    HG   SER  50           HG       SER  50  -7.498 -17.495  -8.374
  348    H    SER  51           HN       SER  51  -4.034 -16.407  -4.130
  349    HA   SER  51           HA       SER  51  -2.047 -18.159  -5.187
  350   1HB   SER  51          HB2       SER  51  -0.934 -17.539  -3.267
  351   2HB   SER  51          HB1       SER  51  -2.223 -16.344  -3.186
  352    HG   SER  51           HG       SER  51  -1.757 -18.581  -1.645
  353    H    MET  52           HN       MET  52  -1.849 -20.374  -5.060
  354    HA   MET  52           HA       MET  52  -3.801 -21.849  -3.314
  355   1HB   MET  52          HB2       MET  52  -2.830 -22.830  -5.996
  356   2HB   MET  52          HB1       MET  52  -4.292 -23.276  -5.128
  357   1HG   MET  52          HG2       MET  52  -4.434 -20.482  -5.559
  358   2HG   MET  52          HG1       MET  52  -3.949 -21.209  -7.087
  359   1HE   MET  52          HE1       MET  52  -6.620 -20.079  -4.997
  360   2HE   MET  52          HE2       MET  52  -6.249 -21.515  -4.044
  361   3HE   MET  52          HE3       MET  52  -7.820 -21.368  -4.828
  362    H    THR  53           HN       THR  53  -0.551 -21.292  -4.105
  363    HA   THR  53           HA       THR  53   0.415 -24.020  -3.561
  364    HB   THR  53           HB       THR  53   2.549 -22.220  -3.492
  365    HG1  THR  53           HG1      THR  53   2.091 -20.699  -4.998
  366   1HG2  THR  53          HG21      THR  53   3.153 -23.663  -5.099
  367   2HG2  THR  53          HG22      THR  53   1.968 -22.956  -6.197
  368   3HG2  THR  53          HG23      THR  53   1.505 -24.290  -5.141
  369    HA   PRO  54           HA       PRO  54   2.115 -22.005   0.394
  370   1HB   PRO  54          HB2       PRO  54   1.614 -19.356   0.865
  371   2HB   PRO  54          HB1       PRO  54   3.026 -19.925  -0.047
  372   1HG   PRO  54          HG2       PRO  54   0.462 -18.793  -1.042
  373   2HG   PRO  54          HG1       PRO  54   2.109 -18.558  -1.645
  374   1HD   PRO  54          HD2       PRO  54   0.296 -20.232  -2.816
  375   2HD   PRO  54          HD1       PRO  54   2.056 -20.459  -2.913
  376    H    HIS  55           HN       HIS  55  -0.277 -19.450   0.546
  377    HA   HIS  55           HA       HIS  55  -1.930 -21.176   2.350
  378   1HB   HIS  55          HB2       HIS  55  -2.488 -18.277   2.196
  379   2HB   HIS  55          HB1       HIS  55  -2.228 -19.291   3.612
  380    HD1  HIS  55           HD1      HIS  55  -0.307 -17.415   0.944
  381    HD2  HIS  55           HD2      HIS  55   0.379 -19.185   4.655
  382    HE1  HIS  55           HE1      HIS  55   2.052 -16.801   1.600
  383    H    TRP  56           HN       TRP  56  -3.052 -22.201   0.510
  384    HA   TRP  56           HA       TRP  56  -4.358 -20.931  -1.614
  385   1HB   TRP  56          HB2       TRP  56  -4.150 -23.387  -1.152
  386   2HB   TRP  56          HB1       TRP  56  -5.396 -23.220   0.084
  387    HD1  TRP  56           HD1      TRP  56  -7.547 -21.544  -1.205
  388    HE1  TRP  56           HE1      TRP  56  -8.851 -22.282  -3.266
  389    HE3  TRP  56           HE3      TRP  56  -4.269 -24.913  -3.100
  390    HZ2  TRP  56           HZ2      TRP  56  -8.554 -24.070  -5.458
  391    HZ3  TRP  56           HZ3      TRP  56  -4.798 -26.103  -5.199
  392    HH2  TRP  56           HH2      TRP  56  -6.930 -25.704  -6.382
  393    H    HIS  57           HN       HIS  57  -6.164 -19.620  -1.774
  394    HA   HIS  57           HA       HIS  57  -7.845 -19.295   0.681
  395   1HB   HIS  57          HB2       HIS  57  -7.312 -17.085   0.732
  396   2HB   HIS  57          HB1       HIS  57  -6.019 -17.483  -0.391
  397    HD1  HIS  57           HD1      HIS  57  -7.527 -17.884  -2.995
  398    HD2  HIS  57           HD2      HIS  57  -8.427 -14.794  -0.345
  399    HE1  HIS  57           HE1      HIS  57  -8.726 -16.108  -4.346
  400    H    GLN  58           HN       GLN  58  -9.990 -18.152   0.051
  401    HA   GLN  58           HA       GLN  58 -10.935 -19.187  -2.605
  402   1HB   GLN  58          HB2       GLN  58 -11.776 -19.654   0.152
  403   2HB   GLN  58          HB1       GLN  58 -13.109 -19.065  -0.842
  404   1HG   GLN  58          HG2       GLN  58 -11.468 -21.084  -2.198
  405   2HG   GLN  58          HG1       GLN  58 -12.242 -21.689  -0.733
  406   1HE2  GLN  58          HE21      GLN  58 -12.817 -20.635  -4.017
  407   2HE2  GLN  58          HE22      GLN  58 -14.496 -20.891  -4.015
  408    H    ARG  59           HN       ARG  59 -13.532 -18.027  -2.355
  409    HA   ARG  59           HA       ARG  59 -14.541 -15.986  -3.038
  410   1HB   ARG  59          HB2       ARG  59 -13.282 -15.845  -0.396
  411   2HB   ARG  59          HB1       ARG  59 -13.516 -14.253  -1.119
  412   1HG   ARG  59          HG2       ARG  59 -15.793 -14.395  -1.023
  413   2HG   ARG  59          HG1       ARG  59 -15.800 -16.122  -1.384
  414   1HD   ARG  59          HD2       ARG  59 -16.525 -15.985   0.886
  415   2HD   ARG  59          HD1       ARG  59 -14.806 -16.413   1.005
  416    HE   ARG  59           HE       ARG  59 -14.312 -14.135   1.627
  417   1HH1  ARG  59          HH21      ARG  59 -17.373 -14.166   0.169
  418   2HH1  ARG  59          HH22      ARG  59 -18.047 -12.939   1.187
  419   1HH2  ARG  59          HH11      ARG  59 -15.286 -12.782   3.279
  420   2HH2  ARG  59          HH12      ARG  59 -16.866 -12.155   2.948
  421    H    THR  60           HN       THR  60 -11.992 -16.550  -4.380
  422    HA   THR  60           HA       THR  60 -10.047 -14.587  -4.520
  423    HB   THR  60           HB       THR  60  -9.984 -16.433  -6.025
  424    HG1  THR  60           HG1      THR  60  -9.123 -14.836  -7.160
  425   1HG2  THR  60          HG21      THR  60 -12.171 -17.171  -6.293
  426   2HG2  THR  60          HG22      THR  60 -11.873 -16.441  -7.871
  427   3HG2  THR  60          HG23      THR  60 -12.775 -15.552  -6.644
  428    H    THR  61           HN       THR  61  -9.877 -12.825  -6.242
  429    HA   THR  61           HA       THR  61 -11.893 -10.815  -5.855
  430    HB   THR  61           HB       THR  61  -9.425 -10.575  -6.491
  431    HG1  THR  61           HG1      THR  61 -11.424  -9.302  -8.046
  432   1HG2  THR  61          HG21      THR  61 -10.341 -10.916  -9.325
  433   2HG2  THR  61          HG22      THR  61  -9.851 -12.334  -8.398
  434   3HG2  THR  61          HG23      THR  61  -8.710 -11.015  -8.661
  435    H    GLU  62           HN       GLU  62 -11.708 -13.609  -7.857
  436    HA   GLU  62           HA       GLU  62 -13.252 -12.711 -10.097
  437   1HB   GLU  62          HB2       GLU  62 -11.804 -14.842  -9.733
  438   2HB   GLU  62          HB1       GLU  62 -13.232 -15.499  -8.931
  439   1HG   GLU  62          HG2       GLU  62 -13.799 -16.167 -11.037
  440   2HG   GLU  62          HG1       GLU  62 -14.353 -14.501 -11.203
  441    H    TYR  63           HN       TYR  63 -13.921 -13.897  -6.885
  442    HA   TYR  63           HA       TYR  63 -16.780 -14.199  -7.247
  443   1HB   TYR  63          HB2       TYR  63 -14.726 -14.575  -5.238
  444   2HB   TYR  63          HB1       TYR  63 -16.121 -13.762  -4.530
  445    HD1  TYR  63           HD1      TYR  63 -16.194 -16.120  -7.402
  446    HD2  TYR  63           HD2      TYR  63 -17.034 -15.552  -3.228
  447    HE1  TYR  63           HE1      TYR  63 -17.425 -18.274  -7.356
  448    HE2  TYR  63           HE2      TYR  63 -18.265 -17.704  -3.183
  449    HH   TYR  63           HH       TYR  63 -18.707 -19.592  -4.323
  450    H    TYR  64           HN       TYR  64 -14.643 -11.555  -6.957
  451    HA   TYR  64           HA       TYR  64 -16.843  -9.749  -6.006
  452   1HB   TYR  64          HB2       TYR  64 -13.821  -9.654  -5.884
  453   2HB   TYR  64          HB1       TYR  64 -14.818  -8.239  -5.538
  454    HD1  TYR  64           HD1      TYR  64 -14.707 -11.891  -4.662
  455    HD2  TYR  64           HD2      TYR  64 -15.401  -7.872  -3.317
  456    HE1  TYR  64           HE1      TYR  64 -15.104 -12.730  -2.362
  457    HE2  TYR  64           HE2      TYR  64 -15.798  -8.710  -1.017
  458    HH   TYR  64           HH       TYR  64 -14.915 -11.718   0.021
  459    HA   PRO  65           HA       PRO  65 -16.810  -8.259 -10.158
  460   1HB   PRO  65          HB2       PRO  65 -18.350  -6.027  -9.745
  461   2HB   PRO  65          HB1       PRO  65 -19.026  -7.666  -9.825
  462   1HG   PRO  65          HG2       PRO  65 -18.404  -5.992  -7.442
  463   2HG   PRO  65          HG1       PRO  65 -19.777  -7.071  -7.737
  464   1HD   PRO  65          HD2       PRO  65 -17.646  -7.757  -6.186
  465   2HD   PRO  65          HD1       PRO  65 -18.618  -8.940  -7.089
  466    H    ASN  66           HN       ASN  66 -15.490  -6.730  -7.410
  467    HA   ASN  66           HA       ASN  66 -14.638  -4.205  -8.421
  468   1HB   ASN  66          HB2       ASN  66 -14.571  -5.168  -6.054
  469   2HB   ASN  66          HB1       ASN  66 -13.128  -6.051  -6.549
  470   1HD2  ASN  66          HD21      ASN  66 -12.869  -3.315  -8.354
  471   2HD2  ASN  66          HD22      ASN  66 -12.012  -2.326  -7.276
  472    H    GLY  67           HN       GLY  67 -13.170  -7.444  -8.614
  473   1HA   GLY  67          HA2       GLY  67 -11.294  -8.200  -9.820
  474   2HA   GLY  67          HA1       GLY  67 -11.979  -7.211 -11.109
  475    H    GLY  68           HN       GLY  68 -10.963  -5.667  -8.156
  476   1HA   GLY  68          HA2       GLY  68  -8.883  -4.219  -9.672
  477   2HA   GLY  68          HA1       GLY  68  -9.458  -3.808  -8.053
  478    H    LEU  69           HN       LEU  69  -9.126  -6.993  -7.813
  479    HA   LEU  69           HA       LEU  69  -6.600  -6.856  -6.366
  480   1HB   LEU  69          HB2       LEU  69  -8.498  -9.084  -7.143
  481   2HB   LEU  69          HB1       LEU  69  -7.175  -9.267  -5.999
  482    HG   LEU  69           HG       LEU  69  -9.620  -7.516  -5.735
  483   1HD1  LEU  69          HD11      LEU  69  -9.524  -8.790  -3.444
  484   2HD1  LEU  69          HD12      LEU  69  -8.468  -9.903  -4.313
  485   3HD1  LEU  69          HD13      LEU  69 -10.119  -9.638  -4.872
  486   1HD2  LEU  69          HD21      LEU  69  -7.863  -6.108  -4.983
  487   2HD2  LEU  69          HD22      LEU  69  -6.986  -7.455  -4.258
  488   3HD2  LEU  69          HD23      LEU  69  -8.476  -6.870  -3.516
  489    H    THR  70           HN       THR  70  -5.976  -6.157  -8.946
  490    HA   THR  70           HA       THR  70  -5.390  -8.100 -10.868
  491    HB   THR  70           HB       THR  70  -3.237  -6.149 -10.329
  492    HG1  THR  70           HG1      THR  70  -5.009  -4.544 -11.069
  493   1HG2  THR  70          HG21      THR  70  -3.565  -5.627 -12.636
  494   2HG2  THR  70          HG22      THR  70  -5.178  -6.339 -12.638
  495   3HG2  THR  70          HG23      THR  70  -3.757  -7.374 -12.500
  496    H    ARG  71           HN       ARG  71  -4.421 -10.056 -10.491
  497    HA   ARG  71           HA       ARG  71  -2.949 -11.666  -9.577
  498   1HB   ARG  71          HB2       ARG  71  -1.259  -9.206 -10.108
  499   2HB   ARG  71          HB1       ARG  71  -0.561 -10.779  -9.717
  500   1HG   ARG  71          HG2       ARG  71  -0.872 -11.512 -11.820
  501   2HG   ARG  71          HG1       ARG  71  -2.577 -11.061 -11.773
  502   1HD   ARG  71          HD2       ARG  71  -2.180  -8.942 -12.680
  503   2HD   ARG  71          HD1       ARG  71  -0.492  -8.916 -12.131
  504    HE   ARG  71           HE       ARG  71  -1.513 -10.521 -14.432
  505   1HH1  ARG  71          HH11      ARG  71   0.704  -8.218 -13.845
  506   2HH1  ARG  71          HH12      ARG  71   2.101  -9.113 -14.342
  507   1HH2  ARG  71          HH21      ARG  71   0.433 -12.149 -14.489
  508   2HH2  ARG  71          HH22      ARG  71   1.947 -11.337 -14.708
  509    H    ASN  72           HN       ASN  72  -0.555 -10.004  -8.046
  510    HA   ASN  72           HA       ASN  72  -1.697 -10.561  -5.375
  511   1HB   ASN  72          HB2       ASN  72   0.598 -10.431  -4.691
  512   2HB   ASN  72          HB1       ASN  72   0.606 -11.239  -6.260
  513   1HD2  ASN  72          HD21      ASN  72   0.867  -7.940  -4.862
  514   2HD2  ASN  72          HD22      ASN  72   1.954  -7.359  -6.030
  515    H    TYR  73           HN       TYR  73  -2.499  -8.159  -7.120
  516    HA   TYR  73           HA       TYR  73  -1.418  -5.732  -6.070
  517   1HB   TYR  73          HB2       TYR  73  -3.912  -6.665  -7.435
  518   2HB   TYR  73          HB1       TYR  73  -3.939  -5.058  -6.709
  519    HD1  TYR  73           HD1      TYR  73  -3.867  -3.642  -8.616
  520    HD2  TYR  73           HD2      TYR  73  -1.012  -6.824  -8.193
  521    HE1  TYR  73           HE1      TYR  73  -2.588  -2.750 -10.544
  522    HE2  TYR  73           HE2      TYR  73   0.267  -5.930 -10.122
  523    HH   TYR  73           HH       TYR  73  -0.765  -4.125 -12.334
  524    H    CYS  74           HN       CYS  74  -1.909  -4.552  -4.269
  525    HA   CYS  74           HA       CYS  74  -3.274  -5.868  -2.035
  526   1HB   CYS  74          HB2       CYS  74  -1.315  -4.679  -1.476
  527   2HB   CYS  74          HB1       CYS  74  -1.719  -3.333  -2.539
  528    H    ARG  75           HN       ARG  75  -5.298  -5.283  -1.231
  529    HA   ARG  75           HA       ARG  75  -6.667  -2.850  -2.168
  530   1HB   ARG  75          HB2       ARG  75  -6.780  -5.292  -3.588
  531   2HB   ARG  75          HB1       ARG  75  -8.342  -5.122  -2.787
  532   1HG   ARG  75          HG2       ARG  75  -8.675  -3.965  -4.800
  533   2HG   ARG  75          HG1       ARG  75  -8.242  -2.668  -3.686
  534   1HD   ARG  75          HD2       ARG  75  -6.192  -2.317  -4.682
  535   2HD   ARG  75          HD1       ARG  75  -5.997  -4.028  -5.112
  536    HE   ARG  75           HE       ARG  75  -8.125  -3.329  -6.660
  537   1HH1  ARG  75          HH21      ARG  75  -6.110  -0.811  -5.890
  538   2HH1  ARG  75          HH22      ARG  75  -5.561  -0.499  -7.503
  539   1HH2  ARG  75          HH11      ARG  75  -6.980  -3.372  -8.827
  540   2HH2  ARG  75          HH12      ARG  75  -6.054  -1.948  -9.166
  541    H    ASN  76           HN       ASN  76  -9.309  -4.060  -1.589
  542    HA   ASN  76           HA       ASN  76  -9.127  -5.053   1.182
  543   1HB   ASN  76          HB2       ASN  76  -8.859  -2.463   1.036
  544   2HB   ASN  76          HB1       ASN  76 -10.586  -2.463   0.672
  545   1HD2  ASN  76          HD21      ASN  76  -9.670  -1.278   3.078
  546   2HD2  ASN  76          HD22      ASN  76 -10.171  -2.231   4.391
  547    HA   PRO  77           HA       PRO  77 -12.812  -6.505  -1.137
  548   1HB   PRO  77          HB2       PRO  77 -12.649  -9.080  -0.222
  549   2HB   PRO  77          HB1       PRO  77 -11.749  -8.500  -1.638
  550   1HG   PRO  77          HG2       PRO  77 -10.813  -8.929   1.153
  551   2HG   PRO  77          HG1       PRO  77  -9.979  -9.235  -0.378
  552   1HD   PRO  77          HD2       PRO  77  -9.495  -7.058   1.198
  553   2HD   PRO  77          HD1       PRO  77  -9.248  -7.076  -0.562
  554    H    ASP  78           HN       ASP  78 -11.861  -6.241   2.131
  555    HA   ASP  78           HA       ASP  78 -14.621  -6.921   3.088
  556   1HB   ASP  78          HB2       ASP  78 -12.104  -7.780   3.893
  557   2HB   ASP  78          HB1       ASP  78 -12.502  -6.536   5.079
  558    H    ALA  79           HN       ALA  79 -12.218  -4.416   2.782
  559    HA   ALA  79           HA       ALA  79 -12.414  -2.087   3.144
  560   1HB   ALA  79          HB1       ALA  79 -14.533  -1.379   2.761
  561   2HB   ALA  79          HB2       ALA  79 -15.136  -2.175   4.215
  562   3HB   ALA  79          HB3       ALA  79 -14.977  -3.085   2.712
  563    H    GLU  80           HN       GLU  80 -11.238  -3.600   5.179
  564    HA   GLU  80           HA       GLU  80 -12.491  -2.963   7.765
  565   1HB   GLU  80          HB2       GLU  80  -9.637  -3.834   7.367
  566   2HB   GLU  80          HB1       GLU  80 -10.766  -4.296   8.638
  567   1HG   GLU  80          HG2       GLU  80 -12.006  -5.189   6.318
  568   2HG   GLU  80          HG1       GLU  80 -10.300  -5.533   6.034
  569    H    ILE  81           HN       ILE  81  -9.973  -2.300   9.083
  570    HA   ILE  81           HA       ILE  81 -10.014   0.511   9.096
  571    HB   ILE  81           HB       ILE  81  -7.656   0.169  10.028
  572   1HG1  ILE  81          HG12      ILE  81  -7.789  -2.634  10.381
  573   2HG1  ILE  81          HG11      ILE  81  -8.050  -2.342   8.662
  574   1HG2  ILE  81          HG21      ILE  81  -9.643  -1.769  11.208
  575   2HG2  ILE  81          HG22      ILE  81  -9.912  -0.028  11.285
  576   3HG2  ILE  81          HG23      ILE  81  -8.489  -0.735  12.049
  577   1HD1  ILE  81          HD11      ILE  81  -5.843  -1.987   8.418
  578   2HD1  ILE  81          HD12      ILE  81  -5.597  -2.170  10.154
  579   3HD1  ILE  81          HD13      ILE  81  -5.978  -0.586   9.480
  580    H    SER  82           HN       SER  82  -8.363  -1.715   6.947
  581    HA   SER  82           HA       SER  82  -7.860   0.373   4.976
  582   1HB   SER  82          HB2       SER  82  -5.282  -0.784   5.678
  583   2HB   SER  82          HB1       SER  82  -5.734   0.912   5.537
  584    HG   SER  82           HG       SER  82  -5.735   0.959   7.627
  585    HA   PRO  83           HA       PRO  83  -7.489  -3.110   2.331
  586   1HB   PRO  83          HB2       PRO  83  -5.418  -2.505   0.652
  587   2HB   PRO  83          HB1       PRO  83  -6.987  -1.678   0.586
  588   1HG   PRO  83          HG2       PRO  83  -4.416  -0.769   1.759
  589   2HG   PRO  83          HG1       PRO  83  -5.673   0.161   0.929
  590   1HD   PRO  83          HD2       PRO  83  -5.328   0.092   3.659
  591   2HD   PRO  83          HD1       PRO  83  -6.852   0.506   2.845
  592    H    TRP  84           HN       TRP  84  -6.272  -5.070   1.888
  593    HA   TRP  84           HA       TRP  84  -3.556  -5.355   3.016
  594   1HB   TRP  84          HB2       TRP  84  -4.329  -7.155   4.563
  595   2HB   TRP  84          HB1       TRP  84  -5.039  -5.591   4.958
  596    HD1  TRP  84           HD1      TRP  84  -7.612  -5.237   4.492
  597    HE1  TRP  84           HE1      TRP  84  -9.540  -6.889   4.046
  598    HE3  TRP  84           HE3      TRP  84  -4.933  -9.457   3.437
  599    HZ2  TRP  84           HZ2      TRP  84  -9.900  -9.636   3.336
  600    HZ3  TRP  84           HZ3      TRP  84  -6.094 -11.575   2.881
  601    HH2  TRP  84           HH2      TRP  84  -8.570 -11.670   2.829
  602    H    CYS  85           HN       CYS  85  -3.344  -8.107   3.004
  603    HA   CYS  85           HA       CYS  85  -4.653  -9.540   0.943
  604   1HB   CYS  85          HB2       CYS  85  -2.708  -9.202  -0.798
  605   2HB   CYS  85          HB1       CYS  85  -3.995  -8.004  -0.695
  606    H    TYR  86           HN       TYR  86  -3.663 -11.588   0.549
  607    HA   TYR  86           HA       TYR  86  -2.192 -12.784   2.607
  608   1HB   TYR  86          HB2       TYR  86  -2.397 -13.395  -0.354
  609   2HB   TYR  86          HB1       TYR  86  -1.747 -14.527   0.833
  610    HD1  TYR  86           HD1      TYR  86  -3.184 -15.563   2.516
  611    HD2  TYR  86           HD2      TYR  86  -4.776 -12.807  -0.368
  612    HE1  TYR  86           HE1      TYR  86  -5.484 -16.277   3.105
  613    HE2  TYR  86           HE2      TYR  86  -7.076 -13.521   0.221
  614    HH   TYR  86           HH       TYR  86  -7.645 -16.138   2.563
  615    H    THR  87           HN       THR  87   0.076 -13.838   2.220
  616    HA   THR  87           HA       THR  87   1.949 -11.710   1.228
  617    HB   THR  87           HB       THR  87   3.382 -13.353   2.889
  618    HG1  THR  87           HG1      THR  87   1.857 -14.572   3.707
  619   1HG2  THR  87          HG21      THR  87   3.355 -11.571   4.404
  620   2HG2  THR  87          HG22      THR  87   1.677 -11.165   4.042
  621   3HG2  THR  87          HG23      THR  87   2.947 -10.793   2.876
  622    H    MET  88           HN       MET  88   3.569 -12.330  -0.217
  623    HA   MET  88           HA       MET  88   3.312 -14.761  -1.732
  624   1HB   MET  88          HB2       MET  88   4.654 -12.292  -1.828
  625   2HB   MET  88          HB1       MET  88   5.926 -13.514  -1.845
  626   1HG   MET  88          HG2       MET  88   3.749 -14.336  -3.553
  627   2HG   MET  88          HG1       MET  88   4.293 -12.721  -4.008
  628   1HE   MET  88          HE1       MET  88   5.746 -15.842  -6.140
  629   2HE   MET  88          HE2       MET  88   5.167 -14.222  -6.520
  630   3HE   MET  88          HE3       MET  88   4.191 -15.284  -5.507
  631    H    ASP  89           HN       ASP  89   4.501 -14.367   1.397
  632    HA   ASP  89           HA       ASP  89   6.476 -16.580   1.082
  633   1HB   ASP  89          HB2       ASP  89   6.059 -14.522   3.276
  634   2HB   ASP  89          HB1       ASP  89   7.378 -15.690   3.201
  635    HA   PRO  90           HA       PRO  90   3.570 -19.145   3.171
  636   1HB   PRO  90          HB2       PRO  90   5.315 -21.111   3.951
  637   2HB   PRO  90          HB1       PRO  90   4.742 -20.931   2.281
  638   1HG   PRO  90          HG2       PRO  90   7.321 -20.068   3.497
  639   2HG   PRO  90          HG1       PRO  90   7.005 -20.777   1.905
  640   1HD   PRO  90          HD2       PRO  90   7.426 -18.114   2.290
  641   2HD   PRO  90          HD1       PRO  90   6.415 -18.758   0.977
  642    H    ASN  91           HN       ASN  91   5.970 -17.324   4.629
  643    HA   ASN  91           HA       ASN  91   5.642 -18.395   7.360
  644   1HB   ASN  91          HB2       ASN  91   7.586 -17.010   5.935
  645   2HB   ASN  91          HB1       ASN  91   6.902 -15.770   6.987
  646   1HD2  ASN  91          HD21      ASN  91   8.471 -18.980   7.017
  647   2HD2  ASN  91          HD22      ASN  91   8.970 -18.902   8.637
  648    H    VAL  92           HN       VAL  92   4.067 -16.191   5.264
  649    HA   VAL  92           HA       VAL  92   2.626 -14.953   7.588
  650    HB   VAL  92           HB       VAL  92   3.381 -13.770   4.888
  651   1HG1  VAL  92          HG11      VAL  92   2.738 -11.625   6.238
  652   2HG1  VAL  92          HG12      VAL  92   1.864 -12.742   7.287
  653   3HG1  VAL  92          HG13      VAL  92   1.440 -12.621   5.581
  654   1HG2  VAL  92          HG21      VAL  92   5.387 -13.382   5.843
  655   2HG2  VAL  92          HG22      VAL  92   4.838 -14.047   7.381
  656   3HG2  VAL  92          HG23      VAL  92   4.570 -12.344   7.012
  657    H    ARG  93           HN       ARG  93   0.377 -15.173   7.442
  658    HA   ARG  93           HA       ARG  93  -0.697 -16.571   5.105
  659   1HB   ARG  93          HB2       ARG  93  -2.725 -16.729   6.551
  660   2HB   ARG  93          HB1       ARG  93  -1.278 -17.327   7.361
  661   1HG   ARG  93          HG2       ARG  93  -1.080 -15.365   8.686
  662   2HG   ARG  93          HG1       ARG  93  -2.219 -14.475   7.678
  663   1HD   ARG  93          HD2       ARG  93  -3.548 -15.073   9.529
  664   2HD   ARG  93          HD1       ARG  93  -3.904 -16.374   8.375
  665    HE   ARG  93           HE       ARG  93  -1.726 -16.680  10.404
  666   1HH1  ARG  93          HH11      ARG  93  -4.962 -17.391   9.876
  667   2HH1  ARG  93          HH12      ARG  93  -4.810 -19.099  10.124
  668   1HH2  ARG  93          HH21      ARG  93  -1.344 -19.040  10.246
  669   2HH2  ARG  93          HH22      ARG  93  -2.760 -20.032  10.333
  670    H    TRP  94           HN       TRP  94  -0.979 -13.469   6.765
  671    HA   TRP  94           HA       TRP  94  -1.922 -12.168   4.320
  672   1HB   TRP  94          HB2       TRP  94  -4.125 -11.696   5.045
  673   2HB   TRP  94          HB1       TRP  94  -3.889 -13.373   5.531
  674    HD1  TRP  94           HD1      TRP  94  -3.964 -13.926   8.056
  675    HE1  TRP  94           HE1      TRP  94  -4.366 -12.538  10.189
  676    HE3  TRP  94           HE3      TRP  94  -3.700  -9.223   6.098
  677    HZ2  TRP  94           HZ2      TRP  94  -4.554  -9.784  10.961
  678    HZ3  TRP  94           HZ3      TRP  94  -3.994  -7.236   7.548
  679    HH2  TRP  94           HH2      TRP  94  -4.421  -7.510   9.976
  680    H    GLU  95           HN       GLU  95  -1.858  -9.814   4.564
  681    HA   GLU  95           HA       GLU  95  -1.019  -8.718   7.178
  682   1HB   GLU  95          HB2       GLU  95   0.850  -9.714   5.330
  683   2HB   GLU  95          HB1       GLU  95   0.911  -7.961   5.143
  684   1HG   GLU  95          HG2       GLU  95   0.999  -9.309   7.849
  685   2HG   GLU  95          HG1       GLU  95   2.455  -8.937   6.925
  686    H    TYR  96           HN       TYR  96  -1.369  -6.473   7.280
  687    HA   TYR  96           HA       TYR  96  -3.106  -5.306   5.281
  688   1HB   TYR  96          HB2       TYR  96  -1.781  -4.542   7.847
  689   2HB   TYR  96          HB1       TYR  96  -2.351  -3.227   6.819
  690    HD1  TYR  96           HD1      TYR  96  -4.783  -3.525   5.840
  691    HD2  TYR  96           HD2      TYR  96  -3.288  -5.569   9.310
  692    HE1  TYR  96           HE1      TYR  96  -7.108  -3.940   6.597
  693    HE2  TYR  96           HE2      TYR  96  -5.613  -5.984  10.067
  694    HH   TYR  96           HH       TYR  96  -8.350  -5.352   8.022
  695    H    CYS  97           HN       CYS  97  -2.508  -3.148   4.228
  696    HA   CYS  97           HA       CYS  97   0.178  -3.423   2.994
  697   1HB   CYS  97          HB2       CYS  97  -2.332  -1.848   2.377
  698   2HB   CYS  97          HB1       CYS  97  -0.855  -1.722   1.419
  699    H    ASN  98           HN       ASN  98   1.667  -1.696   2.960
  700    HA   ASN  98           HA       ASN  98   1.950  -0.103   5.298
  701   1HB   ASN  98          HB2       ASN  98   3.086  -0.161   2.522
  702   2HB   ASN  98          HB1       ASN  98   3.526   1.164   3.601
  703   1HD2  ASN  98          HD21      ASN  98   4.794  -1.650   2.595
  704   2HD2  ASN  98          HD22      ASN  98   5.550  -2.190   4.016
  705    H    LEU  99           HN       LEU  99  -0.467   0.791   5.169
  706    HA   LEU  99           HA       LEU  99  -0.225   3.528   4.101
  707   1HB   LEU  99          HB2       LEU  99  -2.680   2.928   3.082
  708   2HB   LEU  99          HB1       LEU  99  -1.192   2.863   2.146
  709    HG   LEU  99           HG       LEU  99  -0.990   0.426   2.851
  710   1HD1  LEU  99          HD11      LEU  99  -3.274  -0.567   3.485
  711   2HD1  LEU  99          HD12      LEU  99  -3.746   1.081   3.903
  712   3HD1  LEU  99          HD13      LEU  99  -2.411   0.303   4.753
  713   1HD2  LEU  99          HD21      LEU  99  -3.448   1.246   1.271
  714   2HD2  LEU  99          HD22      LEU  99  -2.659  -0.330   1.193
  715   3HD2  LEU  99          HD23      LEU  99  -1.813   1.109   0.625
  716    H    THR 100           HN       THR 100  -1.318   4.960   5.324
  717    HA   THR 100           HA       THR 100  -3.121   3.918   7.469
  718    HB   THR 100           HB       THR 100  -2.483   6.099   8.551
  719    HG1  THR 100           HG1      THR 100  -1.501   7.520   7.384
  720   1HG2  THR 100          HG21      THR 100  -1.070   4.530   9.418
  721   2HG2  THR 100          HG22      THR 100   0.137   5.398   8.468
  722   3HG2  THR 100          HG23      THR 100  -0.600   3.929   7.828
  723    H    GLN 101           HN       GLN 101  -5.030   5.342   7.943
  724    HA   GLN 101           HA       GLN 101  -6.679   5.899   5.769
  725   1HB   GLN 101          HB2       GLN 101  -6.820   6.079   8.483
  726   2HB   GLN 101          HB1       GLN 101  -6.823   7.790   8.055
  727   1HG   GLN 101          HG2       GLN 101  -8.642   7.177   6.336
  728   2HG   GLN 101          HG1       GLN 101  -8.778   5.649   7.209
  729   1HE2  GLN 101          HE21      GLN 101  -9.971   5.656   9.154
  730   2HE2  GLN 101          HE22      GLN 101 -10.597   7.057   9.878
  731    H    CYS 102           HN       CYS 102  -5.704   6.999   4.031
  732    HA   CYS 102           HA       CYS 102  -3.968   9.213   4.137
  733   1HB   CYS 102          HB2       CYS 102  -5.190   7.651   2.233
  734   2HB   CYS 102          HB1       CYS 102  -5.957   9.215   1.959
  735    HA   PRO 103           HA       PRO 103  -7.779  12.074   4.028
  736   1HB   PRO 103          HB2       PRO 103 -10.250  10.976   4.424
  737   2HB   PRO 103          HB1       PRO 103  -9.503  11.113   2.820
  738   1HG   PRO 103          HG2       PRO 103  -9.789   8.746   4.575
  739   2HG   PRO 103          HG1       PRO 103  -9.786   8.853   2.810
  740   1HD   PRO 103          HD2       PRO 103  -7.654   8.018   4.376
  741   2HD   PRO 103          HD1       PRO 103  -7.541   8.567   2.691
  742    H    VAL 104           HN       VAL 104  -7.183  12.926   6.038
  743    HA   VAL 104           HA       VAL 104  -7.866  11.474   8.523
  744    HB   VAL 104           HB       VAL 104  -6.407  14.056   7.888
  745   1HG1  VAL 104          HG11      VAL 104  -6.326  14.534  10.094
  746   2HG1  VAL 104          HG12      VAL 104  -5.916  12.868  10.504
  747   3HG1  VAL 104          HG13      VAL 104  -7.604  13.338  10.308
  748   1HG2  VAL 104          HG21      VAL 104  -5.180  11.587   9.073
  749   2HG2  VAL 104          HG22      VAL 104  -4.437  12.824   8.061
  750   3HG2  VAL 104          HG23      VAL 104  -5.509  11.624   7.341
  751    H    THR 105           HN       THR 105  -8.092  14.975   7.937
  752    HA   THR 105           HA       THR 105 -10.809  14.920   9.183
  753    HB   THR 105           HB       THR 105  -8.875  17.218   8.751
  754    HG1  THR 105           HG1      THR 105  -8.886  16.597  11.244
  755   1HG2  THR 105          HG21      THR 105 -10.947  18.181   9.221
  756   2HG2  THR 105          HG22      THR 105 -10.263  18.001  10.837
  757   3HG2  THR 105          HG23      THR 105 -11.451  16.838  10.247
  758    H    GLU 106           HN       GLU 106 -12.181  16.897   8.319
  759    HA   GLU 106           HA       GLU 106 -13.389  17.798   6.500
  760   1HB   GLU 106          HB2       GLU 106 -10.519  17.700   5.564
  761   2HB   GLU 106          HB1       GLU 106 -11.790  18.361   4.535
  762   1HG   GLU 106          HG2       GLU 106 -11.505  19.293   7.383
  763   2HG   GLU 106          HG1       GLU 106 -10.497  19.986   6.112
  764    H    SER 107           HN       SER 107 -14.275  17.197   4.374
  765    HA   SER 107           HA       SER 107 -13.589  14.402   3.530
  766   1HB   SER 107          HB2       SER 107 -15.802  13.792   3.753
  767   2HB   SER 107          HB1       SER 107 -15.771  15.071   4.964
  768    HG   SER 107           HG       SER 107 -16.291  16.465   3.035
  769    H    SER 108           HN       SER 108 -15.080  14.103   1.330
  770    HA   SER 108           HA       SER 108 -15.323  14.741  -0.934
  771   1HB   SER 108          HB2       SER 108 -15.870  17.002   0.744
  772   2HB   SER 108          HB1       SER 108 -15.015  17.569  -0.688
  773    HG   SER 108           HG       SER 108 -16.672  17.027  -1.888
  774    H    VAL 109           HN       VAL 109 -12.696  14.094   0.055
  775    HA   VAL 109           HA       VAL 109 -10.749  16.064  -0.819
  776    HB   VAL 109           HB       VAL 109  -9.199  14.153  -0.458
  777   1HG1  VAL 109          HG11      VAL 109 -11.151  15.169   1.452
  778   2HG1  VAL 109          HG12      VAL 109  -9.428  14.865   1.672
  779   3HG1  VAL 109          HG13      VAL 109 -10.590  13.556   1.893
  780   1HG2  VAL 109          HG21      VAL 109 -11.634  12.678  -0.976
  781   2HG2  VAL 109          HG22      VAL 109 -10.954  12.199   0.579
  782   3HG2  VAL 109          HG23      VAL 109  -9.978  12.080  -0.885
  783    H    LEU 110           HN       LEU 110 -10.693  16.601  -2.984
  784    HA   LEU 110           HA       LEU 110 -10.890  14.371  -4.984
  785   1HB   LEU 110          HB2       LEU 110 -11.881  17.170  -4.803
  786   2HB   LEU 110          HB1       LEU 110 -11.340  16.640  -6.396
  787    HG   LEU 110           HG       LEU 110 -12.970  14.621  -5.054
  788   1HD1  LEU 110          HD11      LEU 110 -13.835  17.072  -4.370
  789   2HD1  LEU 110          HD12      LEU 110 -14.947  15.749  -4.723
  790   3HD1  LEU 110          HD13      LEU 110 -14.587  16.954  -5.960
  791   1HD2  LEU 110          HD21      LEU 110 -13.752  14.293  -7.206
  792   2HD2  LEU 110          HD22      LEU 110 -12.235  15.110  -7.579
  793   3HD2  LEU 110          HD23      LEU 110 -13.748  16.016  -7.582
  794    H    ALA 111           HN       ALA 111  -9.140  17.330  -4.074
  795    HA   ALA 111           HA       ALA 111  -6.928  16.483  -5.920
  796   1HB   ALA 111          HB1       ALA 111  -6.589  19.145  -5.725
  797   2HB   ALA 111          HB2       ALA 111  -8.324  19.071  -5.415
  798   3HB   ALA 111          HB3       ALA 111  -7.669  18.427  -6.920
  799    H    THR 112           HN       THR 112  -5.550  15.530  -4.387
  800    HA   THR 112           HA       THR 112  -5.117  16.707  -1.746
  801    HB   THR 112           HB       THR 112  -3.597  14.572  -3.280
  802    HG1  THR 112           HG1      THR 112  -5.525  14.037  -1.331
  803   1HG2  THR 112          HG21      THR 112  -2.722  13.889  -1.198
  804   2HG2  THR 112          HG22      THR 112  -3.915  14.819  -0.292
  805   3HG2  THR 112          HG23      THR 112  -2.613  15.648  -1.144
  806    H    SER 113           HN       SER 113  -3.870  18.521  -1.514
  807    HA   SER 113           HA       SER 113  -2.057  19.489  -3.544
  808   1HB   SER 113          HB2       SER 113  -1.794  21.284  -2.041
  809   2HB   SER 113          HB1       SER 113  -3.392  20.669  -1.631
  810    HG   SER 113           HG       SER 113  -2.036  20.980   0.209
  811    H    THR 114           HN       THR 114   0.222  20.236  -2.108
  812    HA   THR 114           HA       THR 114   1.455  17.594  -1.390
  813    HB   THR 114           HB       THR 114   3.373  19.455  -2.423
  814    HG1  THR 114           HG1      THR 114   1.482  18.955  -4.394
  815   1HG2  THR 114          HG21      THR 114   4.030  17.606  -3.576
  816   2HG2  THR 114          HG22      THR 114   2.399  17.269  -4.155
  817   3HG2  THR 114          HG23      THR 114   2.876  16.779  -2.530
  818    H    ALA 115           HN       ALA 115   3.905  18.481  -0.517
  819    HA   ALA 115           HA       ALA 115   3.227  19.727   2.052
  820   1HB   ALA 115          HB1       ALA 115   5.758  19.352   2.338
  821   2HB   ALA 115          HB2       ALA 115   5.711  18.609   0.739
  822   3HB   ALA 115          HB3       ALA 115   4.775  17.914   2.063
  823    H    VAL 116           HN       VAL 116   3.713  21.830   2.657
  824    HA   VAL 116           HA       VAL 116   5.434  23.496   0.888
  825    HB   VAL 116           HB       VAL 116   2.565  24.106   1.675
  826   1HG1  VAL 116          HG11      VAL 116   2.968  26.050   0.051
  827   2HG1  VAL 116          HG12      VAL 116   4.687  25.697   0.225
  828   3HG1  VAL 116          HG13      VAL 116   3.738  26.178   1.632
  829   1HG2  VAL 116          HG21      VAL 116   3.845  23.497  -1.009
  830   2HG2  VAL 116          HG22      VAL 116   2.165  23.981  -0.773
  831   3HG2  VAL 116          HG23      VAL 116   2.739  22.443  -0.128
  832    H    SER 117           HN       SER 117   6.847  24.504   2.265
  833    HA   SER 117           HA       SER 117   5.956  25.048   5.072
  834   1HB   SER 117          HB2       SER 117   8.677  25.339   5.011
  835   2HB   SER 117          HB1       SER 117   7.859  23.815   5.344
  836    HG   SER 117           HG       SER 117   9.002  23.227   3.652
  837    H    GLU 118           HN       GLU 118   5.481  27.171   5.467
  838    HA   GLU 118           HA       GLU 118   5.974  29.315   3.643
  839   1HB   GLU 118          HB2       GLU 118   4.206  29.494   5.224
  840   2HB   GLU 118          HB1       GLU 118   5.266  29.088   6.574
  841   1HG   GLU 118          HG2       GLU 118   6.406  31.198   6.423
  842   2HG   GLU 118          HG1       GLU 118   5.615  31.581   4.893
  843    H    GLN 119           HN       GLN 119   7.509  28.698   6.830
  844    HA   GLN 119           HA       GLN 119   9.846  30.336   5.923
  845   1HB   GLN 119          HB2       GLN 119   8.224  30.362   8.204
  846   2HB   GLN 119          HB1       GLN 119   9.718  29.594   8.743
  847   1HG   GLN 119          HG2       GLN 119  10.661  31.673   7.201
  848   2HG   GLN 119          HG1       GLN 119   9.230  32.383   7.952
  849   1HE2  GLN 119          HE21      GLN 119  10.876  33.727   9.199
  850   2HE2  GLN 119          HE22      GLN 119  11.581  33.049  10.587
  Start of MODEL   10
    1   1H    ALA   1          HT1       ALA   1  37.622   8.564   9.260
    2   2H    ALA   1          HT2       ALA   1  38.974   9.439   8.719
    3   3H    ALA   1          HT3       ALA   1  39.185   7.971   9.548
    4    HA   ALA   1           HA       ALA   1  38.085   8.356   6.814
    5   1HB   ALA   1          HB1       ALA   1  40.185   7.749   6.198
    6   2HB   ALA   1          HB2       ALA   1  40.232   6.441   7.380
    7   3HB   ALA   1          HB3       ALA   1  40.642   8.086   7.867
    8    H    ARG   2           HN       ARG   2  38.991   5.825   9.199
    9    HA   ARG   2           HA       ARG   2  36.574   4.284   8.322
   10   1HB   ARG   2          HB2       ARG   2  39.355   3.720   7.934
   11   2HB   ARG   2          HB1       ARG   2  38.704   2.527   9.060
   12   1HG   ARG   2          HG2       ARG   2  36.701   2.488   7.307
   13   2HG   ARG   2          HG1       ARG   2  37.965   3.045   6.209
   14   1HD   ARG   2          HD2       ARG   2  38.073   0.534   7.922
   15   2HD   ARG   2          HD1       ARG   2  37.903   0.598   6.156
   16    HE   ARG   2           HE       ARG   2  40.269   1.859   7.476
   17   1HH1  ARG   2          HH21      ARG   2  39.881  -1.207   6.663
   18   2HH1  ARG   2          HH22      ARG   2  40.886  -1.228   5.253
   19   1HH2  ARG   2          HH11      ARG   2  41.114   2.225   5.043
   20   2HH2  ARG   2          HH12      ARG   2  41.585   0.716   4.335
   21    H    ILE   3           HN       ILE   3  35.837   5.429  10.418
   22    HA   ILE   3           HA       ILE   3  36.678   3.799  12.794
   23    HB   ILE   3           HB       ILE   3  35.856   6.713  12.570
   24   1HG1  ILE   3          HG12      ILE   3  38.405   6.281  13.794
   25   2HG1  ILE   3          HG11      ILE   3  38.366   5.369  12.286
   26   1HG2  ILE   3          HG21      ILE   3  35.633   6.790  14.825
   27   2HG2  ILE   3          HG22      ILE   3  37.034   5.751  15.083
   28   3HG2  ILE   3          HG23      ILE   3  35.461   5.037  14.729
   29   1HD1  ILE   3          HD11      ILE   3  37.509   8.266  12.477
   30   2HD1  ILE   3          HD12      ILE   3  37.809   7.327  11.015
   31   3HD1  ILE   3          HD13      ILE   3  39.152   7.775  12.066
   32    H    HIS   4           HN       HIS   4  34.055   5.365  11.025
   33    HA   HIS   4           HA       HIS   4  32.069   3.479  11.830
   34   1HB   HIS   4          HB2       HIS   4  32.814   5.371  13.806
   35   2HB   HIS   4          HB1       HIS   4  31.219   5.857  13.230
   36    HD1  HIS   4           HD1      HIS   4  33.009   3.107  15.031
   37    HD2  HIS   4           HD2      HIS   4  29.145   3.943  13.709
   38    HE1  HIS   4           HE1      HIS   4  31.493   1.400  16.126
   39    H    HIS   5           HN       HIS   5  32.655   6.902  11.035
   40    HA   HIS   5           HA       HIS   5  30.102   7.155   9.598
   41   1HB   HIS   5          HB2       HIS   5  32.169   8.810  10.719
   42   2HB   HIS   5          HB1       HIS   5  31.935   9.264   9.031
   43    HD1  HIS   5           HD1      HIS   5  30.230   9.246  12.357
   44    HD2  HIS   5           HD2      HIS   5  29.315  10.264   8.419
   45    HE1  HIS   5           HE1      HIS   5  28.070  10.566  12.442
   46    H    HIS   6           HN       HIS   6  30.499   8.320   7.282
   47    HA   HIS   6           HA       HIS   6  32.693   7.058   5.749
   48   1HB   HIS   6          HB2       HIS   6  30.095   5.905   6.050
   49   2HB   HIS   6          HB1       HIS   6  30.243   6.469   4.386
   50    HD1  HIS   6           HD1      HIS   6  30.273   3.732   3.988
   51    HD2  HIS   6           HD2      HIS   6  33.679   5.441   5.679
   52    HE1  HIS   6           HE1      HIS   6  32.141   2.048   3.694
   53    H    HIS   7           HN       HIS   7  33.107   9.427   5.499
   54    HA   HIS   7           HA       HIS   7  31.196  10.779   3.626
   55   1HB   HIS   7          HB2       HIS   7  32.427  11.532   6.033
   56   2HB   HIS   7          HB1       HIS   7  33.318  12.403   4.785
   57    HD1  HIS   7           HD1      HIS   7  30.841  13.266   6.926
   58    HD2  HIS   7           HD2      HIS   7  30.861  13.174   2.758
   59    HE1  HIS   7           HE1      HIS   7  29.000  14.830   6.166
   60    H    HIS   8           HN       HIS   8  32.408   9.235   1.992
   61    HA   HIS   8           HA       HIS   8  34.721  10.776   0.892
   62   1HB   HIS   8          HB2       HIS   8  35.067   8.519   2.330
   63   2HB   HIS   8          HB1       HIS   8  34.788   7.803   0.742
   64    HD1  HIS   8           HD1      HIS   8  36.115  10.320  -0.789
   65    HD2  HIS   8           HD2      HIS   8  37.881   8.024   2.210
   66    HE1  HIS   8           HE1      HIS   8  38.618  10.598  -1.054
   67    H    HIS   9           HN       HIS   9  35.091   8.630  -1.129
   68    HA   HIS   9           HA       HIS   9  33.407   9.603  -3.206
   69   1HB   HIS   9          HB2       HIS   9  34.346   7.666  -4.433
   70   2HB   HIS   9          HB1       HIS   9  35.592   8.482  -3.486
   71    HD1  HIS   9           HD1      HIS   9  33.638   5.302  -3.699
   72    HD2  HIS   9           HD2      HIS   9  36.480   7.019  -1.179
   73    HE1  HIS   9           HE1      HIS   9  34.456   3.451  -2.177
   74    H    ILE  10           HN       ILE  10  31.767   8.317  -4.415
   75    HA   ILE  10           HA       ILE  10  30.347   6.246  -2.811
   76    HB   ILE  10           HB       ILE  10  29.554   8.691  -2.433
   77   1HG1  ILE  10          HG12      ILE  10  27.148   7.938  -2.496
   78   2HG1  ILE  10          HG11      ILE  10  27.683   6.483  -3.336
   79   1HG2  ILE  10          HG21      ILE  10  29.569   8.844  -5.133
   80   2HG2  ILE  10          HG22      ILE  10  28.506   9.828  -4.127
   81   3HG2  ILE  10          HG23      ILE  10  27.894   8.355  -4.877
   82   1HD1  ILE  10          HD11      ILE  10  27.447   6.468  -0.710
   83   2HD1  ILE  10          HD12      ILE  10  29.021   7.259  -0.765
   84   3HD1  ILE  10          HD13      ILE  10  28.815   5.658  -1.474
   85    H    GLU  11           HN       GLU  11  29.347   4.700  -4.137
   86    HA   GLU  11           HA       GLU  11  29.684   5.101  -7.089
   87   1HB   GLU  11          HB2       GLU  11  29.881   2.666  -7.152
   88   2HB   GLU  11          HB1       GLU  11  30.976   3.299  -5.922
   89   1HG   GLU  11          HG2       GLU  11  28.712   2.951  -4.445
   90   2HG   GLU  11          HG1       GLU  11  28.550   1.635  -5.609
   91    H    GLY  12           HN       GLY  12  27.887   4.880  -8.409
   92   1HA   GLY  12          HA2       GLY  12  25.662   4.441  -9.043
   93   2HA   GLY  12          HA1       GLY  12  25.475   3.509  -7.558
   94    H    ARG  13           HN       ARG  13  23.424   5.181  -8.411
   95    HA   ARG  13           HA       ARG  13  23.607   7.757  -6.997
   96   1HB   ARG  13          HB2       ARG  13  21.395   8.076  -7.949
   97   2HB   ARG  13          HB1       ARG  13  22.406   7.319  -9.180
   98   1HG   ARG  13          HG2       ARG  13  21.506   5.075  -8.258
   99   2HG   ARG  13          HG1       ARG  13  20.263   6.053  -7.477
  100   1HD   ARG  13          HD2       ARG  13  19.209   5.611  -9.509
  101   2HD   ARG  13          HD1       ARG  13  20.073   7.100  -9.939
  102    HE   ARG  13           HE       ARG  13  21.777   5.754 -11.029
  103   1HH1  ARG  13          HH21      ARG  13  21.291   3.377  -9.100
  104   2HH1  ARG  13          HH22      ARG  13  20.695   2.194 -10.215
  105   1HH2  ARG  13          HH11      ARG  13  20.083   4.493 -12.736
  106   2HH2  ARG  13          HH12      ARG  13  20.011   2.825 -12.274
  107    H    ALA  14           HN       ALA  14  20.952   7.844  -5.970
  108    HA   ALA  14           HA       ALA  14  21.339   6.489  -3.409
  109   1HB   ALA  14          HB1       ALA  14  20.328   8.544  -3.130
  110   2HB   ALA  14          HB2       ALA  14  18.867   7.568  -3.288
  111   3HB   ALA  14          HB3       ALA  14  19.491   8.452  -4.680
  112    HA   PRO  15           HA       PRO  15  19.178   2.886  -5.016
  113   1HB   PRO  15          HB2       PRO  15  19.659   1.318  -2.823
  114   2HB   PRO  15          HB1       PRO  15  20.863   1.594  -4.098
  115   1HG   PRO  15          HG2       PRO  15  20.621   2.867  -1.417
  116   2HG   PRO  15          HG1       PRO  15  22.069   2.345  -2.291
  117   1HD   PRO  15          HD2       PRO  15  21.267   4.940  -2.154
  118   2HD   PRO  15          HD1       PRO  15  22.182   4.272  -3.524
  119    H    THR  16           HN       THR  16  17.138   4.170  -4.724
  120    HA   THR  16           HA       THR  16  15.566   3.121  -2.428
  121    HB   THR  16           HB       THR  16  15.800   6.058  -3.163
  122    HG1  THR  16           HG1      THR  16  16.715   4.667  -0.869
  123   1HG2  THR  16          HG21      THR  16  14.166   4.508  -1.169
  124   2HG2  THR  16          HG22      THR  16  13.649   5.784  -2.270
  125   3HG2  THR  16          HG23      THR  16  14.609   6.183  -0.845
  126    H    GLU  17           HN       GLU  17  13.282   3.125  -2.866
  127    HA   GLU  17           HA       GLU  17  12.356   2.506  -5.380
  128   1HB   GLU  17          HB2       GLU  17  11.296   2.827  -2.906
  129   2HB   GLU  17          HB1       GLU  17  10.572   4.211  -3.726
  130   1HG   GLU  17          HG2       GLU  17   9.466   2.864  -5.300
  131   2HG   GLU  17          HG1       GLU  17  10.537   1.491  -5.015
  132    H    GLN  18           HN       GLN  18  10.962   3.827  -6.887
  133    HA   GLN  18           HA       GLN  18  11.302   6.715  -6.890
  134   1HB   GLN  18          HB2       GLN  18  12.535   6.641  -9.091
  135   2HB   GLN  18          HB1       GLN  18  13.463   6.002  -7.735
  136   1HG   GLN  18          HG2       GLN  18  12.459   3.704  -8.410
  137   2HG   GLN  18          HG1       GLN  18  12.081   4.488  -9.943
  138   1HE2  GLN  18          HE21      GLN  18  13.777   4.694 -11.448
  139   2HE2  GLN  18          HE22      GLN  18  15.401   4.337 -11.108
  140    H    SER  19           HN       SER  19   8.918   5.404  -6.808
  141    HA   SER  19           HA       SER  19   7.895   4.986  -9.548
  142   1HB   SER  19          HB2       SER  19   7.118   3.459  -7.902
  143   2HB   SER  19          HB1       SER  19   6.834   4.743  -6.730
  144    HG   SER  19           HG       SER  19   4.922   4.980  -7.549
  145    HA   PRO  20           HA       PRO  20   6.735   9.316  -9.583
  146   1HB   PRO  20          HB2       PRO  20   5.890   9.343 -12.184
  147   2HB   PRO  20          HB1       PRO  20   7.603   9.411 -11.726
  148   1HG   PRO  20          HG2       PRO  20   6.001   7.114 -12.716
  149   2HG   PRO  20          HG1       PRO  20   7.689   7.538 -13.037
  150   1HD   PRO  20          HD2       PRO  20   6.890   5.596 -11.269
  151   2HD   PRO  20          HD1       PRO  20   8.443   6.456 -11.178
  152    H    GLY  21           HN       GLY  21   4.879   9.231  -8.227
  153   1HA   GLY  21          HA2       GLY  21   2.397   9.825  -8.873
  154   2HA   GLY  21          HA1       GLY  21   2.374   8.145  -9.410
  155    H    VAL  22           HN       VAL  22   3.034  10.150  -6.536
  156    HA   VAL  22           HA       VAL  22   1.944   7.909  -4.869
  157    HB   VAL  22           HB       VAL  22   4.451   8.084  -4.861
  158   1HG1  VAL  22          HG11      VAL  22   4.160  10.631  -3.301
  159   2HG1  VAL  22          HG12      VAL  22   4.185  10.705  -5.063
  160   3HG1  VAL  22          HG13      VAL  22   5.556  10.020  -4.190
  161   1HG2  VAL  22          HG21      VAL  22   3.422   8.971  -2.172
  162   2HG2  VAL  22          HG22      VAL  22   4.629   7.739  -2.544
  163   3HG2  VAL  22          HG23      VAL  22   2.921   7.418  -2.844
  164    H    GLN  23           HN       GLN  23   0.539   8.595  -3.245
  165    HA   GLN  23           HA       GLN  23   0.460  11.149  -2.037
  166   1HB   GLN  23          HB2       GLN  23  -1.560  12.018  -3.352
  167   2HB   GLN  23          HB1       GLN  23  -0.020  12.046  -4.211
  168   1HG   GLN  23          HG2       GLN  23  -0.600   9.830  -5.223
  169   2HG   GLN  23          HG1       GLN  23  -2.185   9.938  -4.455
  170   1HE2  GLN  23          HE21      GLN  23  -0.316  10.959  -7.192
  171   2HE2  GLN  23          HE22      GLN  23  -1.480  11.991  -7.870
  172    H    ASP  24           HN       ASP  24  -0.303  10.183  -0.158
  173    HA   ASP  24           HA       ASP  24  -2.086   8.035   0.106
  174   1HB   ASP  24          HB2       ASP  24  -2.577   9.237   2.359
  175   2HB   ASP  24          HB1       ASP  24  -0.904   8.802   2.012
  176    H    CYS  25           HN       CYS  25  -3.902   8.138  -1.285
  177    HA   CYS  25           HA       CYS  25  -6.099   9.844  -0.357
  178   1HB   CYS  25          HB2       CYS  25  -5.861  11.496  -1.875
  179   2HB   CYS  25          HB1       CYS  25  -4.313  10.794  -2.299
  180    H    TYR  26           HN       TYR  26  -8.145   9.326  -1.498
  181    HA   TYR  26           HA       TYR  26  -8.177   7.047  -3.350
  182   1HB   TYR  26          HB2       TYR  26  -9.117   5.428  -1.875
  183   2HB   TYR  26          HB1       TYR  26  -7.746   6.117  -1.012
  184    HD1  TYR  26           HD1      TYR  26 -11.453   6.508  -1.428
  185    HD2  TYR  26           HD2      TYR  26  -8.038   7.008   1.127
  186    HE1  TYR  26           HE1      TYR  26 -12.949   7.133   0.447
  187    HE2  TYR  26           HE2      TYR  26  -9.534   7.634   3.002
  188    HH   TYR  26           HH       TYR  26 -12.805   7.063   3.013
  189    H    HIS  27           HN       HIS  27 -10.657   6.338  -3.599
  190    HA   HIS  27           HA       HIS  27 -12.205   8.900  -3.608
  191   1HB   HIS  27          HB2       HIS  27 -11.568   7.797  -5.771
  192   2HB   HIS  27          HB1       HIS  27 -12.527   6.396  -5.295
  193    HD1  HIS  27           HD1      HIS  27 -13.198   8.275  -7.773
  194    HD2  HIS  27           HD2      HIS  27 -14.992   8.485  -4.016
  195    HE1  HIS  27           HE1      HIS  27 -15.442   9.399  -8.113
  196    H    GLY  28           HN       GLY  28 -14.186   6.284  -4.363
  197   1HA   GLY  28          HA2       GLY  28 -16.004   6.589  -2.291
  198   2HA   GLY  28          HA1       GLY  28 -15.787   5.062  -3.146
  199    H    ASP  29           HN       ASP  29 -14.648   3.402  -2.141
  200    HA   ASP  29           HA       ASP  29 -13.606   4.002   0.592
  201   1HB   ASP  29          HB2       ASP  29 -15.772   2.336  -0.275
  202   2HB   ASP  29          HB1       ASP  29 -14.508   1.303   0.390
  203    H    GLY  30           HN       GLY  30 -11.764   4.211  -1.228
  204   1HA   GLY  30          HA2       GLY  30  -9.659   3.335  -1.814
  205   2HA   GLY  30          HA1       GLY  30 -10.018   1.933  -0.797
  206    H    GLN  31           HN       GLN  31 -12.615   2.433  -2.826
  207    HA   GLN  31           HA       GLN  31 -11.938   0.077  -4.439
  208   1HB   GLN  31          HB2       GLN  31 -14.244   1.741  -3.731
  209   2HB   GLN  31          HB1       GLN  31 -14.275   1.221  -5.417
  210   1HG   GLN  31          HG2       GLN  31 -13.461  -0.927  -3.610
  211   2HG   GLN  31          HG1       GLN  31 -15.069  -0.306  -3.233
  212   1HE2  GLN  31          HE21      GLN  31 -13.329  -2.361  -5.362
  213   2HE2  GLN  31          HE22      GLN  31 -14.563  -2.607  -6.501
  214    H    SER  32           HN       SER  32 -11.380   0.077  -6.622
  215    HA   SER  32           HA       SER  32 -10.787   0.937  -8.750
  216   1HB   SER  32          HB2       SER  32 -13.001   2.271  -8.052
  217   2HB   SER  32          HB1       SER  32 -11.869   3.618  -7.982
  218    HG   SER  32           HG       SER  32 -13.009   2.767 -10.099
  219    H    TYR  33           HN       TYR  33  -9.543   1.831  -5.852
  220    HA   TYR  33           HA       TYR  33  -8.010   4.161  -6.222
  221   1HB   TYR  33          HB2       TYR  33  -8.193   2.917  -4.126
  222   2HB   TYR  33          HB1       TYR  33  -7.368   1.534  -4.843
  223    HD1  TYR  33           HD1      TYR  33  -5.356   1.381  -3.603
  224    HD2  TYR  33           HD2      TYR  33  -6.584   5.158  -5.239
  225    HE1  TYR  33           HE1      TYR  33  -3.169   2.363  -2.977
  226    HE2  TYR  33           HE2      TYR  33  -4.395   6.141  -4.614
  227    HH   TYR  33           HH       TYR  33  -2.478   5.813  -3.527
  228    H    ARG  34           HN       ARG  34  -7.333   4.188  -8.484
  229    HA   ARG  34           HA       ARG  34  -5.769   2.134  -9.731
  230   1HB   ARG  34          HB2       ARG  34  -6.635   4.900 -10.173
  231   2HB   ARG  34          HB1       ARG  34  -5.050   4.567 -10.872
  232   1HG   ARG  34          HG2       ARG  34  -7.446   2.770 -11.298
  233   2HG   ARG  34          HG1       ARG  34  -7.017   4.079 -12.400
  234   1HD   ARG  34          HD2       ARG  34  -4.664   2.504 -11.823
  235   2HD   ARG  34          HD1       ARG  34  -5.969   1.453 -12.411
  236    HE   ARG  34           HE       ARG  34  -5.125   3.943 -13.851
  237   1HH1  ARG  34          HH11      ARG  34  -7.701   2.674 -14.678
  238   2HH1  ARG  34          HH12      ARG  34  -7.199   1.631 -15.965
  239   1HH2  ARG  34          HH21      ARG  34  -3.843   1.737 -15.101
  240   2HH2  ARG  34          HH22      ARG  34  -5.017   1.099 -16.204
  241    H    GLY  35           HN       GLY  35  -3.646   1.592  -9.364
  242   1HA   GLY  35          HA2       GLY  35  -1.316   2.656  -9.228
  243   2HA   GLY  35          HA1       GLY  35  -1.964   3.547  -7.850
  244    H    SER  36           HN       SER  36   0.264   1.581  -7.955
  245    HA   SER  36           HA       SER  36  -0.818  -0.661  -6.313
  246   1HB   SER  36          HB2       SER  36   1.876  -1.081  -6.689
  247   2HB   SER  36          HB1       SER  36   0.618  -1.657  -7.780
  248    HG   SER  36           HG       SER  36   1.334  -0.303  -9.207
  249    H    PHE  37           HN       PHE  37  -1.136   1.221  -4.636
  250    HA   PHE  37           HA       PHE  37   1.094   2.454  -3.347
  251   1HB   PHE  37          HB2       PHE  37  -1.430   2.932  -3.246
  252   2HB   PHE  37          HB1       PHE  37  -1.499   1.657  -2.030
  253    HD1  PHE  37           HD1      PHE  37  -0.385   5.060  -2.784
  254    HD2  PHE  37           HD2      PHE  37  -0.295   1.897   0.121
  255    HE1  PHE  37           HE1      PHE  37   0.398   6.664  -1.062
  256    HE2  PHE  37           HE2      PHE  37   0.488   3.503   1.843
  257    HZ   PHE  37           HZ       PHE  37   0.833   5.885   1.251
  258    H    SER  38           HN       SER  38   2.456   0.353  -3.427
  259    HA   SER  38           HA       SER  38   2.022  -1.814  -1.597
  260   1HB   SER  38          HB2       SER  38   4.594  -1.912  -1.907
  261   2HB   SER  38          HB1       SER  38   3.605  -2.035  -3.357
  262    HG   SER  38           HG       SER  38   5.074  -0.491  -3.816
  263    H    THR  39           HN       THR  39   1.408   0.587  -0.115
  264    HA   THR  39           HA       THR  39   3.492   0.392   2.004
  265    HB   THR  39           HB       THR  39   2.722   3.039   2.061
  266    HG1  THR  39           HG1      THR  39   2.820   3.713  -0.103
  267   1HG2  THR  39          HG21      THR  39   4.950   3.094   0.457
  268   2HG2  THR  39          HG22      THR  39   5.042   1.476   1.151
  269   3HG2  THR  39          HG23      THR  39   4.979   2.886   2.208
  270    H    THR  40           HN       THR  40   2.463  -0.089   3.905
  271    HA   THR  40           HA       THR  40  -0.448   0.033   4.098
  272    HB   THR  40           HB       THR  40  -0.042  -1.046   6.233
  273    HG1  THR  40           HG1      THR  40   1.604  -0.435   7.345
  274   1HG2  THR  40          HG21      THR  40   0.425  -2.837   4.944
  275   2HG2  THR  40          HG22      THR  40   2.122  -2.510   5.282
  276   3HG2  THR  40          HG23      THR  40   1.377  -1.873   3.816
  277    H    VAL  41           HN       VAL  41  -1.313   0.991   6.296
  278    HA   VAL  41           HA       VAL  41  -1.284   3.776   6.248
  279    HB   VAL  41           HB       VAL  41  -1.686   1.732   8.436
  280   1HG1  VAL  41          HG11      VAL  41  -1.299   4.584   8.733
  281   2HG1  VAL  41          HG12      VAL  41  -1.589   3.371   9.980
  282   3HG1  VAL  41          HG13      VAL  41  -2.951   4.147   9.171
  283   1HG2  VAL  41          HG21      VAL  41  -4.082   2.705   8.087
  284   2HG2  VAL  41          HG22      VAL  41  -3.432   1.617   6.861
  285   3HG2  VAL  41          HG23      VAL  41  -3.425   3.359   6.587
  286    H    THR  42           HN       THR  42   1.125   1.620   7.587
  287    HA   THR  42           HA       THR  42   2.462   3.784   9.097
  288    HB   THR  42           HB       THR  42   3.249   0.901   8.560
  289    HG1  THR  42           HG1      THR  42   1.686   0.452   9.859
  290   1HG2  THR  42          HG21      THR  42   5.145   1.593   9.580
  291   2HG2  THR  42          HG22      THR  42   4.175   1.655  11.051
  292   3HG2  THR  42          HG23      THR  42   4.414   3.114  10.091
  293    H    GLY  43           HN       GLY  43   2.650   2.228   5.983
  294   1HA   GLY  43          HA2       GLY  43   3.889   3.321   4.168
  295   2HA   GLY  43          HA1       GLY  43   5.064   3.874   5.366
  296    H    ARG  44           HN       ARG  44   3.856   0.669   5.663
  297    HA   ARG  44           HA       ARG  44   6.481  -0.516   5.461
  298   1HB   ARG  44          HB2       ARG  44   3.641  -1.532   5.628
  299   2HB   ARG  44          HB1       ARG  44   5.039  -2.605   5.685
  300   1HG   ARG  44          HG2       ARG  44   5.293  -0.310   7.485
  301   2HG   ARG  44          HG1       ARG  44   3.906  -1.331   7.866
  302   1HD   ARG  44          HD2       ARG  44   6.024  -3.114   7.290
  303   2HD   ARG  44          HD1       ARG  44   6.704  -1.862   8.350
  304    HE   ARG  44           HE       ARG  44   4.068  -3.033   9.072
  305   1HH1  ARG  44          HH11      ARG  44   7.174  -4.092   9.384
  306   2HH1  ARG  44          HH12      ARG  44   7.248  -4.012  11.112
  307   1HH2  ARG  44          HH21      ARG  44   4.260  -2.277  11.423
  308   2HH2  ARG  44          HH22      ARG  44   5.600  -2.977  12.268
  309    H    THR  45           HN       THR  45   5.913  -2.885   4.092
  310    HA   THR  45           HA       THR  45   5.741  -1.958   1.237
  311    HB   THR  45           HB       THR  45   7.947  -2.728   2.375
  312    HG1  THR  45           HG1      THR  45   8.500  -3.064   0.390
  313   1HG2  THR  45          HG21      THR  45   8.251  -5.004   2.801
  314   2HG2  THR  45          HG22      THR  45   6.868  -5.465   1.810
  315   3HG2  THR  45          HG23      THR  45   6.612  -4.714   3.384
  316    H    CYS  46           HN       CYS  46   3.665  -3.062   3.094
  317    HA   CYS  46           HA       CYS  46   2.258  -4.998   3.370
  318   1HB   CYS  46          HB2       CYS  46   1.860  -3.158   1.207
  319   2HB   CYS  46          HB1       CYS  46   1.207  -4.736   0.756
  320    H    GLN  47           HN       GLN  47   2.964  -7.092   3.422
  321    HA   GLN  47           HA       GLN  47   4.642  -8.381   1.575
  322   1HB   GLN  47          HB2       GLN  47   4.154  -9.270   3.771
  323   2HB   GLN  47          HB1       GLN  47   2.445  -9.437   3.378
  324   1HG   GLN  47          HG2       GLN  47   3.696 -11.596   3.224
  325   2HG   GLN  47          HG1       GLN  47   2.962 -11.117   1.692
  326   1HE2  GLN  47          HE21      GLN  47   6.056 -11.363   3.426
  327   2HE2  GLN  47          HE22      GLN  47   7.036 -11.181   2.052
  328    H    SER  48           HN       SER  48   4.258  -8.781  -0.565
  329    HA   SER  48           HA       SER  48   1.960  -8.461  -2.045
  330   1HB   SER  48          HB2       SER  48   4.074 -10.621  -2.287
  331   2HB   SER  48          HB1       SER  48   2.982 -10.141  -3.582
  332    HG   SER  48           HG       SER  48   5.142  -9.116  -3.492
  333    H    TRP  49           HN       TRP  49   0.263  -9.896  -2.751
  334    HA   TRP  49           HA       TRP  49  -0.859 -11.588  -0.701
  335   1HB   TRP  49          HB2       TRP  49  -1.478 -11.560  -3.666
  336   2HB   TRP  49          HB1       TRP  49  -2.580 -11.947  -2.345
  337    HD1  TRP  49           HD1      TRP  49  -1.148  -9.070  -4.280
  338    HE1  TRP  49           HE1      TRP  49  -2.186  -6.883  -3.444
  339    HE3  TRP  49           HE3      TRP  49  -3.528 -10.737  -0.140
  340    HZ2  TRP  49           HZ2      TRP  49  -3.810  -5.942  -1.310
  341    HZ3  TRP  49           HZ3      TRP  49  -4.827  -9.194   1.302
  342    HH2  TRP  49           HH2      TRP  49  -4.971  -6.788   0.719
  343    H    SER  50           HN       SER  50   1.243 -12.137  -3.441
  344    HA   SER  50           HA       SER  50   0.925 -15.036  -3.514
  345   1HB   SER  50          HB2       SER  50   1.590 -13.468  -5.393
  346   2HB   SER  50          HB1       SER  50   3.144 -13.269  -4.587
  347    HG   SER  50           HG       SER  50   2.512 -15.134  -6.264
  348    H    SER  51           HN       SER  51   2.090 -13.262  -1.076
  349    HA   SER  51           HA       SER  51   4.734 -14.307  -0.611
  350   1HB   SER  51          HB2       SER  51   4.333 -13.342   1.629
  351   2HB   SER  51          HB1       SER  51   3.793 -12.239   0.367
  352    HG   SER  51           HG       SER  51   2.341 -13.698   2.229
  353    H    MET  52           HN       MET  52   5.129 -16.441  -0.201
  354    HA   MET  52           HA       MET  52   3.072 -17.963   1.355
  355   1HB   MET  52          HB2       MET  52   5.089 -19.027  -0.645
  356   2HB   MET  52          HB1       MET  52   3.701 -19.878   0.025
  357   1HG   MET  52          HG2       MET  52   3.039 -17.333  -1.306
  358   2HG   MET  52          HG1       MET  52   3.665 -18.584  -2.376
  359   1HE   MET  52          HE1       MET  52   0.017 -18.647   0.314
  360   2HE   MET  52          HE2       MET  52   1.243 -17.399   0.118
  361   3HE   MET  52          HE3       MET  52   1.635 -18.880   0.969
  362    H    THR  53           HN       THR  53   5.547 -16.358   2.178
  363    HA   THR  53           HA       THR  53   7.180 -18.533   3.402
  364    HB   THR  53           HB       THR  53   8.332 -16.078   4.001
  365    HG1  THR  53           HG1      THR  53   8.199 -14.951   2.028
  366   1HG2  THR  53          HG21      THR  53   9.219 -18.288   2.934
  367   2HG2  THR  53          HG22      THR  53  10.024 -16.770   2.537
  368   3HG2  THR  53          HG23      THR  53   8.880 -17.484   1.401
  369    HA   PRO  54           HA       PRO  54   6.066 -16.004   7.263
  370   1HB   PRO  54          HB2       PRO  54   4.675 -13.661   7.005
  371   2HB   PRO  54          HB1       PRO  54   6.447 -13.745   6.933
  372   1HG   PRO  54          HG2       PRO  54   4.471 -13.531   4.721
  373   2HG   PRO  54          HG1       PRO  54   6.064 -12.778   4.891
  374   1HD   PRO  54          HD2       PRO  54   5.582 -14.965   3.333
  375   2HD   PRO  54          HD1       PRO  54   7.159 -14.601   4.064
  376    H    HIS  55           HN       HIS  55   3.282 -14.361   5.913
  377    HA   HIS  55           HA       HIS  55   1.499 -16.371   7.182
  378   1HB   HIS  55          HB2       HIS  55   0.347 -14.052   5.737
  379   2HB   HIS  55          HB1       HIS  55   0.027 -14.621   7.372
  380    HD1  HIS  55           HD1      HIS  55   2.343 -12.411   5.402
  381    HD2  HIS  55           HD2      HIS  55   1.651 -13.429   9.384
  382    HE1  HIS  55           HE1      HIS  55   3.717 -10.810   6.796
  383    H    TRP  56           HN       TRP  56   0.933 -18.088   5.895
  384    HA   TRP  56           HA       TRP  56   0.859 -17.764   2.947
  385   1HB   TRP  56          HB2       TRP  56   1.989 -19.650   4.275
  386   2HB   TRP  56          HB1       TRP  56   0.361 -20.242   4.609
  387    HD1  TRP  56           HD1      TRP  56  -1.127 -20.063   2.024
  388    HE1  TRP  56           HE1      TRP  56  -0.442 -21.281  -0.103
  389    HE3  TRP  56           HE3      TRP  56   3.776 -20.780   3.044
  390    HZ2  TRP  56           HZ2      TRP  56   1.911 -22.419  -1.254
  391    HZ3  TRP  56           HZ3      TRP  56   5.227 -21.901   1.404
  392    HH2  TRP  56           HH2      TRP  56   4.321 -22.741  -0.740
  393    H    HIS  57           HN       HIS  57  -1.036 -17.867   1.752
  394    HA   HIS  57           HA       HIS  57  -3.540 -18.750   3.060
  395   1HB   HIS  57          HB2       HIS  57  -4.620 -16.656   2.873
  396   2HB   HIS  57          HB1       HIS  57  -3.001 -16.221   3.415
  397    HD1  HIS  57           HD1      HIS  57  -1.872 -16.901   0.379
  398    HD2  HIS  57           HD2      HIS  57  -4.770 -14.116   1.486
  399    HE1  HIS  57           HE1      HIS  57  -1.974 -15.193  -1.486
  400    H    GLN  58           HN       GLN  58  -5.373 -18.089   1.168
  401    HA   GLN  58           HA       GLN  58  -4.245 -19.134  -1.410
  402   1HB   GLN  58          HB2       GLN  58  -5.998 -20.355   0.457
  403   2HB   GLN  58          HB1       GLN  58  -6.980 -19.923  -0.943
  404   1HG   GLN  58          HG2       GLN  58  -5.010 -20.951  -2.323
  405   2HG   GLN  58          HG1       GLN  58  -4.593 -21.747  -0.805
  406   1HE2  GLN  58          HE21      GLN  58  -5.399 -23.398  -2.893
  407   2HE2  GLN  58          HE22      GLN  58  -6.959 -23.999  -2.597
  408    H    ARG  59           HN       ARG  59  -5.106 -16.352  -0.400
  409    HA   ARG  59           HA       ARG  59  -7.323 -15.839  -2.347
  410   1HB   ARG  59          HB2       ARG  59  -6.261 -14.336   0.065
  411   2HB   ARG  59          HB1       ARG  59  -7.550 -13.732  -0.978
  412   1HG   ARG  59          HG2       ARG  59  -7.763 -16.485   0.210
  413   2HG   ARG  59          HG1       ARG  59  -8.179 -15.075   1.186
  414   1HD   ARG  59          HD2       ARG  59 -10.203 -15.009   0.172
  415   2HD   ARG  59          HD1       ARG  59  -9.394 -14.734  -1.384
  416    HE   ARG  59           HE       ARG  59  -9.208 -17.210  -1.613
  417   1HH1  ARG  59          HH11      ARG  59 -12.135 -16.586  -1.581
  418   2HH1  ARG  59          HH12      ARG  59 -12.736 -17.712  -0.410
  419   1HH2  ARG  59          HH21      ARG  59  -9.612 -18.384   0.936
  420   2HH2  ARG  59          HH22      ARG  59 -11.307 -18.731   1.014
  421    H    THR  60           HN       THR  60  -4.322 -16.094  -2.893
  422    HA   THR  60           HA       THR  60  -3.010 -13.668  -3.373
  423    HB   THR  60           HB       THR  60  -1.883 -15.695  -3.868
  424    HG1  THR  60           HG1      THR  60  -1.158 -14.461  -5.434
  425   1HG2  THR  60          HG21      THR  60  -3.473 -17.343  -4.189
  426   2HG2  THR  60          HG22      THR  60  -2.936 -17.110  -5.853
  427   3HG2  THR  60          HG23      THR  60  -4.423 -16.346  -5.291
  428    H    THR  61           HN       THR  61  -2.646 -12.831  -5.716
  429    HA   THR  61           HA       THR  61  -5.185 -11.783  -6.700
  430    HB   THR  61           HB       THR  61  -3.273 -11.072  -8.513
  431    HG1  THR  61           HG1      THR  61  -1.404 -11.630  -7.777
  432   1HG2  THR  61          HG21      THR  61  -4.657  -9.933  -6.382
  433   2HG2  THR  61          HG22      THR  61  -3.688  -9.070  -7.577
  434   3HG2  THR  61          HG23      THR  61  -2.965  -9.565  -6.047
  435    H    GLU  62           HN       GLU  62  -3.316 -14.604  -7.225
  436    HA   GLU  62           HA       GLU  62  -3.900 -15.013 -10.004
  437   1HB   GLU  62          HB2       GLU  62  -2.316 -16.164  -8.066
  438   2HB   GLU  62          HB1       GLU  62  -3.593 -17.367  -8.253
  439   1HG   GLU  62          HG2       GLU  62  -2.860 -17.984 -10.305
  440   2HG   GLU  62          HG1       GLU  62  -2.621 -16.312 -10.813
  441    H    TYR  63           HN       TYR  63  -5.590 -15.405  -7.032
  442    HA   TYR  63           HA       TYR  63  -7.761 -16.923  -8.372
  443   1HB   TYR  63          HB2       TYR  63  -6.549 -16.869  -5.775
  444   2HB   TYR  63          HB1       TYR  63  -8.244 -16.415  -5.601
  445    HD1  TYR  63           HD1      TYR  63  -9.417 -18.298  -4.846
  446    HD2  TYR  63           HD2      TYR  63  -6.535 -18.734  -8.002
  447    HE1  TYR  63           HE1      TYR  63 -10.085 -20.670  -5.129
  448    HE2  TYR  63           HE2      TYR  63  -7.204 -21.105  -8.283
  449    HH   TYR  63           HH       TYR  63 -10.007 -22.420  -6.747
  450    H    TYR  64           HN       TYR  64  -6.826 -13.776  -7.957
  451    HA   TYR  64           HA       TYR  64  -9.618 -12.811  -8.254
  452   1HB   TYR  64          HB2       TYR  64  -7.915 -12.545  -5.843
  453   2HB   TYR  64          HB1       TYR  64  -8.712 -11.060  -6.364
  454    HD1  TYR  64           HD1      TYR  64 -11.244 -11.858  -7.435
  455    HD2  TYR  64           HD2      TYR  64  -9.119 -13.504  -4.084
  456    HE1  TYR  64           HE1      TYR  64 -13.383 -12.665  -6.475
  457    HE2  TYR  64           HE2      TYR  64 -11.259 -14.311  -3.124
  458    HH   TYR  64           HH       TYR  64 -13.644 -14.949  -4.232
  459    HA   PRO  65           HA       PRO  65  -6.287 -10.528 -10.577
  460   1HB   PRO  65          HB2       PRO  65  -7.247 -11.041 -13.085
  461   2HB   PRO  65          HB1       PRO  65  -6.114 -12.119 -12.247
  462   1HG   PRO  65          HG2       PRO  65  -9.048 -12.380 -12.620
  463   2HG   PRO  65          HG1       PRO  65  -7.795 -13.629 -12.601
  464   1HD   PRO  65          HD2       PRO  65  -9.474 -13.085 -10.494
  465   2HD   PRO  65          HD1       PRO  65  -7.881 -13.857 -10.336
  466    H    ASN  66           HN       ASN  66  -9.539 -10.311  -9.930
  467    HA   ASN  66           HA       ASN  66 -10.218  -8.127 -11.779
  468   1HB   ASN  66          HB2       ASN  66 -11.499  -9.710  -9.587
  469   2HB   ASN  66          HB1       ASN  66 -12.216  -8.154 -10.010
  470   1HD2  ASN  66          HD21      ASN  66 -11.985  -8.002 -12.739
  471   2HD2  ASN  66          HD22      ASN  66 -12.760  -9.310 -13.493
  472    H    GLY  67           HN       GLY  67  -8.444  -8.342  -8.900
  473   1HA   GLY  67          HA2       GLY  67  -9.301  -5.695  -7.892
  474   2HA   GLY  67          HA1       GLY  67  -8.138  -6.769  -7.114
  475    H    GLY  68           HN       GLY  68  -6.306  -7.250  -9.084
  476   1HA   GLY  68          HA2       GLY  68  -4.705  -6.215 -10.533
  477   2HA   GLY  68          HA1       GLY  68  -5.493  -4.660 -10.252
  478    H    LEU  69           HN       LEU  69  -4.636  -6.829  -7.641
  479    HA   LEU  69           HA       LEU  69  -2.610  -4.818  -6.726
  480   1HB   LEU  69          HB2       LEU  69  -3.231  -5.844  -4.469
  481   2HB   LEU  69          HB1       LEU  69  -4.484  -4.922  -5.272
  482    HG   LEU  69           HG       LEU  69  -4.384  -7.792  -5.974
  483   1HD1  LEU  69          HD11      LEU  69  -4.668  -6.821  -3.193
  484   2HD1  LEU  69          HD12      LEU  69  -4.212  -8.417  -3.789
  485   3HD1  LEU  69          HD13      LEU  69  -5.911  -7.950  -3.730
  486   1HD2  LEU  69          HD21      LEU  69  -6.777  -7.545  -5.984
  487   2HD2  LEU  69          HD22      LEU  69  -6.107  -6.102  -6.742
  488   3HD2  LEU  69          HD23      LEU  69  -6.681  -6.036  -5.077
  489    H    THR  70           HN       THR  70  -2.191  -7.166  -8.511
  490    HA   THR  70           HA       THR  70  -1.087  -9.443  -7.323
  491    HB   THR  70           HB       THR  70  -1.303  -8.972  -9.761
  492    HG1  THR  70           HG1      THR  70   0.363 -10.442  -8.714
  493   1HG2  THR  70          HG21      THR  70   0.786  -7.668 -10.682
  494   2HG2  THR  70          HG22      THR  70   0.811  -6.958  -9.068
  495   3HG2  THR  70          HG23      THR  70  -0.612  -6.770 -10.093
  496    H    ARG  71           HN       ARG  71   1.090  -9.933  -6.563
  497    HA   ARG  71           HA       ARG  71   3.128  -9.435  -5.449
  498   1HB   ARG  71          HB2       ARG  71   3.095  -7.935  -7.680
  499   2HB   ARG  71          HB1       ARG  71   3.013  -6.635  -6.490
  500   1HG   ARG  71          HG2       ARG  71   4.975  -7.944  -5.332
  501   2HG   ARG  71          HG1       ARG  71   5.192  -8.656  -6.931
  502   1HD   ARG  71          HD2       ARG  71   4.878  -5.928  -7.458
  503   2HD   ARG  71          HD1       ARG  71   5.903  -5.981  -6.010
  504    HE   ARG  71           HE       ARG  71   6.538  -7.289  -8.611
  505   1HH1  ARG  71          HH11      ARG  71   7.467  -8.819  -6.156
  506   2HH1  ARG  71          HH12      ARG  71   9.070  -8.195  -5.952
  507   1HH2  ARG  71          HH21      ARG  71   8.551  -5.457  -8.015
  508   2HH2  ARG  71          HH22      ARG  71   9.683  -6.291  -7.004
  509    H    ASN  72           HN       ASN  72   3.687  -6.613  -4.520
  510    HA   ASN  72           HA       ASN  72   1.835  -6.632  -2.221
  511   1HB   ASN  72          HB2       ASN  72   4.004  -6.606  -1.408
  512   2HB   ASN  72          HB1       ASN  72   4.639  -5.792  -2.834
  513   1HD2  ASN  72          HD21      ASN  72   1.852  -4.575  -1.033
  514   2HD2  ASN  72          HD22      ASN  72   2.627  -3.181  -0.462
  515    H    TYR  73           HN       TYR  73   0.182  -5.748  -3.811
  516    HA   TYR  73           HA       TYR  73   0.506  -2.779  -4.195
  517   1HB   TYR  73          HB2       TYR  73  -1.071  -4.916  -5.681
  518   2HB   TYR  73          HB1       TYR  73  -1.260  -3.192  -5.988
  519    HD1  TYR  73           HD1      TYR  73  -0.461  -4.947  -8.181
  520    HD2  TYR  73           HD2      TYR  73   1.976  -3.046  -5.195
  521    HE1  TYR  73           HE1      TYR  73   1.483  -5.018  -9.717
  522    HE2  TYR  73           HE2      TYR  73   3.915  -3.119  -6.731
  523    HH   TYR  73           HH       TYR  73   3.621  -3.786 -10.034
  524    H    CYS  74           HN       CYS  74  -0.998  -1.518  -3.175
  525    HA   CYS  74           HA       CYS  74  -2.761  -2.691  -1.187
  526   1HB   CYS  74          HB2       CYS  74  -1.547  -0.185  -1.894
  527   2HB   CYS  74          HB1       CYS  74  -3.263   0.072  -1.584
  528    H    ARG  75           HN       ARG  75  -4.782  -3.425  -1.629
  529    HA   ARG  75           HA       ARG  75  -6.484  -1.926  -3.579
  530   1HB   ARG  75          HB2       ARG  75  -5.365  -4.597  -3.780
  531   2HB   ARG  75          HB1       ARG  75  -7.124  -4.664  -3.790
  532   1HG   ARG  75          HG2       ARG  75  -6.000  -4.360  -6.082
  533   2HG   ARG  75          HG1       ARG  75  -7.277  -3.218  -5.684
  534   1HD   ARG  75          HD2       ARG  75  -5.723  -1.476  -5.208
  535   2HD   ARG  75          HD1       ARG  75  -4.363  -2.615  -5.123
  536    HE   ARG  75           HE       ARG  75  -4.384  -2.774  -7.514
  537   1HH1  ARG  75          HH21      ARG  75  -7.469  -2.751  -7.629
  538   2HH1  ARG  75          HH22      ARG  75  -7.738  -1.305  -8.545
  539   1HH2  ARG  75          HH11      ARG  75  -4.514  -0.108  -8.099
  540   2HH2  ARG  75          HH12      ARG  75  -6.065   0.192  -8.808
  541    H    ASN  76           HN       ASN  76  -8.869  -2.649  -3.242
  542    HA   ASN  76           HA       ASN  76  -9.338  -3.522  -0.415
  543   1HB   ASN  76          HB2       ASN  76  -9.301  -0.961  -0.995
  544   2HB   ASN  76          HB1       ASN  76 -10.890  -1.283  -1.686
  545   1HD2  ASN  76          HD21      ASN  76 -11.435   0.287   0.250
  546   2HD2  ASN  76          HD22      ASN  76 -11.777  -0.458   1.737
  547    HA   PRO  77           HA       PRO  77 -12.168  -5.728  -3.284
  548   1HB   PRO  77          HB2       PRO  77 -11.881  -8.172  -2.089
  549   2HB   PRO  77          HB1       PRO  77 -10.772  -7.576  -3.340
  550   1HG   PRO  77          HG2       PRO  77 -10.417  -7.693  -0.396
  551   2HG   PRO  77          HG1       PRO  77  -9.230  -7.921  -1.688
  552   1HD   PRO  77          HD2       PRO  77  -9.496  -5.620  -0.197
  553   2HD   PRO  77          HD1       PRO  77  -8.760  -5.698  -1.812
  554    H    ASP  78           HN       ASP  78 -12.133  -4.759  -0.099
  555    HA   ASP  78           HA       ASP  78 -14.742  -6.075   0.558
  556   1HB   ASP  78          HB2       ASP  78 -12.780  -6.349   2.089
  557   2HB   ASP  78          HB1       ASP  78 -12.754  -4.600   2.316
  558    H    ALA  79           HN       ALA  79 -13.317  -3.097  -0.383
  559    HA   ALA  79           HA       ALA  79 -14.334  -0.997  -0.793
  560   1HB   ALA  79          HB1       ALA  79 -16.384  -2.956  -0.720
  561   2HB   ALA  79          HB2       ALA  79 -16.460  -1.357  -1.458
  562   3HB   ALA  79          HB3       ALA  79 -16.974  -1.581   0.214
  563    H    GLU  80           HN       GLU  80 -13.137  -1.726   1.835
  564    HA   GLU  80           HA       GLU  80 -14.814  -0.473   3.891
  565   1HB   GLU  80          HB2       GLU  80 -12.678  -2.250   3.773
  566   2HB   GLU  80          HB1       GLU  80 -11.949  -0.781   4.424
  567   1HG   GLU  80          HG2       GLU  80 -12.894  -1.173   6.424
  568   2HG   GLU  80          HG1       GLU  80 -14.495  -1.171   5.683
  569    H    ILE  81           HN       ILE  81 -13.240   1.213   5.285
  570    HA   ILE  81           HA       ILE  81 -13.363   3.717   4.124
  571    HB   ILE  81           HB       ILE  81 -11.462   4.265   5.706
  572   1HG1  ILE  81          HG12      ILE  81 -11.143   1.968   7.164
  573   2HG1  ILE  81          HG11      ILE  81 -11.192   1.333   5.519
  574   1HG2  ILE  81          HG21      ILE  81 -13.210   2.413   7.223
  575   2HG2  ILE  81          HG22      ILE  81 -14.029   3.639   6.255
  576   3HG2  ILE  81          HG23      ILE  81 -12.872   4.122   7.496
  577   1HD1  ILE  81          HD11      ILE  81  -8.977   2.460   6.754
  578   2HD1  ILE  81          HD12      ILE  81  -9.585   3.763   5.732
  579   3HD1  ILE  81          HD13      ILE  81  -9.169   2.204   5.020
  580    H    SER  82           HN       SER  82 -10.794   1.321   3.718
  581    HA   SER  82           HA       SER  82  -9.931   2.561   1.209
  582   1HB   SER  82          HB2       SER  82  -7.763   2.325   3.242
  583   2HB   SER  82          HB1       SER  82  -7.962   3.507   1.951
  584    HG   SER  82           HG       SER  82  -8.385   4.567   3.834
  585    HA   PRO  83           HA       PRO  83  -8.395  -1.492   0.545
  586   1HB   PRO  83          HB2       PRO  83  -5.973  -1.156  -0.669
  587   2HB   PRO  83          HB1       PRO  83  -7.509  -0.765  -1.464
  588   1HG   PRO  83          HG2       PRO  83  -5.501   1.031  -0.254
  589   2HG   PRO  83          HG1       PRO  83  -6.574   1.298  -1.635
  590   1HD   PRO  83          HD2       PRO  83  -6.968   2.292   0.934
  591   2HD   PRO  83          HD1       PRO  83  -8.213   2.166  -0.327
  592    H    TRP  84           HN       TRP  84  -6.628  -3.088   1.064
  593    HA   TRP  84           HA       TRP  84  -4.653  -2.252   3.103
  594   1HB   TRP  84          HB2       TRP  84  -5.632  -3.852   4.752
  595   2HB   TRP  84          HB1       TRP  84  -6.747  -2.546   4.351
  596    HD1  TRP  84           HD1      TRP  84  -8.975  -3.157   3.173
  597    HE1  TRP  84           HE1      TRP  84 -10.088  -5.382   2.492
  598    HE3  TRP  84           HE3      TRP  84  -5.060  -6.355   3.886
  599    HZ2  TRP  84           HZ2      TRP  84  -9.405  -8.154   2.279
  600    HZ3  TRP  84           HZ3      TRP  84  -5.316  -8.778   3.439
  601    HH2  TRP  84           HH2      TRP  84  -7.481  -9.682   2.637
  602    H    CYS  85           HN       CYS  85  -3.354  -4.274   3.806
  603    HA   CYS  85           HA       CYS  85  -3.528  -6.667   2.170
  604   1HB   CYS  85          HB2       CYS  85  -1.178  -6.049   1.111
  605   2HB   CYS  85          HB1       CYS  85  -2.668  -5.487   0.364
  606    H    TYR  86           HN       TYR  86  -1.702  -8.163   2.620
  607    HA   TYR  86           HA       TYR  86  -1.018  -8.289   5.384
  608   1HB   TYR  86          HB2       TYR  86   0.412  -9.591   3.051
  609   2HB   TYR  86          HB1       TYR  86   0.244 -10.221   4.690
  610    HD1  TYR  86           HD1      TYR  86  -2.682  -9.355   5.067
  611    HD2  TYR  86           HD2      TYR  86  -0.663 -11.430   1.893
  612    HE1  TYR  86           HE1      TYR  86  -4.810 -10.459   4.436
  613    HE2  TYR  86           HE2      TYR  86  -2.792 -12.534   1.263
  614    HH   TYR  86           HH       TYR  86  -5.438 -11.776   1.647
  615    H    THR  87           HN       THR  87   1.218  -8.235   6.291
  616    HA   THR  87           HA       THR  87   2.807  -5.974   5.141
  617    HB   THR  87           HB       THR  87   3.842  -6.501   7.600
  618    HG1  THR  87           HG1      THR  87   2.597  -8.024   8.351
  619   1HG2  THR  87          HG21      THR  87   1.230  -5.028   7.397
  620   2HG2  THR  87          HG22      THR  87   2.686  -4.406   6.617
  621   3HG2  THR  87          HG23      THR  87   2.651  -4.635   8.365
  622    H    MET  88           HN       MET  88   5.019  -6.293   4.610
  623    HA   MET  88           HA       MET  88   5.903  -9.040   4.169
  624   1HB   MET  88          HB2       MET  88   6.386  -6.936   2.809
  625   2HB   MET  88          HB1       MET  88   7.528  -6.491   4.079
  626   1HG   MET  88          HG2       MET  88   8.850  -8.456   3.695
  627   2HG   MET  88          HG1       MET  88   7.618  -9.155   2.644
  628   1HE   MET  88          HE1       MET  88   6.799  -8.261   0.605
  629   2HE   MET  88          HE2       MET  88   8.194  -9.183   0.050
  630   3HE   MET  88          HE3       MET  88   7.862  -7.599  -0.645
  631    H    ASP  89           HN       ASP  89   5.554  -7.671   7.064
  632    HA   ASP  89           HA       ASP  89   8.162  -8.692   8.107
  633   1HB   ASP  89          HB2       ASP  89   6.706  -6.179   8.403
  634   2HB   ASP  89          HB1       ASP  89   7.035  -6.925   9.967
  635    HA   PRO  90           HA       PRO  90   5.615 -11.539  10.291
  636   1HB   PRO  90          HB2       PRO  90   7.423 -12.265  12.220
  637   2HB   PRO  90          HB1       PRO  90   7.520 -12.829  10.539
  638   1HG   PRO  90          HG2       PRO  90   9.032 -10.648  11.893
  639   2HG   PRO  90          HG1       PRO  90   9.589 -11.839  10.707
  640   1HD   PRO  90          HD2       PRO  90   9.000  -9.259  10.060
  641   2HD   PRO  90          HD1       PRO  90   8.829 -10.611   8.919
  642    H    ASN  91           HN       ASN  91   6.573  -8.537  11.422
  643    HA   ASN  91           HA       ASN  91   5.524  -8.860  14.166
  644   1HB   ASN  91          HB2       ASN  91   7.354  -7.404  14.064
  645   2HB   ASN  91          HB1       ASN  91   6.867  -6.744  12.504
  646   1HD2  ASN  91          HD21      ASN  91   5.704  -4.808  12.533
  647   2HD2  ASN  91          HD22      ASN  91   5.048  -4.098  13.929
  648    H    VAL  92           HN       VAL  92   4.352  -8.181  11.021
  649    HA   VAL  92           HA       VAL  92   1.799  -7.123  12.183
  650    HB   VAL  92           HB       VAL  92   3.215  -6.342   9.607
  651   1HG1  VAL  92          HG11      VAL  92   0.985  -5.920   9.129
  652   2HG1  VAL  92          HG12      VAL  92   1.397  -4.422   9.961
  653   3HG1  VAL  92          HG13      VAL  92   0.551  -5.705  10.825
  654   1HG2  VAL  92          HG21      VAL  92   4.465  -5.225  11.203
  655   2HG2  VAL  92          HG22      VAL  92   3.151  -5.212  12.380
  656   3HG2  VAL  92          HG23      VAL  92   3.139  -4.076  11.031
  657    H    ARG  93           HN       ARG  93  -0.034  -8.175  11.379
  658    HA   ARG  93           HA       ARG  93   0.387 -10.449   9.587
  659   1HB   ARG  93          HB2       ARG  93  -0.993 -10.469  11.714
  660   2HB   ARG  93          HB1       ARG  93  -2.150  -9.427  10.884
  661   1HG   ARG  93          HG2       ARG  93  -3.053 -11.522  10.429
  662   2HG   ARG  93          HG1       ARG  93  -2.021 -11.291   9.017
  663   1HD   ARG  93          HD2       ARG  93  -0.613 -12.976   9.634
  664   2HD   ARG  93          HD1       ARG  93  -0.636 -12.486  11.340
  665    HE   ARG  93           HE       ARG  93  -3.036 -13.812  10.158
  666   1HH1  ARG  93          HH11      ARG  93  -1.034 -15.844  10.853
  667   2HH1  ARG  93          HH12      ARG  93  -1.363 -16.170  12.522
  668   1HH2  ARG  93          HH21      ARG  93  -3.215 -13.277  12.997
  669   2HH2  ARG  93          HH22      ARG  93  -2.597 -14.716  13.736
  670    H    TRP  94           HN       TRP  94  -1.561  -7.477   9.712
  671    HA   TRP  94           HA       TRP  94  -1.392  -7.146   6.802
  672   1HB   TRP  94          HB2       TRP  94  -3.753  -7.439   6.391
  673   2HB   TRP  94          HB1       TRP  94  -3.214  -8.859   7.286
  674    HD1  TRP  94           HD1      TRP  94  -4.319  -9.334   9.556
  675    HE1  TRP  94           HE1      TRP  94  -6.072  -8.122  11.006
  676    HE3  TRP  94           HE3      TRP  94  -4.624  -4.896   7.046
  677    HZ2  TRP  94           HZ2      TRP  94  -7.425  -5.602  11.091
  678    HZ3  TRP  94           HZ3      TRP  94  -6.151  -3.111   7.832
  679    HH2  TRP  94           HH2      TRP  94  -7.549  -3.456   9.849
  680    H    GLU  95           HN       GLU  95  -2.247  -5.004   6.171
  681    HA   GLU  95           HA       GLU  95  -3.117  -3.227   8.391
  682   1HB   GLU  95          HB2       GLU  95  -0.576  -2.968   6.762
  683   2HB   GLU  95          HB1       GLU  95  -1.253  -1.633   7.693
  684   1HG   GLU  95          HG2       GLU  95  -1.265  -3.323   9.674
  685   2HG   GLU  95          HG1       GLU  95  -0.123  -4.239   8.690
  686    H    TYR  96           HN       TYR  96  -3.796  -1.066   7.529
  687    HA   TYR  96           HA       TYR  96  -5.195  -1.367   4.958
  688   1HB   TYR  96          HB2       TYR  96  -5.151   0.461   7.314
  689   2HB   TYR  96          HB1       TYR  96  -5.714   1.153   5.792
  690    HD1  TYR  96           HD1      TYR  96  -6.702  -0.632   8.665
  691    HD2  TYR  96           HD2      TYR  96  -7.404  -0.402   4.434
  692    HE1  TYR  96           HE1      TYR  96  -8.896  -1.747   8.970
  693    HE2  TYR  96           HE2      TYR  96  -9.598  -1.518   4.738
  694    HH   TYR  96           HH       TYR  96 -10.529  -2.937   7.780
  695    H    CYS  97           HN       CYS  97  -5.133   0.947   3.674
  696    HA   CYS  97           HA       CYS  97  -2.247   1.355   3.006
  697   1HB   CYS  97          HB2       CYS  97  -4.764   1.966   1.430
  698   2HB   CYS  97          HB1       CYS  97  -3.111   1.971   0.813
  699    H    ASN  98           HN       ASN  98  -1.373   3.416   2.972
  700    HA   ASN  98           HA       ASN  98  -2.564   5.466   4.624
  701   1HB   ASN  98          HB2       ASN  98  -0.149   5.047   2.934
  702   2HB   ASN  98          HB1       ASN  98  -0.560   6.714   3.336
  703   1HD2  ASN  98          HD21      ASN  98   1.630   4.747   4.365
  704   2HD2  ASN  98          HD22      ASN  98   1.507   4.875   6.052
  705    H    LEU  99           HN       LEU  99  -4.678   5.752   3.348
  706    HA   LEU  99           HA       LEU  99  -4.256   7.890   1.321
  707   1HB   LEU  99          HB2       LEU  99  -6.414   6.228   0.420
  708   2HB   LEU  99          HB1       LEU  99  -4.912   6.611  -0.412
  709    HG   LEU  99           HG       LEU  99  -5.012   4.472   1.716
  710   1HD1  LEU  99          HD11      LEU  99  -5.323   2.847  -0.128
  711   2HD1  LEU  99          HD12      LEU  99  -5.571   4.182  -1.250
  712   3HD1  LEU  99          HD13      LEU  99  -6.722   3.902   0.056
  713   1HD2  LEU  99          HD21      LEU  99  -3.014   5.635   0.035
  714   2HD2  LEU  99          HD22      LEU  99  -3.270   3.975  -0.505
  715   3HD2  LEU  99          HD23      LEU  99  -2.830   4.299   1.172
  716    H    THR 100           HN       THR 100  -5.796   9.486   1.456
  717    HA   THR 100           HA       THR 100  -7.961   9.115   3.480
  718    HB   THR 100           HB       THR 100  -7.852  11.532   3.657
  719    HG1  THR 100           HG1      THR 100  -7.529  12.140   1.568
  720   1HG2  THR 100          HG21      THR 100  -5.748   9.797   4.245
  721   2HG2  THR 100          HG22      THR 100  -5.984  11.415   4.908
  722   3HG2  THR 100          HG23      THR 100  -4.970  11.184   3.483
  723    H    GLN 101           HN       GLN 101 -10.085  10.064   2.939
  724    HA   GLN 101           HA       GLN 101 -11.129   9.292   0.434
  725   1HB   GLN 101          HB2       GLN 101 -12.127  10.162   2.784
  726   2HB   GLN 101          HB1       GLN 101 -12.328  11.633   1.831
  727   1HG   GLN 101          HG2       GLN 101 -13.371  10.100   0.032
  728   2HG   GLN 101          HG1       GLN 101 -13.494   8.897   1.317
  729   1HE2  GLN 101          HE21      GLN 101 -15.149   9.169   2.884
  730   2HE2  GLN 101          HE22      GLN 101 -16.239  10.470   2.878
  731    H    CYS 102           HN       CYS 102  -9.690  10.089  -1.221
  732    HA   CYS 102           HA       CYS 102  -9.597  13.015  -1.544
  733   1HB   CYS 102          HB2       CYS 102  -7.599  12.668  -2.666
  734   2HB   CYS 102          HB1       CYS 102  -7.614  11.334  -1.520
  735    HA   PRO 103           HA       PRO 103 -12.726  12.478  -4.657
  736   1HB   PRO 103          HB2       PRO 103 -12.945  15.118  -5.328
  737   2HB   PRO 103          HB1       PRO 103 -13.660  14.434  -3.855
  738   1HG   PRO 103          HG2       PRO 103 -11.188  16.039  -4.188
  739   2HG   PRO 103          HG1       PRO 103 -12.358  16.025  -2.860
  740   1HD   PRO 103          HD2       PRO 103  -9.903  14.772  -2.802
  741   2HD   PRO 103          HD1       PRO 103 -11.288  14.335  -1.778
  742    H    VAL 104           HN       VAL 104 -12.916  13.727  -7.006
  743    HA   VAL 104           HA       VAL 104 -10.241  13.330  -8.302
  744    HB   VAL 104           HB       VAL 104 -13.030  13.112  -9.479
  745   1HG1  VAL 104          HG11      VAL 104 -11.570  13.326 -11.286
  746   2HG1  VAL 104          HG12      VAL 104 -11.580  11.577 -11.056
  747   3HG1  VAL 104          HG13      VAL 104 -10.240  12.541 -10.435
  748   1HG2  VAL 104          HG21      VAL 104 -11.316  11.174  -7.972
  749   2HG2  VAL 104          HG22      VAL 104 -12.257  10.567  -9.334
  750   3HG2  VAL 104          HG23      VAL 104 -13.071  11.346  -7.977
  751    H    THR 105           HN       THR 105 -10.098  14.645 -10.436
  752    HA   THR 105           HA       THR 105 -10.456  17.459  -9.830
  753    HB   THR 105           HB       THR 105  -9.744  16.028 -12.412
  754    HG1  THR 105           HG1      THR 105  -8.360  15.437 -10.752
  755   1HG2  THR 105          HG21      THR 105  -8.920  18.064 -13.198
  756   2HG2  THR 105          HG22      THR 105  -8.773  18.744 -11.578
  757   3HG2  THR 105          HG23      THR 105 -10.363  18.578 -12.323
  758    H    GLU 106           HN       GLU 106 -12.692  17.951  -9.681
  759    HA   GLU 106           HA       GLU 106 -14.092  18.480 -12.108
  760   1HB   GLU 106          HB2       GLU 106 -15.734  16.713 -12.067
  761   2HB   GLU 106          HB1       GLU 106 -14.151  15.945 -11.952
  762   1HG   GLU 106          HG2       GLU 106 -14.410  15.919  -9.455
  763   2HG   GLU 106          HG1       GLU 106 -16.055  16.522  -9.665
  764    H    SER 107           HN       SER 107 -14.303  17.837  -8.632
  765    HA   SER 107           HA       SER 107 -16.219  20.131  -8.411
  766   1HB   SER 107          HB2       SER 107 -17.131  18.579  -6.466
  767   2HB   SER 107          HB1       SER 107 -17.644  18.311  -8.129
  768    HG   SER 107           HG       SER 107 -16.953  16.363  -7.302
  769    H    SER 108           HN       SER 108 -16.395  20.593  -5.847
  770    HA   SER 108           HA       SER 108 -13.724  20.298  -4.556
  771   1HB   SER 108          HB2       SER 108 -15.071  22.773  -5.560
  772   2HB   SER 108          HB1       SER 108 -14.143  22.889  -4.068
  773    HG   SER 108           HG       SER 108 -13.265  22.795  -6.584
  774    H    VAL 109           HN       VAL 109 -16.179  19.025  -3.832
  775    HA   VAL 109           HA       VAL 109 -17.190  20.591  -1.501
  776    HB   VAL 109           HB       VAL 109 -18.904  18.727  -1.513
  777   1HG1  VAL 109          HG11      VAL 109 -19.500  20.738  -2.652
  778   2HG1  VAL 109          HG12      VAL 109 -19.874  19.429  -3.773
  779   3HG1  VAL 109          HG13      VAL 109 -18.409  20.387  -3.992
  780   1HG2  VAL 109          HG21      VAL 109 -18.237  17.864  -4.214
  781   2HG2  VAL 109          HG22      VAL 109 -18.597  16.889  -2.789
  782   3HG2  VAL 109          HG23      VAL 109 -16.954  17.462  -3.073
  783    H    LEU 110           HN       LEU 110 -15.416  20.269  -0.024
  784    HA   LEU 110           HA       LEU 110 -14.563  17.497   0.571
  785   1HB   LEU 110          HB2       LEU 110 -13.392  20.025   0.568
  786   2HB   LEU 110          HB1       LEU 110 -13.577  19.652   2.283
  787    HG   LEU 110           HG       LEU 110 -12.359  17.737   0.277
  788   1HD1  LEU 110          HD11      LEU 110 -10.207  18.399   1.522
  789   2HD1  LEU 110          HD12      LEU 110 -11.104  19.810   2.083
  790   3HD1  LEU 110          HD13      LEU 110 -10.839  19.563   0.357
  791   1HD2  LEU 110          HD21      LEU 110 -13.038  17.680   3.150
  792   2HD2  LEU 110          HD22      LEU 110 -11.406  17.126   2.777
  793   3HD2  LEU 110          HD23      LEU 110 -12.797  16.343   2.025
  794    H    ALA 111           HN       ALA 111 -17.341  18.550   1.231
  795    HA   ALA 111           HA       ALA 111 -17.289  17.800   4.126
  796   1HB   ALA 111          HB1       ALA 111 -18.976  19.631   4.475
  797   2HB   ALA 111          HB2       ALA 111 -18.711  20.134   2.806
  798   3HB   ALA 111          HB3       ALA 111 -17.395  20.232   3.977
  799    H    THR 112           HN       THR 112 -17.935  15.762   2.725
  800    HA   THR 112           HA       THR 112 -20.690  15.764   1.701
  801    HB   THR 112           HB       THR 112 -18.938  13.371   2.256
  802    HG1  THR 112           HG1      THR 112 -18.309  14.018  -0.074
  803   1HG2  THR 112          HG21      THR 112 -20.420  12.319   0.933
  804   2HG2  THR 112          HG22      THR 112 -20.235  13.542  -0.325
  805   3HG2  THR 112          HG23      THR 112 -21.405  13.783   0.973
  806    H    SER 113           HN       SER 113 -19.124  15.207   4.734
  807    HA   SER 113           HA       SER 113 -20.896  13.300   5.920
  808   1HB   SER 113          HB2       SER 113 -18.936  15.375   6.771
  809   2HB   SER 113          HB1       SER 113 -20.058  14.801   8.003
  810    HG   SER 113           HG       SER 113 -18.829  12.912   6.356
  811    H    THR 114           HN       THR 114 -20.938  16.881   5.999
  812    HA   THR 114           HA       THR 114 -23.460  17.005   7.449
  813    HB   THR 114           HB       THR 114 -23.202  19.431   6.927
  814    HG1  THR 114           HG1      THR 114 -22.306  19.056   4.821
  815   1HG2  THR 114          HG21      THR 114 -21.751  19.485   8.641
  816   2HG2  THR 114          HG22      THR 114 -20.439  18.958   7.586
  817   3HG2  THR 114          HG23      THR 114 -21.451  17.764   8.400
  818    H    ALA 115           HN       ALA 115 -24.292  15.366   5.585
  819    HA   ALA 115           HA       ALA 115 -25.541  17.034   3.423
  820   1HB   ALA 115          HB1       ALA 115 -25.600  14.213   2.890
  821   2HB   ALA 115          HB2       ALA 115 -23.970  14.651   3.402
  822   3HB   ALA 115          HB3       ALA 115 -24.711  15.466   2.025
  823    H    VAL 116           HN       VAL 116 -27.702  15.995   2.682
  824    HA   VAL 116           HA       VAL 116 -29.555  15.930   4.849
  825    HB   VAL 116           HB       VAL 116 -30.020  16.500   2.466
  826   1HG1  VAL 116          HG11      VAL 116 -28.798  14.933   1.206
  827   2HG1  VAL 116          HG12      VAL 116 -30.464  14.391   1.005
  828   3HG1  VAL 116          HG13      VAL 116 -29.401  13.569   2.147
  829   1HG2  VAL 116          HG21      VAL 116 -31.852  14.237   2.769
  830   2HG2  VAL 116          HG22      VAL 116 -32.195  15.967   2.804
  831   3HG2  VAL 116          HG23      VAL 116 -31.651  15.147   4.267
  832    H    SER 117           HN       SER 117 -27.452  13.493   3.636
  833    HA   SER 117           HA       SER 117 -29.118  11.245   4.601
  834   1HB   SER 117          HB2       SER 117 -27.399   9.907   3.563
  835   2HB   SER 117          HB1       SER 117 -27.704  11.269   2.490
  836    HG   SER 117           HG       SER 117 -25.639  11.083   4.436
  837    H    GLU 118           HN       GLU 118 -28.761  10.207   6.550
  838    HA   GLU 118           HA       GLU 118 -26.239  10.524   8.024
  839   1HB   GLU 118          HB2       GLU 118 -27.415  11.639   9.946
  840   2HB   GLU 118          HB1       GLU 118 -27.360  12.639   8.494
  841   1HG   GLU 118          HG2       GLU 118 -29.664  11.527   7.948
  842   2HG   GLU 118          HG1       GLU 118 -29.693  11.151   9.672
  843    H    GLN 119           HN       GLN 119 -27.666   8.232   7.050
  844    HA   GLN 119           HA       GLN 119 -29.147   7.052   9.304
  845   1HB   GLN 119          HB2       GLN 119 -28.490   6.469   6.472
  846   2HB   GLN 119          HB1       GLN 119 -28.712   5.054   7.501
  847   1HG   GLN 119          HG2       GLN 119 -30.903   5.871   8.212
  848   2HG   GLN 119          HG1       GLN 119 -30.681   7.348   7.273
  849   1HE2  GLN 119          HE21      GLN 119 -32.182   4.376   7.125
  850   2HE2  GLN 119          HE22      GLN 119 -32.246   4.182   5.440
  Start of MODEL   11
    1   1H    ALA   1          HT1       ALA   1  21.166  -6.212  -0.674
    2   2H    ALA   1          HT2       ALA   1  20.900  -5.060   0.546
    3   3H    ALA   1          HT3       ALA   1  21.822  -6.449   0.872
    4    HA   ALA   1           HA       ALA   1  23.616  -5.712  -0.466
    5   1HB   ALA   1          HB1       ALA   1  22.044  -4.976  -2.261
    6   2HB   ALA   1          HB2       ALA   1  23.306  -3.784  -1.951
    7   3HB   ALA   1          HB3       ALA   1  21.680  -3.532  -1.316
    8    H    ARG   2           HN       ARG   2  23.950  -2.738  -0.514
    9    HA   ARG   2           HA       ARG   2  24.329  -2.359   2.425
   10   1HB   ARG   2          HB2       ARG   2  26.330  -2.231   1.084
   11   2HB   ARG   2          HB1       ARG   2  25.553  -1.144  -0.068
   12   1HG   ARG   2          HG2       ARG   2  25.554   0.662   1.449
   13   2HG   ARG   2          HG1       ARG   2  25.812  -0.393   2.840
   14   1HD   ARG   2          HD2       ARG   2  28.045  -0.095   2.637
   15   2HD   ARG   2          HD1       ARG   2  27.983  -0.789   1.004
   16    HE   ARG   2           HE       ARG   2  27.122   1.629   0.385
   17   1HH1  ARG   2          HH21      ARG   2  27.849   2.542   3.217
   18   2HH1  ARG   2          HH22      ARG   2  29.399   3.264   2.939
   19   1HH2  ARG   2          HH11      ARG   2  29.818   1.800  -0.175
   20   2HH2  ARG   2          HH12      ARG   2  30.514   2.842   1.020
   21    H    ILE   3           HN       ILE   3  23.230  -0.716   3.475
   22    HA   ILE   3           HA       ILE   3  21.479   1.046   1.798
   23    HB   ILE   3           HB       ILE   3  20.113   1.152   3.877
   24   1HG1  ILE   3          HG12      ILE   3  21.756  -1.031   5.085
   25   2HG1  ILE   3          HG11      ILE   3  22.370   0.617   5.220
   26   1HG2  ILE   3          HG21      ILE   3  20.217  -1.685   3.872
   27   2HG2  ILE   3          HG22      ILE   3  20.619  -1.158   2.238
   28   3HG2  ILE   3          HG23      ILE   3  19.104  -0.647   2.982
   29   1HD1  ILE   3          HD11      ILE   3  19.486   0.232   5.826
   30   2HD1  ILE   3          HD12      ILE   3  20.669   1.283   6.605
   31   3HD1  ILE   3          HD13      ILE   3  20.627  -0.437   6.992
   32    H    HIS   4           HN       HIS   4  23.812   2.193   1.721
   33    HA   HIS   4           HA       HIS   4  23.678   4.392   3.718
   34   1HB   HIS   4          HB2       HIS   4  25.805   2.323   3.394
   35   2HB   HIS   4          HB1       HIS   4  26.337   3.975   3.706
   36    HD1  HIS   4           HD1      HIS   4  26.475   1.522   5.778
   37    HD2  HIS   4           HD2      HIS   4  23.649   4.587   5.771
   38    HE1  HIS   4           HE1      HIS   4  25.552   1.651   8.133
   39    H    HIS   5           HN       HIS   5  22.865   5.146   1.411
   40    HA   HIS   5           HA       HIS   5  25.074   6.647   0.179
   41   1HB   HIS   5          HB2       HIS   5  24.821   4.173  -0.737
   42   2HB   HIS   5          HB1       HIS   5  23.489   4.877  -1.653
   43    HD1  HIS   5           HD1      HIS   5  26.695   6.699  -0.808
   44    HD2  HIS   5           HD2      HIS   5  24.799   5.049  -4.134
   45    HE1  HIS   5           HE1      HIS   5  28.040   7.418  -2.829
   46    H    HIS   6           HN       HIS   6  23.874   7.526  -2.108
   47    HA   HIS   6           HA       HIS   6  21.639   9.140  -1.080
   48   1HB   HIS   6          HB2       HIS   6  23.428   9.039  -3.485
   49   2HB   HIS   6          HB1       HIS   6  21.921   9.949  -3.596
   50    HD1  HIS   6           HD1      HIS   6  25.269  10.622  -2.941
   51    HD2  HIS   6           HD2      HIS   6  21.781  11.569  -0.864
   52    HE1  HIS   6           HE1      HIS   6  25.836  12.588  -1.449
   53    H    HIS   7           HN       HIS   7  19.681   8.045  -1.047
   54    HA   HIS   7           HA       HIS   7  18.801   5.862  -2.502
   55   1HB   HIS   7          HB2       HIS   7  17.545   8.301  -1.324
   56   2HB   HIS   7          HB1       HIS   7  16.527   7.290  -2.350
   57    HD1  HIS   7           HD1      HIS   7  15.302   5.595  -1.010
   58    HD2  HIS   7           HD2      HIS   7  19.071   6.364   0.595
   59    HE1  HIS   7           HE1      HIS   7  15.533   4.102   1.023
   60    H    HIS   8           HN       HIS   8  18.058   5.499  -4.599
   61    HA   HIS   8           HA       HIS   8  18.513   7.687  -6.561
   62   1HB   HIS   8          HB2       HIS   8  18.466   4.708  -6.506
   63   2HB   HIS   8          HB1       HIS   8  18.007   5.480  -8.025
   64    HD1  HIS   8           HD1      HIS   8  19.912   6.097  -9.508
   65    HD2  HIS   8           HD2      HIS   8  21.102   5.838  -5.521
   66    HE1  HIS   8           HE1      HIS   8  22.412   6.500  -9.479
   67    H    HIS   9           HN       HIS   9  15.961   6.772  -4.738
   68    HA   HIS   9           HA       HIS   9  13.947   6.837  -6.935
   69   1HB   HIS   9          HB2       HIS   9  14.225   5.381  -4.596
   70   2HB   HIS   9          HB1       HIS   9  13.044   6.612  -4.147
   71    HD1  HIS   9           HD1      HIS   9  13.425   3.500  -6.084
   72    HD2  HIS   9           HD2      HIS   9  10.688   6.639  -5.907
   73    HE1  HIS   9           HE1      HIS   9  11.343   2.705  -7.287
   74    H    ILE  10           HN       ILE  10  14.533   9.217  -7.259
   75    HA   ILE  10           HA       ILE  10  13.994  11.176  -5.215
   76    HB   ILE  10           HB       ILE  10  14.050  12.713  -7.167
   77   1HG1  ILE  10          HG12      ILE  10  14.660  10.848  -9.238
   78   2HG1  ILE  10          HG11      ILE  10  13.133  10.349  -8.508
   79   1HG2  ILE  10          HG21      ILE  10  16.056  10.651  -6.576
   80   2HG2  ILE  10          HG22      ILE  10  16.260  12.392  -6.774
   81   3HG2  ILE  10          HG23      ILE  10  16.224  11.342  -8.190
   82   1HD1  ILE  10          HD11      ILE  10  13.428  12.351 -10.402
   83   2HD1  ILE  10          HD12      ILE  10  13.314  13.248  -8.887
   84   3HD1  ILE  10          HD13      ILE  10  12.028  12.134  -9.352
   85    H    GLU  11           HN       GLU  11  12.029  11.966  -4.534
   86    HA   GLU  11           HA       GLU  11   9.555  10.862  -5.657
   87   1HB   GLU  11          HB2       GLU  11   9.750  11.117  -3.277
   88   2HB   GLU  11          HB1       GLU  11  10.271  12.794  -3.438
   89   1HG   GLU  11          HG2       GLU  11   8.093  13.473  -4.222
   90   2HG   GLU  11          HG1       GLU  11   7.555  11.797  -4.335
   91    H    GLY  12           HN       GLY  12  11.101  14.075  -5.455
   92   1HA   GLY  12          HA2       GLY  12  10.468  15.128  -7.889
   93   2HA   GLY  12          HA1       GLY  12   8.946  15.315  -7.015
   94    H    ARG  13           HN       ARG  13   8.731  17.112  -5.759
   95    HA   ARG  13           HA       ARG  13  11.210  18.504  -4.824
   96   1HB   ARG  13          HB2       ARG  13  10.431  19.485  -6.950
   97   2HB   ARG  13          HB1       ARG  13   8.822  19.710  -6.263
   98   1HG   ARG  13          HG2       ARG  13   9.486  21.464  -4.920
   99   2HG   ARG  13          HG1       ARG  13  11.138  20.863  -4.770
  100   1HD   ARG  13          HD2       ARG  13  10.988  21.383  -7.470
  101   2HD   ARG  13          HD1       ARG  13   9.995  22.685  -6.786
  102    HE   ARG  13           HE       ARG  13  12.647  22.115  -5.555
  103   1HH1  ARG  13          HH11      ARG  13  12.047  23.720  -8.281
  104   2HH1  ARG  13          HH12      ARG  13  12.331  25.323  -7.689
  105   1HH2  ARG  13          HH21      ARG  13  12.347  24.377  -4.355
  106   2HH2  ARG  13          HH22      ARG  13  12.502  25.694  -5.468
  107    H    ALA  14           HN       ALA  14  10.388  17.397  -2.769
  108    HA   ALA  14           HA       ALA  14   8.317  19.125  -1.457
  109   1HB   ALA  14          HB1       ALA  14   8.167  16.586  -0.291
  110   2HB   ALA  14          HB2       ALA  14   8.367  16.262  -2.013
  111   3HB   ALA  14          HB3       ALA  14   7.027  17.263  -1.454
  112    HA   PRO  15           HA       PRO  15  12.115  19.112   1.088
  113   1HB   PRO  15          HB2       PRO  15  11.846  21.702   1.923
  114   2HB   PRO  15          HB1       PRO  15  12.607  21.260   0.381
  115   1HG   PRO  15          HG2       PRO  15   9.876  22.300   0.916
  116   2HG   PRO  15          HG1       PRO  15  10.965  22.625  -0.442
  117   1HD   PRO  15          HD2       PRO  15   8.827  20.905  -0.550
  118   2HD   PRO  15          HD1       PRO  15  10.248  20.806  -1.613
  119    H    THR  16           HN       THR  16   8.869  20.354   1.819
  120    HA   THR  16           HA       THR  16   9.208  19.371   4.635
  121    HB   THR  16           HB       THR  16   7.359  21.267   4.922
  122    HG1  THR  16           HG1      THR  16   7.227  22.575   3.293
  123   1HG2  THR  16          HG21      THR  16   9.118  21.963   6.146
  124   2HG2  THR  16          HG22      THR  16   9.674  22.823   4.710
  125   3HG2  THR  16          HG23      THR  16  10.263  21.195   5.046
  126    H    GLU  17           HN       GLU  17   8.283  17.582   2.730
  127    HA   GLU  17           HA       GLU  17   5.658  17.410   1.950
  128   1HB   GLU  17          HB2       GLU  17   5.937  14.924   2.616
  129   2HB   GLU  17          HB1       GLU  17   7.138  15.605   1.519
  130   1HG   GLU  17          HG2       GLU  17   8.778  15.734   3.185
  131   2HG   GLU  17          HG1       GLU  17   7.591  15.706   4.491
  132    H    GLN  18           HN       GLN  18   4.201  18.531   3.357
  133    HA   GLN  18           HA       GLN  18   3.939  18.350   6.123
  134   1HB   GLN  18          HB2       GLN  18   2.605  19.490   4.027
  135   2HB   GLN  18          HB1       GLN  18   1.426  18.296   4.569
  136   1HG   GLN  18          HG2       GLN  18   2.494  19.498   6.904
  137   2HG   GLN  18          HG1       GLN  18   2.119  20.809   5.785
  138   1HE2  GLN  18          HE21      GLN  18   0.738  18.683   8.069
  139   2HE2  GLN  18          HE22      GLN  18  -0.892  18.921   7.660
  140    H    SER  19           HN       SER  19   2.512  16.185   3.664
  141    HA   SER  19           HA       SER  19   1.118  14.490   5.522
  142   1HB   SER  19          HB2       SER  19   1.212  12.939   3.474
  143   2HB   SER  19          HB1       SER  19   0.490  14.525   3.220
  144    HG   SER  19           HG       SER  19   1.934  14.387   1.618
  145    HA   PRO  20           HA       PRO  20   4.666  12.329   7.089
  146   1HB   PRO  20          HB2       PRO  20   3.291  10.399   8.459
  147   2HB   PRO  20          HB1       PRO  20   3.464  12.064   9.047
  148   1HG   PRO  20          HG2       PRO  20   1.156  10.763   7.697
  149   2HG   PRO  20          HG1       PRO  20   1.175  11.950   9.010
  150   1HD   PRO  20          HD2       PRO  20   0.640  12.574   6.402
  151   2HD   PRO  20          HD1       PRO  20   1.315  13.724   7.577
  152    H    GLY  21           HN       GLY  21   4.592   9.501   7.476
  153   1HA   GLY  21          HA2       GLY  21   4.150   8.516   4.685
  154   2HA   GLY  21          HA1       GLY  21   5.595   8.090   5.602
  155    H    VAL  22           HN       VAL  22   4.630   7.443   8.068
  156    HA   VAL  22           HA       VAL  22   3.083   4.972   7.483
  157    HB   VAL  22           HB       VAL  22   5.309   5.073   8.718
  158   1HG1  VAL  22          HG11      VAL  22   4.643   7.151  10.008
  159   2HG1  VAL  22          HG12      VAL  22   5.326   5.859  10.995
  160   3HG1  VAL  22          HG13      VAL  22   3.583   6.126  10.974
  161   1HG2  VAL  22          HG21      VAL  22   3.147   3.963  10.500
  162   2HG2  VAL  22          HG22      VAL  22   4.725   3.273  10.117
  163   3HG2  VAL  22          HG23      VAL  22   3.440   3.260   8.908
  164    H    GLN  23           HN       GLN  23   1.183   4.449   8.704
  165    HA   GLN  23           HA       GLN  23   0.026   5.871  10.818
  166   1HB   GLN  23          HB2       GLN  23  -1.644   7.238   9.362
  167   2HB   GLN  23          HB1       GLN  23  -0.008   7.869   9.543
  168   1HG   GLN  23          HG2       GLN  23   0.352   7.709   7.325
  169   2HG   GLN  23          HG1       GLN  23  -0.109   6.006   7.335
  170   1HE2  GLN  23          HE21      GLN  23  -0.952   8.859   5.895
  171   2HE2  GLN  23          HE22      GLN  23  -2.604   8.576   5.632
  172    H    ASP  24           HN       ASP  24  -1.182   4.118  11.461
  173    HA   ASP  24           HA       ASP  24  -2.457   2.317   9.546
  174   1HB   ASP  24          HB2       ASP  24  -2.868   2.514  12.540
  175   2HB   ASP  24          HB1       ASP  24  -2.999   1.077  11.524
  176    H    CYS  25           HN       CYS  25  -3.963   3.753   8.440
  177    HA   CYS  25           HA       CYS  25  -6.534   3.986   9.828
  178   1HB   CYS  25          HB2       CYS  25  -6.363   6.149  10.438
  179   2HB   CYS  25          HB1       CYS  25  -4.664   6.075   9.996
  180    H    TYR  26           HN       TYR  26  -8.256   4.213   8.357
  181    HA   TYR  26           HA       TYR  26  -7.646   4.678   5.489
  182   1HB   TYR  26          HB2       TYR  26  -8.474   2.526   4.824
  183   2HB   TYR  26          HB1       TYR  26  -7.341   2.220   6.140
  184    HD1  TYR  26           HD1      TYR  26 -10.955   2.622   5.332
  185    HD2  TYR  26           HD2      TYR  26  -8.055   1.217   8.171
  186    HE1  TYR  26           HE1      TYR  26 -12.759   1.520   6.628
  187    HE2  TYR  26           HE2      TYR  26  -9.859   0.113   9.468
  188    HH   TYR  26           HH       TYR  26 -12.304  -0.818   8.787
  189    H    HIS  27           HN       HIS  27  -9.733   4.848   4.226
  190    HA   HIS  27           HA       HIS  27 -11.941   5.832   6.002
  191   1HB   HIS  27          HB2       HIS  27 -10.655   7.448   4.534
  192   2HB   HIS  27          HB1       HIS  27 -11.302   6.587   3.136
  193    HD1  HIS  27           HD1      HIS  27 -12.531   8.936   2.602
  194    HD2  HIS  27           HD2      HIS  27 -13.868   6.915   5.995
  195    HE1  HIS  27           HE1      HIS  27 -14.771   9.952   3.205
  196    H    GLY  28           HN       GLY  28 -13.987   4.976   5.683
  197   1HA   GLY  28          HA2       GLY  28 -15.692   3.638   4.781
  198   2HA   GLY  28          HA1       GLY  28 -14.848   3.729   3.236
  199    H    ASP  29           HN       ASP  29 -13.298   2.112   2.724
  200    HA   ASP  29           HA       ASP  29 -13.158  -0.208   4.599
  201   1HB   ASP  29          HB2       ASP  29 -14.106   0.005   1.780
  202   2HB   ASP  29          HB1       ASP  29 -13.274  -1.473   2.265
  203    H    GLY  30           HN       GLY  30 -11.351   2.082   3.405
  204   1HA   GLY  30          HA2       GLY  30  -9.034   2.219   3.020
  205   2HA   GLY  30          HA1       GLY  30  -8.927   0.494   3.392
  206    H    GLN  31           HN       GLN  31 -11.334   0.646   1.173
  207    HA   GLN  31           HA       GLN  31  -9.822  -0.552  -0.934
  208   1HB   GLN  31          HB2       GLN  31 -12.517   0.186  -0.296
  209   2HB   GLN  31          HB1       GLN  31 -12.173   0.731  -1.939
  210   1HG   GLN  31          HG2       GLN  31 -11.441  -1.496  -2.581
  211   2HG   GLN  31          HG1       GLN  31 -11.605  -2.067  -0.921
  212   1HE2  GLN  31          HE21      GLN  31 -13.874  -2.069  -0.006
  213   2HE2  GLN  31          HE22      GLN  31 -15.184  -2.255  -1.068
  214    H    SER  32           HN       SER  32 -10.753   2.816  -0.332
  215    HA   SER  32           HA       SER  32  -9.540   3.701  -2.886
  216   1HB   SER  32          HB2       SER  32 -10.678   5.707  -2.430
  217   2HB   SER  32          HB1       SER  32 -11.719   4.513  -1.660
  218    HG   SER  32           HG       SER  32 -10.287   6.536  -0.564
  219    H    TYR  33           HN       TYR  33  -7.998   2.550  -0.463
  220    HA   TYR  33           HA       TYR  33  -6.525   4.560   0.878
  221   1HB   TYR  33          HB2       TYR  33  -6.565   2.065   1.271
  222   2HB   TYR  33          HB1       TYR  33  -5.513   1.884  -0.134
  223    HD1  TYR  33           HD1      TYR  33  -5.591   2.357   3.373
  224    HD2  TYR  33           HD2      TYR  33  -3.355   3.419  -0.137
  225    HE1  TYR  33           HE1      TYR  33  -3.628   2.894   4.788
  226    HE2  TYR  33           HE2      TYR  33  -1.391   3.954   1.279
  227    HH   TYR  33           HH       TYR  33  -1.577   4.356   4.604
  228    H    ARG  34           HN       ARG  34  -4.695   5.766   0.315
  229    HA   ARG  34           HA       ARG  34  -3.761   5.526  -2.529
  230   1HB   ARG  34          HB2       ARG  34  -5.168   7.531  -1.906
  231   2HB   ARG  34          HB1       ARG  34  -3.898   7.998  -0.774
  232   1HG   ARG  34          HG2       ARG  34  -2.690   8.913  -2.436
  233   2HG   ARG  34          HG1       ARG  34  -2.732   7.401  -3.344
  234   1HD   ARG  34          HD2       ARG  34  -5.244   9.009  -3.340
  235   2HD   ARG  34          HD1       ARG  34  -3.884   9.643  -4.288
  236    HE   ARG  34           HE       ARG  34  -3.826   7.506  -5.513
  237   1HH1  ARG  34          HH11      ARG  34  -6.726   8.650  -5.499
  238   2HH1  ARG  34          HH12      ARG  34  -7.623   7.183  -5.287
  239   1HH2  ARG  34          HH21      ARG  34  -4.864   5.325  -4.310
  240   2HH2  ARG  34          HH22      ARG  34  -6.569   5.301  -4.614
  241    H    GLY  35           HN       GLY  35  -1.982   4.134  -1.865
  242   1HA   GLY  35          HA2       GLY  35   0.498   5.206  -1.494
  243   2HA   GLY  35          HA1       GLY  35  -0.097   5.106   0.163
  244    H    SER  36           HN       SER  36   2.124   3.616  -0.609
  245    HA   SER  36           HA       SER  36   1.189   0.854  -1.159
  246   1HB   SER  36          HB2       SER  36   3.962   1.986  -0.681
  247   2HB   SER  36          HB1       SER  36   3.576   0.426  -1.402
  248    HG   SER  36           HG       SER  36   3.975   2.557  -2.714
  249    H    PHE  37           HN       PHE  37   0.047   1.263   1.155
  250    HA   PHE  37           HA       PHE  37   1.685   1.101   3.524
  251   1HB   PHE  37          HB2       PHE  37  -0.772   1.792   3.205
  252   2HB   PHE  37          HB1       PHE  37  -1.132   0.066   3.184
  253    HD1  PHE  37           HD1      PHE  37  -1.380  -1.118   5.202
  254    HD2  PHE  37           HD2      PHE  37   0.607   2.690   5.212
  255    HE1  PHE  37           HE1      PHE  37  -1.297  -1.167   7.680
  256    HE2  PHE  37           HE2      PHE  37   0.690   2.640   7.690
  257    HZ   PHE  37           HZ       PHE  37  -0.262   0.711   8.925
  258    H    SER  38           HN       SER  38   2.968  -0.725   2.058
  259    HA   SER  38           HA       SER  38   1.991  -3.411   2.097
  260   1HB   SER  38          HB2       SER  38   4.374  -3.906   1.711
  261   2HB   SER  38          HB1       SER  38   3.859  -2.515   0.760
  262    HG   SER  38           HG       SER  38   5.156  -1.295   1.879
  263    H    THR  39           HN       THR  39   1.360  -2.405   4.709
  264    HA   THR  39           HA       THR  39   3.310  -3.895   6.429
  265    HB   THR  39           HB       THR  39   1.390  -1.637   7.100
  266    HG1  THR  39           HG1      THR  39   3.112  -0.962   5.798
  267   1HG2  THR  39          HG21      THR  39   3.407  -3.217   8.682
  268   2HG2  THR  39          HG22      THR  39   1.739  -2.823   9.101
  269   3HG2  THR  39          HG23      THR  39   2.980  -1.571   9.153
  270    H    THR  40           HN       THR  40   2.462  -5.791   7.211
  271    HA   THR  40           HA       THR  40  -0.380  -6.402   6.887
  272    HB   THR  40           HB       THR  40   0.339  -8.597   7.716
  273    HG1  THR  40           HG1      THR  40   1.695  -8.108   9.350
  274   1HG2  THR  40          HG21      THR  40   1.326  -9.018   5.736
  275   2HG2  THR  40          HG22      THR  40   2.768  -8.120   6.209
  276   3HG2  THR  40          HG23      THR  40   1.406  -7.276   5.472
  277    H    VAL  41           HN       VAL  41  -1.688  -7.218   8.743
  278    HA   VAL  41           HA       VAL  41  -2.042  -5.376  10.824
  279    HB   VAL  41           HB       VAL  41  -2.624  -8.334  10.549
  280   1HG1  VAL  41          HG11      VAL  41  -4.163  -8.100  12.444
  281   2HG1  VAL  41          HG12      VAL  41  -3.685  -6.415  12.648
  282   3HG1  VAL  41          HG13      VAL  41  -2.522  -7.705  12.955
  283   1HG2  VAL  41          HG21      VAL  41  -4.087  -5.753  10.043
  284   2HG2  VAL  41          HG22      VAL  41  -4.996  -7.224  10.386
  285   3HG2  VAL  41          HG23      VAL  41  -3.921  -7.158   8.990
  286    H    THR  42           HN       THR  42   0.066  -8.230  10.725
  287    HA   THR  42           HA       THR  42   0.804  -8.060  13.547
  288    HB   THR  42           HB       THR  42   2.155  -9.481  11.231
  289    HG1  THR  42           HG1      THR  42   0.083 -10.165  11.210
  290   1HG2  THR  42          HG21      THR  42   3.206  -9.263  13.618
  291   2HG2  THR  42          HG22      THR  42   3.166 -10.844  12.837
  292   3HG2  THR  42          HG23      THR  42   1.974 -10.440  14.073
  293    H    GLY  43           HN       GLY  43   1.688  -6.324  10.751
  294   1HA   GLY  43          HA2       GLY  43   3.166  -4.423  10.800
  295   2HA   GLY  43          HA1       GLY  43   3.971  -5.117  12.208
  296    H    ARG  44           HN       ARG  44   3.444  -7.486   9.868
  297    HA   ARG  44           HA       ARG  44   6.289  -7.742   9.312
  298   1HB   ARG  44          HB2       ARG  44   4.074  -9.370   9.374
  299   2HB   ARG  44          HB1       ARG  44   4.342  -9.197   7.639
  300   1HG   ARG  44          HG2       ARG  44   5.885 -10.837   7.889
  301   2HG   ARG  44          HG1       ARG  44   6.902  -9.584   8.600
  302   1HD   ARG  44          HD2       ARG  44   6.935 -11.070  10.370
  303   2HD   ARG  44          HD1       ARG  44   5.410 -10.254  10.771
  304    HE   ARG  44           HE       ARG  44   4.563 -12.154   9.007
  305   1HH1  ARG  44          HH11      ARG  44   7.030 -13.740   9.666
  306   2HH1  ARG  44          HH12      ARG  44   6.484 -14.720  10.985
  307   1HH2  ARG  44          HH21      ARG  44   3.681 -12.779  11.615
  308   2HH2  ARG  44          HH22      ARG  44   4.588 -14.176  12.087
  309    H    THR  45           HN       THR  45   6.523  -8.374   6.685
  310    HA   THR  45           HA       THR  45   5.879  -5.800   5.292
  311    HB   THR  45           HB       THR  45   8.096  -7.847   5.103
  312    HG1  THR  45           HG1      THR  45   8.723  -5.210   5.142
  313   1HG2  THR  45          HG21      THR  45   7.760  -7.418   2.827
  314   2HG2  THR  45          HG22      THR  45   8.934  -6.180   3.271
  315   3HG2  THR  45          HG23      THR  45   7.228  -5.762   3.118
  316    H    CYS  46           HN       CYS  46   4.373  -5.962   3.664
  317    HA   CYS  46           HA       CYS  46   3.109  -8.356   2.883
  318   1HB   CYS  46          HB2       CYS  46   2.002  -6.290   2.532
  319   2HB   CYS  46          HB1       CYS  46   3.385  -5.605   1.680
  320    H    GLN  47           HN       GLN  47   3.408  -9.732   1.086
  321    HA   GLN  47           HA       GLN  47   6.114  -9.704  -0.109
  322   1HB   GLN  47          HB2       GLN  47   5.369 -11.806   0.711
  323   2HB   GLN  47          HB1       GLN  47   3.773 -11.614  -0.011
  324   1HG   GLN  47          HG2       GLN  47   5.010 -13.173  -1.381
  325   2HG   GLN  47          HG1       GLN  47   4.888 -11.659  -2.277
  326   1HE2  GLN  47          HE21      GLN  47   7.088 -14.027  -1.446
  327   2HE2  GLN  47          HE22      GLN  47   8.519 -13.119  -1.540
  328    H    SER  48           HN       SER  48   6.468  -9.103  -2.250
  329    HA   SER  48           HA       SER  48   4.836  -7.553  -3.830
  330   1HB   SER  48          HB2       SER  48   7.159  -9.264  -4.136
  331   2HB   SER  48          HB1       SER  48   6.185  -9.262  -5.603
  332    HG   SER  48           HG       SER  48   7.228  -7.025  -4.197
  333    H    TRP  49           HN       TRP  49   2.928  -7.912  -4.972
  334    HA   TRP  49           HA       TRP  49   1.420 -10.301  -4.761
  335   1HB   TRP  49          HB2       TRP  49   1.497  -8.225  -6.982
  336   2HB   TRP  49          HB1       TRP  49   0.176  -9.353  -6.696
  337    HD1  TRP  49           HD1      TRP  49   1.493  -6.029  -5.646
  338    HE1  TRP  49           HE1      TRP  49  -0.018  -5.038  -3.826
  339    HE3  TRP  49           HE3      TRP  49  -1.312 -10.084  -4.507
  340    HZ2  TRP  49           HZ2      TRP  49  -2.122  -5.843  -2.098
  341    HZ3  TRP  49           HZ3      TRP  49  -3.076  -9.977  -2.768
  342    HH2  TRP  49           HH2      TRP  49  -3.487  -7.850  -1.556
  343    H    SER  50           HN       SER  50   3.860  -9.229  -7.035
  344    HA   SER  50           HA       SER  50   3.639 -11.491  -8.858
  345   1HB   SER  50          HB2       SER  50   4.381  -9.107  -9.316
  346   2HB   SER  50          HB1       SER  50   5.872  -9.486  -8.460
  347    HG   SER  50           HG       SER  50   5.765 -11.416 -10.044
  348    H    SER  51           HN       SER  51   4.306 -11.968  -5.864
  349    HA   SER  51           HA       SER  51   7.039 -13.076  -5.993
  350   1HB   SER  51          HB2       SER  51   4.894 -13.035  -3.843
  351   2HB   SER  51          HB1       SER  51   6.558 -13.562  -3.601
  352    HG   SER  51           HG       SER  51   7.240 -11.532  -3.781
  353    H    MET  52           HN       MET  52   7.387 -15.169  -6.598
  354    HA   MET  52           HA       MET  52   5.065 -17.085  -6.544
  355   1HB   MET  52          HB2       MET  52   7.336 -16.535  -8.431
  356   2HB   MET  52          HB1       MET  52   6.502 -18.087  -8.452
  357   1HG   MET  52          HG2       MET  52   5.155 -16.939  -9.912
  358   2HG   MET  52          HG1       MET  52   4.366 -16.493  -8.404
  359   1HE   MET  52          HE1       MET  52   4.507 -13.659 -11.125
  360   2HE   MET  52          HE2       MET  52   3.382 -14.264  -9.910
  361   3HE   MET  52          HE3       MET  52   4.152 -15.389 -11.026
  362    H    THR  53           HN       THR  53   7.832 -16.421  -4.861
  363    HA   THR  53           HA       THR  53   9.110 -19.055  -4.903
  364    HB   THR  53           HB       THR  53   9.994 -17.641  -2.670
  365    HG1  THR  53           HG1      THR  53   9.824 -15.723  -4.669
  366   1HG2  THR  53          HG21      THR  53  10.914 -17.526  -5.555
  367   2HG2  THR  53          HG22      THR  53  11.423 -18.699  -4.341
  368   3HG2  THR  53          HG23      THR  53  11.876 -17.002  -4.173
  369    HA   PRO  54           HA       PRO  54   7.306 -19.571  -0.545
  370   1HB   PRO  54          HB2       PRO  54   5.772 -17.564   0.517
  371   2HB   PRO  54          HB1       PRO  54   7.536 -17.635   0.703
  372   1HG   PRO  54          HG2       PRO  54   5.896 -16.001  -1.168
  373   2HG   PRO  54          HG1       PRO  54   7.371 -15.574  -0.290
  374   1HD   PRO  54          HD2       PRO  54   7.337 -16.242  -2.932
  375   2HD   PRO  54          HD1       PRO  54   8.738 -16.501  -1.870
  376    H    HIS  55           HN       HIS  55   4.648 -17.348  -1.080
  377    HA   HIS  55           HA       HIS  55   2.928 -19.668  -1.882
  378   1HB   HIS  55          HB2       HIS  55   1.574 -17.191  -1.084
  379   2HB   HIS  55          HB1       HIS  55   1.382 -18.816  -0.438
  380    HD1  HIS  55           HD1      HIS  55   3.655 -15.791  -0.110
  381    HD2  HIS  55           HD2      HIS  55   2.639 -19.224   2.025
  382    HE1  HIS  55           HE1      HIS  55   4.804 -15.603   2.133
  383    H    TRP  56           HN       TRP  56   3.382 -19.485  -4.182
  384    HA   TRP  56           HA       TRP  56   3.437 -17.153  -5.728
  385   1HB   TRP  56          HB2       TRP  56   3.887 -19.477  -6.524
  386   2HB   TRP  56          HB1       TRP  56   2.161 -19.830  -6.422
  387    HD1  TRP  56           HD1      TRP  56   0.814 -17.481  -7.701
  388    HE1  TRP  56           HE1      TRP  56   1.154 -16.767 -10.099
  389    HE3  TRP  56           HE3      TRP  56   5.251 -19.760  -8.660
  390    HZ2  TRP  56           HZ2      TRP  56   3.002 -17.129 -12.218
  391    HZ3  TRP  56           HZ3      TRP  56   6.279 -19.540 -10.908
  392    HH2  TRP  56           HH2      TRP  56   5.164 -18.247 -12.688
  393    H    HIS  57           HN       HIS  57   1.888 -15.692  -6.416
  394    HA   HIS  57           HA       HIS  57  -0.917 -16.183  -5.502
  395   1HB   HIS  57          HB2       HIS  57  -0.931 -13.980  -4.878
  396   2HB   HIS  57          HB1       HIS  57   0.820 -14.146  -4.943
  397    HD1  HIS  57           HD1      HIS  57   1.183 -14.145  -8.036
  398    HD2  HIS  57           HD2      HIS  57  -1.215 -11.427  -5.974
  399    HE1  HIS  57           HE1      HIS  57   0.942 -12.118  -9.536
  400    H    GLN  58           HN       GLN  58  -2.606 -15.131  -6.973
  401    HA   GLN  58           HA       GLN  58  -1.785 -15.250  -9.854
  402   1HB   GLN  58          HB2       GLN  58  -3.992 -16.654  -8.349
  403   2HB   GLN  58          HB1       GLN  58  -4.140 -16.358 -10.082
  404   1HG   GLN  58          HG2       GLN  58  -1.643 -17.618  -8.967
  405   2HG   GLN  58          HG1       GLN  58  -3.071 -18.603  -9.288
  406   1HE2  GLN  58          HE21      GLN  58  -4.061 -17.404 -11.635
  407   2HE2  GLN  58          HE22      GLN  58  -2.920 -17.572 -12.882
  408    H    ARG  59           HN       ARG  59  -1.957 -12.816  -8.633
  409    HA   ARG  59           HA       ARG  59  -4.339 -11.622  -9.921
  410   1HB   ARG  59          HB2       ARG  59  -3.988 -12.094  -7.048
  411   2HB   ARG  59          HB1       ARG  59  -4.317 -10.402  -7.422
  412   1HG   ARG  59          HG2       ARG  59  -6.494 -10.956  -7.599
  413   2HG   ARG  59          HG1       ARG  59  -6.072 -11.850  -9.060
  414   1HD   ARG  59          HD2       ARG  59  -5.589 -13.862  -7.671
  415   2HD   ARG  59          HD1       ARG  59  -6.106 -12.962  -6.231
  416    HE   ARG  59           HE       ARG  59  -8.087 -12.804  -8.339
  417   1HH1  ARG  59          HH11      ARG  59  -7.321 -15.768  -7.871
  418   2HH1  ARG  59          HH12      ARG  59  -8.544 -16.227  -6.734
  419   1HH2  ARG  59          HH21      ARG  59  -9.450 -12.964  -5.988
  420   2HH2  ARG  59          HH22      ARG  59  -9.749 -14.640  -5.667
  421    H    THR  60           HN       THR  60  -1.414 -11.523 -10.321
  422    HA   THR  60           HA       THR  60  -0.039  -9.322  -9.293
  423    HB   THR  60           HB       THR  60   1.012 -10.788 -10.857
  424    HG1  THR  60           HG1      THR  60   1.912  -8.909 -11.307
  425   1HG2  THR  60          HG21      THR  60  -1.359 -10.112 -12.578
  426   2HG2  THR  60          HG22      THR  60  -0.781 -11.702 -12.082
  427   3HG2  THR  60          HG23      THR  60   0.114 -10.776 -13.286
  428    H    THR  61           HN       THR  61   0.448  -7.313 -10.740
  429    HA   THR  61           HA       THR  61  -2.013  -5.767 -10.977
  430    HB   THR  61           HB       THR  61  -0.025  -4.238 -12.041
  431    HG1  THR  61           HG1      THR  61   1.901  -4.858 -11.214
  432   1HG2  THR  61          HG21      THR  61   0.226  -3.323  -9.827
  433   2HG2  THR  61          HG22      THR  61  -0.282  -4.843  -9.089
  434   3HG2  THR  61          HG23      THR  61  -1.443  -3.869  -9.992
  435    H    GLU  62           HN       GLU  62  -0.245  -7.899 -12.990
  436    HA   GLU  62           HA       GLU  62  -0.668  -6.676 -15.538
  437   1HB   GLU  62          HB2       GLU  62   0.919  -8.493 -15.208
  438   2HB   GLU  62          HB1       GLU  62  -0.362  -9.546 -14.608
  439   1HG   GLU  62          HG2       GLU  62  -0.649 -10.265 -16.724
  440   2HG   GLU  62          HG1       GLU  62  -1.276  -8.662 -17.109
  441    H    TYR  63           HN       TYR  63  -2.603  -8.508 -13.325
  442    HA   TYR  63           HA       TYR  63  -4.790  -8.874 -15.260
  443   1HB   TYR  63          HB2       TYR  63  -3.868 -10.322 -13.156
  444   2HB   TYR  63          HB1       TYR  63  -5.135  -9.392 -12.354
  445    HD1  TYR  63           HD1      TYR  63  -7.215 -10.423 -12.268
  446    HD2  TYR  63           HD2      TYR  63  -4.671 -11.127 -15.655
  447    HE1  TYR  63           HE1      TYR  63  -8.936 -11.915 -13.249
  448    HE2  TYR  63           HE2      TYR  63  -6.391 -12.619 -16.637
  449    HH   TYR  63           HH       TYR  63  -8.305 -13.747 -16.211
  450    H    TYR  64           HN       TYR  64  -3.611  -6.419 -13.308
  451    HA   TYR  64           HA       TYR  64  -6.279  -5.063 -13.285
  452   1HB   TYR  64          HB2       TYR  64  -4.492  -5.844 -11.039
  453   2HB   TYR  64          HB1       TYR  64  -5.201  -4.232 -10.940
  454    HD1  TYR  64           HD1      TYR  64  -7.667  -3.938 -10.956
  455    HD2  TYR  64           HD2      TYR  64  -5.847  -7.827 -10.831
  456    HE1  TYR  64           HE1      TYR  64  -9.827  -4.927 -10.244
  457    HE2  TYR  64           HE2      TYR  64  -8.007  -8.815 -10.119
  458    HH   TYR  64           HH       TYR  64 -10.236  -7.594  -8.786
  459    HA   PRO  65           HA       PRO  65  -3.159  -2.250 -15.018
  460   1HB   PRO  65          HB2       PRO  65  -4.932  -0.873 -16.580
  461   2HB   PRO  65          HB1       PRO  65  -4.202  -2.413 -17.076
  462   1HG   PRO  65          HG2       PRO  65  -6.913  -1.867 -15.990
  463   2HG   PRO  65          HG1       PRO  65  -6.403  -3.026 -17.226
  464   1HD   PRO  65          HD2       PRO  65  -6.963  -3.694 -14.625
  465   2HD   PRO  65          HD1       PRO  65  -5.891  -4.631 -15.688
  466    H    ASN  66           HN       ASN  66  -5.867  -1.862 -13.007
  467    HA   ASN  66           HA       ASN  66  -5.001   0.921 -12.331
  468   1HB   ASN  66          HB2       ASN  66  -7.748  -0.148 -12.997
  469   2HB   ASN  66          HB1       ASN  66  -7.544   1.327 -12.052
  470   1HD2  ASN  66          HD21      ASN  66  -8.232   2.840 -13.664
  471   2HD2  ASN  66          HD22      ASN  66  -7.407   3.064 -15.130
  472    H    GLY  67           HN       GLY  67  -4.213  -1.342 -10.875
  473   1HA   GLY  67          HA2       GLY  67  -6.103  -1.615  -8.612
  474   2HA   GLY  67          HA1       GLY  67  -4.616  -2.540  -8.832
  475    H    GLY  68           HN       GLY  68  -2.680  -0.679  -9.105
  476   1HA   GLY  68          HA2       GLY  68  -1.616   1.204  -8.067
  477   2HA   GLY  68          HA1       GLY  68  -2.982   1.332  -6.956
  478    H    LEU  69           HN       LEU  69  -2.033  -1.877  -7.248
  479    HA   LEU  69           HA       LEU  69  -0.437  -1.685  -4.719
  480   1HB   LEU  69          HB2       LEU  69  -1.382  -3.970  -4.328
  481   2HB   LEU  69          HB1       LEU  69  -2.612  -2.735  -4.490
  482    HG   LEU  69           HG       LEU  69  -1.983  -3.750  -7.093
  483   1HD1  LEU  69          HD11      LEU  69  -2.568  -5.785  -4.931
  484   2HD1  LEU  69          HD12      LEU  69  -1.265  -5.811  -6.118
  485   3HD1  LEU  69          HD13      LEU  69  -2.930  -6.083  -6.631
  486   1HD2  LEU  69          HD21      LEU  69  -4.406  -4.231  -7.081
  487   2HD2  LEU  69          HD22      LEU  69  -4.081  -2.637  -6.400
  488   3HD2  LEU  69          HD23      LEU  69  -4.447  -3.993  -5.334
  489    H    THR  70           HN       THR  70   0.428  -1.652  -7.613
  490    HA   THR  70           HA       THR  70   1.565  -4.029  -8.546
  491    HB   THR  70           HB       THR  70   1.593  -1.805  -9.661
  492    HG1  THR  70           HG1      THR  70   3.294  -2.408 -10.737
  493   1HG2  THR  70          HG21      THR  70   3.610  -1.217  -7.486
  494   2HG2  THR  70          HG22      THR  70   2.129  -0.334  -7.857
  495   3HG2  THR  70          HG23      THR  70   3.500  -0.260  -8.964
  496    H    ARG  71           HN       ARG  71   3.558  -5.111  -8.141
  497    HA   ARG  71           HA       ARG  71   5.476  -5.763  -6.916
  498   1HB   ARG  71          HB2       ARG  71   5.722  -3.165  -7.097
  499   2HB   ARG  71          HB1       ARG  71   5.239  -3.169  -5.401
  500   1HG   ARG  71          HG2       ARG  71   7.102  -5.104  -5.301
  501   2HG   ARG  71          HG1       ARG  71   7.742  -4.180  -6.660
  502   1HD   ARG  71          HD2       ARG  71   7.260  -2.116  -5.038
  503   2HD   ARG  71          HD1       ARG  71   7.449  -3.366  -3.793
  504    HE   ARG  71           HE       ARG  71   9.633  -3.948  -5.039
  505   1HH1  ARG  71          HH21      ARG  71   8.460  -0.874  -4.203
  506   2HH1  ARG  71          HH22      ARG  71   9.799  -0.005  -4.876
  507   1HH2  ARG  71          HH11      ARG  71  11.255  -2.817  -6.291
  508   2HH2  ARG  71          HH12      ARG  71  11.382  -1.105  -6.057
  509    H    ASN  72           HN       ASN  72   5.458  -4.389  -4.004
  510    HA   ASN  72           HA       ASN  72   3.806  -6.565  -2.794
  511   1HB   ASN  72          HB2       ASN  72   5.300  -6.337  -0.945
  512   2HB   ASN  72          HB1       ASN  72   6.316  -6.177  -2.379
  513   1HD2  ASN  72          HD21      ASN  72   4.399  -4.092  -0.142
  514   2HD2  ASN  72          HD22      ASN  72   5.481  -2.786  -0.187
  515    H    TYR  73           HN       TYR  73   3.230  -3.478  -3.690
  516    HA   TYR  73           HA       TYR  73   2.466  -1.970  -1.455
  517   1HB   TYR  73          HB2       TYR  73   1.265  -2.372  -4.204
  518   2HB   TYR  73          HB1       TYR  73   0.612  -1.178  -3.086
  519    HD1  TYR  73           HD1      TYR  73   1.269   0.466  -4.954
  520    HD2  TYR  73           HD2      TYR  73   4.138  -1.776  -2.673
  521    HE1  TYR  73           HE1      TYR  73   3.048   2.060  -5.622
  522    HE2  TYR  73           HE2      TYR  73   5.915  -0.182  -3.341
  523    HH   TYR  73           HH       TYR  73   5.371   2.786  -4.521
  524    H    CYS  74           HN       CYS  74   0.485  -1.791  -0.296
  525    HA   CYS  74           HA       CYS  74  -1.045  -4.348  -0.073
  526   1HB   CYS  74          HB2       CYS  74   0.138  -3.486   1.908
  527   2HB   CYS  74          HB1       CYS  74  -0.717  -1.950   1.761
  528    H    ARG  75           HN       ARG  75  -3.055  -4.348  -0.972
  529    HA   ARG  75           HA       ARG  75  -4.597  -1.780  -1.052
  530   1HB   ARG  75          HB2       ARG  75  -3.498  -3.436  -3.172
  531   2HB   ARG  75          HB1       ARG  75  -5.243  -3.279  -3.338
  532   1HG   ARG  75          HG2       ARG  75  -3.850  -1.453  -4.488
  533   2HG   ARG  75          HG1       ARG  75  -5.125  -0.889  -3.414
  534   1HD   ARG  75          HD2       ARG  75  -3.581  -0.346  -1.681
  535   2HD   ARG  75          HD1       ARG  75  -2.280  -1.277  -2.450
  536    HE   ARG  75           HE       ARG  75  -1.951   0.519  -3.971
  537   1HH1  ARG  75          HH21      ARG  75  -2.722   2.402  -1.832
  538   2HH1  ARG  75          HH22      ARG  75  -4.013   3.303  -2.554
  539   1HH2  ARG  75          HH11      ARG  75  -4.566   0.991  -5.080
  540   2HH2  ARG  75          HH12      ARG  75  -5.057   2.504  -4.394
  541    H    ASN  76           HN       ASN  76  -6.991  -2.316  -1.581
  542    HA   ASN  76           HA       ASN  76  -7.758  -4.889  -0.238
  543   1HB   ASN  76          HB2       ASN  76  -8.076  -2.642   0.969
  544   2HB   ASN  76          HB1       ASN  76  -9.311  -2.293  -0.241
  545   1HD2  ASN  76          HD21      ASN  76 -10.771  -2.331   1.788
  546   2HD2  ASN  76          HD22      ASN  76 -11.381  -3.837   2.280
  547    HA   PRO  77           HA       PRO  77  -9.594  -4.582  -4.517
  548   1HB   PRO  77          HB2       PRO  77  -8.658  -6.993  -5.417
  549   2HB   PRO  77          HB1       PRO  77  -7.744  -5.479  -5.577
  550   1HG   PRO  77          HG2       PRO  77  -7.427  -7.682  -3.604
  551   2HG   PRO  77          HG1       PRO  77  -6.195  -6.692  -4.400
  552   1HD   PRO  77          HD2       PRO  77  -7.033  -6.297  -1.827
  553   2HD   PRO  77          HD1       PRO  77  -6.363  -5.013  -2.857
  554    H    ASP  78           HN       ASP  78 -11.095  -5.113  -2.309
  555    HA   ASP  78           HA       ASP  78 -12.777  -7.357  -3.184
  556   1HB   ASP  78          HB2       ASP  78 -10.884  -7.456  -0.898
  557   2HB   ASP  78          HB1       ASP  78 -12.505  -8.071  -0.569
  558    H    ALA  79           HN       ALA  79 -12.680  -6.326   0.158
  559    HA   ALA  79           HA       ALA  79 -14.191  -3.997   0.222
  560   1HB   ALA  79          HB1       ALA  79 -15.711  -6.431  -0.584
  561   2HB   ALA  79          HB2       ALA  79 -15.973  -4.747  -1.036
  562   3HB   ALA  79          HB3       ALA  79 -16.511  -5.331   0.539
  563    H    GLU  80           HN       GLU  80 -12.380  -5.441   1.911
  564    HA   GLU  80           HA       GLU  80 -13.999  -6.364   4.227
  565   1HB   GLU  80          HB2       GLU  80 -10.995  -6.133   4.093
  566   2HB   GLU  80          HB1       GLU  80 -11.969  -7.302   4.983
  567   1HG   GLU  80          HG2       GLU  80 -11.668  -7.162   1.971
  568   2HG   GLU  80          HG1       GLU  80 -10.941  -8.369   3.032
  569    H    ILE  81           HN       ILE  81 -12.512  -5.569   6.362
  570    HA   ILE  81           HA       ILE  81 -13.291  -2.869   6.847
  571    HB   ILE  81           HB       ILE  81 -11.661  -3.166   8.779
  572   1HG1  ILE  81          HG12      ILE  81 -11.205  -5.927   8.594
  573   2HG1  ILE  81          HG11      ILE  81 -10.772  -5.285   7.010
  574   1HG2  ILE  81          HG21      ILE  81 -13.790  -3.851   9.379
  575   2HG2  ILE  81          HG22      ILE  81 -12.925  -5.381   9.528
  576   3HG2  ILE  81          HG23      ILE  81 -13.880  -5.045   8.084
  577   1HD1  ILE  81          HD11      ILE  81  -8.789  -4.783   8.004
  578   2HD1  ILE  81          HD12      ILE  81  -9.475  -4.866   9.627
  579   3HD1  ILE  81          HD13      ILE  81  -9.671  -3.404   8.660
  580    H    SER  82           HN       SER  82 -10.384  -4.286   5.494
  581    HA   SER  82           HA       SER  82  -9.467  -1.678   4.519
  582   1HB   SER  82          HB2       SER  82  -7.964  -1.245   6.162
  583   2HB   SER  82          HB1       SER  82  -8.754  -2.513   7.095
  584    HG   SER  82           HG       SER  82  -6.303  -2.514   6.299
  585    HA   PRO  83           HA       PRO  83  -7.241  -4.147   1.655
  586   1HB   PRO  83          HB2       PRO  83  -4.696  -3.149   1.594
  587   2HB   PRO  83          HB1       PRO  83  -6.092  -2.281   0.925
  588   1HG   PRO  83          HG2       PRO  83  -4.676  -1.881   3.506
  589   2HG   PRO  83          HG1       PRO  83  -5.386  -0.687   2.409
  590   1HD   PRO  83          HD2       PRO  83  -6.573  -1.534   4.726
  591   2HD   PRO  83          HD1       PRO  83  -7.465  -0.889   3.331
  592    H    TRP  84           HN       TRP  84  -5.641  -5.842   1.361
  593    HA   TRP  84           HA       TRP  84  -4.344  -6.794   3.893
  594   1HB   TRP  84          HB2       TRP  84  -4.968  -9.121   2.792
  595   2HB   TRP  84          HB1       TRP  84  -6.183  -8.229   3.705
  596    HD1  TRP  84           HD1      TRP  84  -7.834  -6.607   2.174
  597    HE1  TRP  84           HE1      TRP  84  -8.829  -7.075  -0.157
  598    HE3  TRP  84           HE3      TRP  84  -4.666 -10.285   0.581
  599    HZ2  TRP  84           HZ2      TRP  84  -8.346  -8.781  -2.399
  600    HZ3  TRP  84           HZ3      TRP  84  -4.960 -11.311  -1.656
  601    HH2  TRP  84           HH2      TRP  84  -6.794 -10.566  -3.146
  602    H    CYS  85           HN       CYS  85  -2.737  -8.737   3.142
  603    HA   CYS  85           HA       CYS  85  -1.585  -8.406   0.478
  604   1HB   CYS  85          HB2       CYS  85  -1.007  -6.476   2.394
  605   2HB   CYS  85          HB1       CYS  85   0.390  -7.550   2.460
  606    H    TYR  86           HN       TYR  86   0.015  -9.986   0.059
  607    HA   TYR  86           HA       TYR  86   0.062 -12.320   1.768
  608   1HB   TYR  86          HB2       TYR  86   1.957 -11.546  -0.474
  609   2HB   TYR  86          HB1       TYR  86   1.524 -13.175   0.041
  610    HD1  TYR  86           HD1      TYR  86   1.250 -12.187  -2.803
  611    HD2  TYR  86           HD2      TYR  86  -1.498 -12.132   0.499
  612    HE1  TYR  86           HE1      TYR  86  -0.656 -12.196  -4.385
  613    HE2  TYR  86           HE2      TYR  86  -3.402 -12.143  -1.084
  614    HH   TYR  86           HH       TYR  86  -3.239 -13.031  -4.150
  615    H    THR  87           HN       THR  87   2.191 -13.202   2.662
  616    HA   THR  87           HA       THR  87   3.735 -10.960   3.900
  617    HB   THR  87           HB       THR  87   4.467 -13.177   5.250
  618    HG1  THR  87           HG1      THR  87   3.338 -14.752   4.452
  619   1HG2  THR  87          HG21      THR  87   3.253 -12.233   6.904
  620   2HG2  THR  87          HG22      THR  87   1.749 -12.363   5.992
  621   3HG2  THR  87          HG23      THR  87   2.840 -11.006   5.706
  622    H    MET  88           HN       MET  88   5.891 -10.716   3.434
  623    HA   MET  88           HA       MET  88   7.132 -12.066   1.242
  624   1HB   MET  88          HB2       MET  88   9.158 -10.874   2.134
  625   2HB   MET  88          HB1       MET  88   7.743  -9.834   1.981
  626   1HG   MET  88          HG2       MET  88   7.679  -9.447   4.202
  627   2HG   MET  88          HG1       MET  88   7.821 -11.165   4.571
  628   1HE   MET  88          HE1       MET  88   8.629  -9.895   6.458
  629   2HE   MET  88          HE2       MET  88   9.898  -8.674   6.404
  630   3HE   MET  88          HE3       MET  88  10.300 -10.332   6.843
  631    H    ASP  89           HN       ASP  89   6.514 -13.312   4.337
  632    HA   ASP  89           HA       ASP  89   8.906 -15.095   4.196
  633   1HB   ASP  89          HB2       ASP  89   7.452 -13.668   6.315
  634   2HB   ASP  89          HB1       ASP  89   7.753 -15.363   6.700
  635    HA   PRO  90           HA       PRO  90   6.092 -18.348   3.237
  636   1HB   PRO  90          HB2       PRO  90   7.698 -20.446   3.980
  637   2HB   PRO  90          HB1       PRO  90   7.939 -19.525   2.480
  638   1HG   PRO  90          HG2       PRO  90   9.347 -19.276   5.099
  639   2HG   PRO  90          HG1       PRO  90  10.007 -19.217   3.455
  640   1HD   PRO  90          HD2       PRO  90   9.563 -16.982   4.921
  641   2HD   PRO  90          HD1       PRO  90   9.405 -17.008   3.149
  642    H    ASN  91           HN       ASN  91   7.145 -17.465   6.322
  643    HA   ASN  91           HA       ASN  91   5.888 -19.633   7.838
  644   1HB   ASN  91          HB2       ASN  91   7.428 -17.152   8.271
  645   2HB   ASN  91          HB1       ASN  91   6.228 -17.473   9.524
  646   1HD2  ASN  91          HD21      ASN  91   8.269 -19.737   7.594
  647   2HD2  ASN  91          HD22      ASN  91   8.971 -20.487   8.945
  648    H    VAL  92           HN       VAL  92   4.886 -16.742   6.262
  649    HA   VAL  92           HA       VAL  92   2.235 -16.879   7.655
  650    HB   VAL  92           HB       VAL  92   3.737 -14.480   6.537
  651   1HG1  VAL  92          HG11      VAL  92   1.136 -14.767   8.084
  652   2HG1  VAL  92          HG12      VAL  92   1.331 -14.147   6.444
  653   3HG1  VAL  92          HG13      VAL  92   1.954 -13.228   7.814
  654   1HG2  VAL  92          HG21      VAL  92   3.179 -14.544   9.409
  655   2HG2  VAL  92          HG22      VAL  92   4.699 -14.231   8.572
  656   3HG2  VAL  92          HG23      VAL  92   4.202 -15.890   8.906
  657    H    ARG  93           HN       ARG  93   0.458 -16.939   6.255
  658    HA   ARG  93           HA       ARG  93   0.984 -17.323   3.413
  659   1HB   ARG  93          HB2       ARG  93  -0.580 -18.703   4.815
  660   2HB   ARG  93          HB1       ARG  93  -1.612 -17.281   4.974
  661   1HG   ARG  93          HG2       ARG  93  -2.553 -18.455   3.154
  662   2HG   ARG  93          HG1       ARG  93  -1.570 -17.208   2.387
  663   1HD   ARG  93          HD2       ARG  93  -0.223 -18.756   1.419
  664   2HD   ARG  93          HD1       ARG  93  -0.025 -19.632   2.951
  665    HE   ARG  93           HE       ARG  93  -2.382 -19.964   1.135
  666   1HH1  ARG  93          HH11      ARG  93   0.152 -21.777   1.959
  667   2HH1  ARG  93          HH12      ARG  93  -0.705 -23.019   2.810
  668   1HH2  ARG  93          HH21      ARG  93  -3.676 -21.237   2.953
  669   2HH2  ARG  93          HH22      ARG  93  -2.872 -22.712   3.373
  670    H    TRP  94           HN       TRP  94  -1.315 -15.291   5.237
  671    HA   TRP  94           HA       TRP  94  -0.662 -12.925   3.612
  672   1HB   TRP  94          HB2       TRP  94  -2.855 -12.777   2.591
  673   2HB   TRP  94          HB1       TRP  94  -2.235 -14.395   2.263
  674    HD1  TRP  94           HD1      TRP  94  -3.510 -16.417   3.255
  675    HE1  TRP  94           HE1      TRP  94  -5.680 -16.670   4.623
  676    HE3  TRP  94           HE3      TRP  94  -4.350 -11.534   4.490
  677    HZ2  TRP  94           HZ2      TRP  94  -7.528 -15.021   6.052
  678    HZ3  TRP  94           HZ3      TRP  94  -6.320 -10.904   5.855
  679    HH2  TRP  94           HH2      TRP  94  -7.909 -12.639   6.636
  680    H    GLU  95           HN       GLU  95  -1.934 -11.008   4.450
  681    HA   GLU  95           HA       GLU  95  -3.433 -11.383   6.954
  682   1HB   GLU  95          HB2       GLU  95  -0.932 -11.600   7.439
  683   2HB   GLU  95          HB1       GLU  95  -0.794  -9.899   6.994
  684   1HG   GLU  95          HG2       GLU  95  -1.091  -9.805   9.324
  685   2HG   GLU  95          HG1       GLU  95  -2.721  -9.533   8.708
  686    H    TYR  96           HN       TYR  96  -4.463  -9.404   7.627
  687    HA   TYR  96           HA       TYR  96  -5.087  -7.554   5.511
  688   1HB   TYR  96          HB2       TYR  96  -5.639  -7.920   8.423
  689   2HB   TYR  96          HB1       TYR  96  -5.948  -6.321   7.746
  690    HD1  TYR  96           HD1      TYR  96  -7.153  -6.419   5.324
  691    HD2  TYR  96           HD2      TYR  96  -7.401  -9.436   8.371
  692    HE1  TYR  96           HE1      TYR  96  -9.272  -7.244   4.334
  693    HE2  TYR  96           HE2      TYR  96  -9.520 -10.261   7.382
  694    HH   TYR  96           HH       TYR  96 -11.381  -9.267   5.932
  695    H    CYS  97           HN       CYS  97  -4.890  -5.032   6.264
  696    HA   CYS  97           HA       CYS  97  -1.969  -4.613   6.787
  697   1HB   CYS  97          HB2       CYS  97  -3.886  -3.675   4.832
  698   2HB   CYS  97          HB1       CYS  97  -3.149  -2.311   5.672
  699    H    ASN  98           HN       ASN  98  -1.358  -3.214   8.420
  700    HA   ASN  98           HA       ASN  98  -3.012  -2.655  10.633
  701   1HB   ASN  98          HB2       ASN  98  -0.478  -1.525   9.479
  702   2HB   ASN  98          HB1       ASN  98  -1.197  -0.745  10.888
  703   1HD2  ASN  98          HD21      ASN  98   1.315  -2.029  11.142
  704   2HD2  ASN  98          HD22      ASN  98   1.132  -3.420  12.097
  705    H    LEU  99           HN       LEU  99  -5.049  -1.828   9.625
  706    HA   LEU  99           HA       LEU  99  -4.880   1.121   9.191
  707   1HB   LEU  99          HB2       LEU  99  -6.149  -0.968   7.402
  708   2HB   LEU  99          HB1       LEU  99  -6.461   0.761   7.242
  709    HG   LEU  99           HG       LEU  99  -3.674  -0.416   7.203
  710   1HD1  LEU  99          HD11      LEU  99  -3.854   0.016   4.703
  711   2HD1  LEU  99          HD12      LEU  99  -5.595   0.177   4.938
  712   3HD1  LEU  99          HD13      LEU  99  -4.795  -1.353   5.297
  713   1HD2  LEU  99          HD21      LEU  99  -4.806   2.247   6.281
  714   2HD2  LEU  99          HD22      LEU  99  -3.110   1.766   6.218
  715   3HD2  LEU  99          HD23      LEU  99  -3.905   1.990   7.776
  716    H    THR 100           HN       THR 100  -6.550   2.203  10.145
  717    HA   THR 100           HA       THR 100  -8.864   0.620  11.197
  718    HB   THR 100           HB       THR 100  -8.785   2.275  13.069
  719    HG1  THR 100           HG1      THR 100  -6.291   3.026  11.983
  720   1HG2  THR 100          HG21      THR 100  -6.027   1.140  12.866
  721   2HG2  THR 100          HG22      THR 100  -7.397   0.030  12.862
  722   3HG2  THR 100          HG23      THR 100  -7.147   1.118  14.228
  723    H    GLN 101           HN       GLN 101 -10.884   1.893  11.324
  724    HA   GLN 101           HA       GLN 101 -11.473   3.413   8.995
  725   1HB   GLN 101          HB2       GLN 101 -12.754   2.441  11.359
  726   2HB   GLN 101          HB1       GLN 101 -13.198   4.137  11.164
  727   1HG   GLN 101          HG2       GLN 101 -13.776   3.645   8.769
  728   2HG   GLN 101          HG1       GLN 101 -13.495   1.935   9.102
  729   1HE2  GLN 101          HE21      GLN 101 -15.583   1.039   9.168
  730   2HE2  GLN 101          HE22      GLN 101 -16.850   1.635  10.127
  731    H    CYS 102           HN       CYS 102  -9.809   5.061   8.828
  732    HA   CYS 102           HA       CYS 102  -8.942   6.911  10.701
  733   1HB   CYS 102          HB2       CYS 102  -8.733   6.520   8.004
  734   2HB   CYS 102          HB1       CYS 102  -9.664   8.017   8.050
  735    HA   PRO 103           HA       PRO 103 -12.556   9.148  11.863
  736   1HB   PRO 103          HB2       PRO 103 -11.350  11.406  12.836
  737   2HB   PRO 103          HB1       PRO 103 -11.352   9.858  13.708
  738   1HG   PRO 103          HG2       PRO 103  -9.207  11.096  12.054
  739   2HG   PRO 103          HG1       PRO 103  -9.081  10.193  13.572
  740   1HD   PRO 103          HD2       PRO 103  -8.526   9.109  11.137
  741   2HD   PRO 103          HD1       PRO 103  -9.119   8.158  12.517
  742    H    VAL 104           HN       VAL 104 -13.875  10.180  10.415
  743    HA   VAL 104           HA       VAL 104 -13.137  11.413   8.014
  744    HB   VAL 104           HB       VAL 104 -15.405  10.843   8.380
  745   1HG1  VAL 104          HG11      VAL 104 -15.901  10.711  10.603
  746   2HG1  VAL 104          HG12      VAL 104 -16.525  12.343  10.360
  747   3HG1  VAL 104          HG13      VAL 104 -14.902  12.107  11.008
  748   1HG2  VAL 104          HG21      VAL 104 -16.651  12.939   8.093
  749   2HG2  VAL 104          HG22      VAL 104 -15.148  12.999   7.173
  750   3HG2  VAL 104          HG23      VAL 104 -15.277  13.857   8.709
  751    H    THR 105           HN       THR 105 -13.501  13.837   7.527
  752    HA   THR 105           HA       THR 105 -11.891  15.420   9.473
  753    HB   THR 105           HB       THR 105 -11.318  15.125   7.006
  754    HG1  THR 105           HG1      THR 105 -11.248  17.608   6.809
  755   1HG2  THR 105          HG21      THR 105 -14.028  15.906   6.747
  756   2HG2  THR 105          HG22      THR 105 -12.876  15.581   5.452
  757   3HG2  THR 105          HG23      THR 105 -13.060  17.219   6.079
  758    H    GLU 106           HN       GLU 106 -14.630  14.944  10.190
  759    HA   GLU 106           HA       GLU 106 -16.651  16.091  10.685
  760   1HB   GLU 106          HB2       GLU 106 -14.352  18.023  10.962
  761   2HB   GLU 106          HB1       GLU 106 -15.996  18.531  11.352
  762   1HG   GLU 106          HG2       GLU 106 -16.056  17.294  13.255
  763   2HG   GLU 106          HG1       GLU 106 -15.246  15.923  12.496
  764    H    SER 107           HN       SER 107 -17.464  18.701  10.155
  765    HA   SER 107           HA       SER 107 -18.194  18.546   7.348
  766   1HB   SER 107          HB2       SER 107 -19.787  19.473   8.822
  767   2HB   SER 107          HB1       SER 107 -18.583  20.459   9.647
  768    HG   SER 107           HG       SER 107 -18.714  21.920   8.106
  769    H    SER 108           HN       SER 108 -18.030  21.093   6.372
  770    HA   SER 108           HA       SER 108 -15.451  22.360   6.719
  771   1HB   SER 108          HB2       SER 108 -15.739  20.040   4.949
  772   2HB   SER 108          HB1       SER 108 -15.073  21.446   4.124
  773    HG   SER 108           HG       SER 108 -13.832  19.791   5.743
  774    H    VAL 109           HN       VAL 109 -15.372  24.315   5.532
  775    HA   VAL 109           HA       VAL 109 -17.908  25.082   4.194
  776    HB   VAL 109           HB       VAL 109 -15.449  26.684   4.970
  777   1HG1  VAL 109          HG11      VAL 109 -17.994  27.310   3.645
  778   2HG1  VAL 109          HG12      VAL 109 -16.511  28.260   3.731
  779   3HG1  VAL 109          HG13      VAL 109 -17.676  28.323   5.053
  780   1HG2  VAL 109          HG21      VAL 109 -17.880  27.013   6.568
  781   2HG2  VAL 109          HG22      VAL 109 -16.220  26.749   7.099
  782   3HG2  VAL 109          HG23      VAL 109 -17.233  25.375   6.656
  783    H    LEU 110           HN       LEU 110 -14.425  24.826   3.517
  784    HA   LEU 110           HA       LEU 110 -15.030  25.336   0.622
  785   1HB   LEU 110          HB2       LEU 110 -13.375  26.698   2.328
  786   2HB   LEU 110          HB1       LEU 110 -12.253  25.537   1.618
  787    HG   LEU 110           HG       LEU 110 -12.253  27.507   0.217
  788   1HD1  LEU 110          HD11      LEU 110 -13.253  26.526  -1.911
  789   2HD1  LEU 110          HD12      LEU 110 -13.847  25.196  -0.917
  790   3HD1  LEU 110          HD13      LEU 110 -12.113  25.482  -1.061
  791   1HD2  LEU 110          HD21      LEU 110 -14.660  27.897  -0.923
  792   2HD2  LEU 110          HD22      LEU 110 -14.176  28.730   0.554
  793   3HD2  LEU 110          HD23      LEU 110 -15.197  27.295   0.646
  794    H    ALA 111           HN       ALA 111 -15.575  22.839   0.957
  795    HA   ALA 111           HA       ALA 111 -13.086  21.195   0.803
  796   1HB   ALA 111          HB1       ALA 111 -14.452  19.426   1.539
  797   2HB   ALA 111          HB2       ALA 111 -15.919  20.175   0.908
  798   3HB   ALA 111          HB3       ALA 111 -15.156  20.818   2.362
  799    H    THR 112           HN       THR 112 -12.501  20.282  -1.142
  800    HA   THR 112           HA       THR 112 -14.528  20.075  -3.318
  801    HB   THR 112           HB       THR 112 -13.432  22.269  -3.514
  802    HG1  THR 112           HG1      THR 112 -12.060  20.931  -5.482
  803   1HG2  THR 112          HG21      THR 112 -11.224  20.918  -2.483
  804   2HG2  THR 112          HG22      THR 112 -11.245  22.582  -3.066
  805   3HG2  THR 112          HG23      THR 112 -10.767  21.274  -4.148
  806    H    SER 113           HN       SER 113 -14.182  18.256  -4.589
  807    HA   SER 113           HA       SER 113 -12.436  16.177  -3.735
  808   1HB   SER 113          HB2       SER 113 -14.054  16.826  -6.180
  809   2HB   SER 113          HB1       SER 113 -12.994  15.420  -6.203
  810    HG   SER 113           HG       SER 113 -15.097  15.999  -4.384
  811    H    THR 114           HN       THR 114 -10.554  15.296  -4.918
  812    HA   THR 114           HA       THR 114  -8.816  17.467  -5.968
  813    HB   THR 114           HB       THR 114  -7.968  14.624  -5.521
  814    HG1  THR 114           HG1      THR 114  -8.913  16.443  -3.614
  815   1HG2  THR 114          HG21      THR 114  -6.755  17.345  -4.971
  816   2HG2  THR 114          HG22      THR 114  -6.311  16.239  -6.270
  817   3HG2  THR 114          HG23      THR 114  -5.975  15.809  -4.593
  818    H    ALA 115           HN       ALA 115  -7.973  17.419  -8.072
  819    HA   ALA 115           HA       ALA 115  -9.176  15.391  -9.916
  820   1HB   ALA 115          HB1       ALA 115  -7.874  18.037 -10.598
  821   2HB   ALA 115          HB2       ALA 115  -9.566  17.920 -10.116
  822   3HB   ALA 115          HB3       ALA 115  -9.007  17.105 -11.577
  823    H    VAL 116           HN       VAL 116  -7.654  15.029 -11.916
  824    HA   VAL 116           HA       VAL 116  -5.104  13.990 -10.904
  825    HB   VAL 116           HB       VAL 116  -6.499  14.058 -13.596
  826   1HG1  VAL 116          HG11      VAL 116  -4.791  12.343 -14.258
  827   2HG1  VAL 116          HG12      VAL 116  -3.915  12.701 -12.770
  828   3HG1  VAL 116          HG13      VAL 116  -4.104  13.947 -14.003
  829   1HG2  VAL 116          HG21      VAL 116  -7.638  12.337 -12.685
  830   2HG2  VAL 116          HG22      VAL 116  -6.635  12.382 -11.234
  831   3HG2  VAL 116          HG23      VAL 116  -6.121  11.437 -12.632
  832    H    SER 117           HN       SER 117  -3.386  15.386 -10.703
  833    HA   SER 117           HA       SER 117  -3.089  17.560 -12.750
  834   1HB   SER 117          HB2       SER 117  -3.296  18.644 -10.707
  835   2HB   SER 117          HB1       SER 117  -2.595  17.301  -9.809
  836    HG   SER 117           HG       SER 117  -1.393  19.455 -11.036
  837    H    GLU 118           HN       GLU 118  -0.984  17.874 -13.650
  838    HA   GLU 118           HA       GLU 118   1.328  16.325 -12.828
  839   1HB   GLU 118          HB2       GLU 118  -0.196  14.598 -13.823
  840   2HB   GLU 118          HB1       GLU 118  -0.139  15.483 -15.348
  841   1HG   GLU 118          HG2       GLU 118   2.512  15.272 -14.842
  842   2HG   GLU 118          HG1       GLU 118   1.938  13.798 -14.061
  843    H    GLN 119           HN       GLN 119  -0.334  18.109 -15.406
  844    HA   GLN 119           HA       GLN 119   2.191  19.592 -15.941
  845   1HB   GLN 119          HB2       GLN 119   0.949  17.549 -17.603
  846   2HB   GLN 119          HB1       GLN 119   1.056  19.087 -18.460
  847   1HG   GLN 119          HG2       GLN 119   3.359  17.712 -17.041
  848   2HG   GLN 119          HG1       GLN 119   3.101  17.727 -18.786
  849   1HE2  GLN 119          HE21      GLN 119   3.610  19.671 -19.950
  850   2HE2  GLN 119          HE22      GLN 119   4.347  21.011 -19.214
  Start of MODEL   12
    1   1H    ALA   1          HT1       ALA   1  28.140  10.131  18.268
    2   2H    ALA   1          HT2       ALA   1  26.573  10.709  18.579
    3   3H    ALA   1          HT3       ALA   1  27.823  11.796  18.201
    4    HA   ALA   1           HA       ALA   1  27.233   9.710  16.231
    5   1HB   ALA   1          HB1       ALA   1  25.500  11.823  15.648
    6   2HB   ALA   1          HB2       ALA   1  25.315  11.585  17.386
    7   3HB   ALA   1          HB3       ALA   1  25.031  10.244  16.277
    8    H    ARG   2           HN       ARG   2  29.579  10.537  15.975
    9    HA   ARG   2           HA       ARG   2  30.014  13.270  15.085
   10   1HB   ARG   2          HB2       ARG   2  31.599  10.690  14.887
   11   2HB   ARG   2          HB1       ARG   2  32.244  12.275  14.456
   12   1HG   ARG   2          HG2       ARG   2  32.826  12.509  16.622
   13   2HG   ARG   2          HG1       ARG   2  31.105  12.658  16.978
   14   1HD   ARG   2          HD2       ARG   2  31.421   9.918  16.744
   15   2HD   ARG   2          HD1       ARG   2  32.923  10.423  17.542
   16    HE   ARG   2           HE       ARG   2  30.203  11.182  18.544
   17   1HH1  ARG   2          HH21      ARG   2  31.565   8.916  19.906
   18   2HH1  ARG   2          HH22      ARG   2  32.396   9.703  21.205
   19   1HH2  ARG   2          HH11      ARG   2  32.131  12.867  19.813
   20   2HH2  ARG   2          HH12      ARG   2  32.717  11.938  21.152
   21    H    ILE   3           HN       ILE   3  30.106  10.133  13.347
   22    HA   ILE   3           HA       ILE   3  29.173  11.577  10.891
   23    HB   ILE   3           HB       ILE   3  30.794  10.118   9.655
   24   1HG1  ILE   3          HG12      ILE   3  31.856   9.447  12.413
   25   2HG1  ILE   3          HG11      ILE   3  30.828   8.356  11.483
   26   1HG2  ILE   3          HG21      ILE   3  32.280  11.586  11.826
   27   2HG2  ILE   3          HG22      ILE   3  31.300  12.468  10.655
   28   3HG2  ILE   3          HG23      ILE   3  32.657  11.484  10.107
   29   1HD1  ILE   3          HD11      ILE   3  33.375   8.027  11.266
   30   2HD1  ILE   3          HD12      ILE   3  33.361   9.516  10.320
   31   3HD1  ILE   3          HD13      ILE   3  32.447   8.113   9.768
   32    H    HIS   4           HN       HIS   4  27.846   9.772  12.974
   33    HA   HIS   4           HA       HIS   4  27.257   7.312  11.446
   34   1HB   HIS   4          HB2       HIS   4  27.584   7.302  13.893
   35   2HB   HIS   4          HB1       HIS   4  26.239   8.427  14.081
   36    HD1  HIS   4           HD1      HIS   4  24.656   6.832  15.314
   37    HD2  HIS   4           HD2      HIS   4  26.007   5.292  11.682
   38    HE1  HIS   4           HE1      HIS   4  23.272   4.761  14.854
   39    H    HIS   5           HN       HIS   5  25.316   9.984  12.854
   40    HA   HIS   5           HA       HIS   5  22.859   9.356  11.594
   41   1HB   HIS   5          HB2       HIS   5  23.687  11.139  13.398
   42   2HB   HIS   5          HB1       HIS   5  23.713  12.198  11.989
   43    HD1  HIS   5           HD1      HIS   5  21.592  13.517  12.075
   44    HD2  HIS   5           HD2      HIS   5  20.943   9.496  12.964
   45    HE1  HIS   5           HE1      HIS   5  19.087  13.232  12.319
   46    H    HIS   6           HN       HIS   6  21.855  10.901   9.866
   47    HA   HIS   6           HA       HIS   6  21.880  11.760   7.661
   48   1HB   HIS   6          HB2       HIS   6  23.777  13.064   8.905
   49   2HB   HIS   6          HB1       HIS   6  24.864  12.036   7.972
   50    HD1  HIS   6           HD1      HIS   6  25.232  12.638   5.551
   51    HD2  HIS   6           HD2      HIS   6  22.007  14.693   7.210
   52    HE1  HIS   6           HE1      HIS   6  24.497  14.335   3.820
   53    H    HIS   7           HN       HIS   7  21.821  10.549   5.800
   54    HA   HIS   7           HA       HIS   7  23.045   7.940   5.665
   55   1HB   HIS   7          HB2       HIS   7  21.933   7.852   3.538
   56   2HB   HIS   7          HB1       HIS   7  20.898   8.813   4.593
   57    HD1  HIS   7           HD1      HIS   7  23.031   9.031   1.548
   58    HD2  HIS   7           HD2      HIS   7  20.942  11.648   4.032
   59    HE1  HIS   7           HE1      HIS   7  22.919  11.244   0.323
   60    H    HIS   8           HN       HIS   8  25.071   7.416   4.944
   61    HA   HIS   8           HA       HIS   8  26.490   9.300   3.111
   62   1HB   HIS   8          HB2       HIS   8  26.998   9.653   5.594
   63   2HB   HIS   8          HB1       HIS   8  27.737   8.052   5.573
   64    HD1  HIS   8           HD1      HIS   8  28.213  11.552   4.312
   65    HD2  HIS   8           HD2      HIS   8  30.179   7.882   4.109
   66    HE1  HIS   8           HE1      HIS   8  30.516  12.025   3.372
   67    H    HIS   9           HN       HIS   9  25.252   6.420   3.151
   68    HA   HIS   9           HA       HIS   9  27.314   5.215   1.466
   69   1HB   HIS   9          HB2       HIS   9  27.752   4.928   4.102
   70   2HB   HIS   9          HB1       HIS   9  26.638   3.580   3.871
   71    HD1  HIS   9           HD1      HIS   9  27.617   1.476   2.921
   72    HD2  HIS   9           HD2      HIS   9  30.068   4.777   2.231
   73    HE1  HIS   9           HE1      HIS   9  29.742   0.583   1.870
   74    H    ILE  10           HN       ILE  10  24.385   5.902   1.445
   75    HA   ILE  10           HA       ILE  10  23.300   3.155   0.897
   76    HB   ILE  10           HB       ILE  10  22.011   5.682   1.970
   77   1HG1  ILE  10          HG12      ILE  10  21.430   3.429   3.551
   78   2HG1  ILE  10          HG11      ILE  10  23.138   3.273   3.138
   79   1HG2  ILE  10          HG21      ILE  10  19.910   4.389   2.010
   80   2HG2  ILE  10          HG22      ILE  10  20.723   3.040   1.218
   81   3HG2  ILE  10          HG23      ILE  10  20.507   4.565   0.361
   82   1HD1  ILE  10          HD11      ILE  10  21.802   5.687   4.396
   83   2HD1  ILE  10          HD12      ILE  10  23.486   5.637   3.873
   84   3HD1  ILE  10          HD13      ILE  10  22.936   4.587   5.180
   85    H    GLU  11           HN       GLU  11  21.889   6.319   0.173
   86    HA   GLU  11           HA       GLU  11  22.027   5.629  -2.743
   87   1HB   GLU  11          HB2       GLU  11  19.969   6.690  -0.893
   88   2HB   GLU  11          HB1       GLU  11  20.025   7.466  -2.477
   89   1HG   GLU  11          HG2       GLU  11  20.289   4.615  -2.798
   90   2HG   GLU  11          HG1       GLU  11  18.859   4.968  -1.827
   91    H    GLY  12           HN       GLY  12  21.167   8.713  -1.224
   92   1HA   GLY  12          HA2       GLY  12  23.422  10.224  -1.215
   93   2HA   GLY  12          HA1       GLY  12  23.119  10.082  -2.947
   94    H    ARG  13           HN       ARG  13  22.876  12.509  -2.690
   95    HA   ARG  13           HA       ARG  13  20.133  13.225  -1.710
   96   1HB   ARG  13          HB2       ARG  13  21.076  15.435  -1.339
   97   2HB   ARG  13          HB1       ARG  13  22.169  14.248  -0.625
   98   1HG   ARG  13          HG2       ARG  13  23.224  14.338  -3.093
   99   2HG   ARG  13          HG1       ARG  13  22.548  15.966  -3.029
  100   1HD   ARG  13          HD2       ARG  13  23.709  16.212  -0.755
  101   2HD   ARG  13          HD1       ARG  13  24.597  14.733  -1.171
  102    HE   ARG  13           HE       ARG  13  24.635  17.207  -2.861
  103   1HH1  ARG  13          HH11      ARG  13  26.622  15.546  -0.844
  104   2HH1  ARG  13          HH12      ARG  13  27.853  15.185  -2.008
  105   1HH2  ARG  13          HH21      ARG  13  25.956  16.205  -4.724
  106   2HH2  ARG  13          HH22      ARG  13  27.476  15.559  -4.205
  107    H    ALA  14           HN       ALA  14  19.531  15.447  -3.013
  108    HA   ALA  14           HA       ALA  14  20.082  15.013  -5.922
  109   1HB   ALA  14          HB1       ALA  14  17.399  15.755  -5.734
  110   2HB   ALA  14          HB2       ALA  14  17.618  14.628  -4.394
  111   3HB   ALA  14          HB3       ALA  14  17.998  14.125  -6.041
  112    HA   PRO  15           HA       PRO  15  20.251  19.390  -6.147
  113   1HB   PRO  15          HB2       PRO  15  18.970  19.939  -8.503
  114   2HB   PRO  15          HB1       PRO  15  20.579  19.193  -8.427
  115   1HG   PRO  15          HG2       PRO  15  17.931  17.933  -8.921
  116   2HG   PRO  15          HG1       PRO  15  19.511  17.558  -9.624
  117   1HD   PRO  15          HD2       PRO  15  18.337  16.094  -7.629
  118   2HD   PRO  15          HD1       PRO  15  20.091  16.174  -7.905
  119    H    THR  16           HN       THR  16  17.180  19.263  -7.874
  120    HA   THR  16           HA       THR  16  15.910  20.699  -5.570
  121    HB   THR  16           HB       THR  16  15.052  20.787  -8.465
  122    HG1  THR  16           HG1      THR  16  16.514  22.346  -8.828
  123   1HG2  THR  16          HG21      THR  16  13.835  21.760  -6.283
  124   2HG2  THR  16          HG22      THR  16  13.796  22.603  -7.832
  125   3HG2  THR  16          HG23      THR  16  14.945  23.097  -6.588
  126    H    GLU  17           HN       GLU  17  14.652  18.969  -8.445
  127    HA   GLU  17           HA       GLU  17  12.320  18.000  -7.174
  128   1HB   GLU  17          HB2       GLU  17  13.307  18.120  -9.688
  129   2HB   GLU  17          HB1       GLU  17  13.573  16.409  -9.349
  130   1HG   GLU  17          HG2       GLU  17  11.399  16.361 -10.181
  131   2HG   GLU  17          HG1       GLU  17  11.096  16.510  -8.450
  132    H    GLN  18           HN       GLN  18  12.461  16.723  -5.338
  133    HA   GLN  18           HA       GLN  18  14.567  14.693  -5.115
  134   1HB   GLN  18          HB2       GLN  18  13.588  14.514  -2.794
  135   2HB   GLN  18          HB1       GLN  18  14.146  16.132  -3.217
  136   1HG   GLN  18          HG2       GLN  18  11.971  16.952  -3.508
  137   2HG   GLN  18          HG1       GLN  18  11.293  15.340  -3.746
  138   1HE2  GLN  18          HE21      GLN  18  12.983  17.250  -1.188
  139   2HE2  GLN  18          HE22      GLN  18  12.111  16.570   0.100
  140    H    SER  19           HN       SER  19  11.263  14.932  -6.032
  141    HA   SER  19           HA       SER  19  10.348  12.313  -5.236
  142   1HB   SER  19          HB2       SER  19   8.439  12.929  -6.459
  143   2HB   SER  19          HB1       SER  19   9.127  14.496  -6.040
  144    HG   SER  19           HG       SER  19   9.539  14.831  -8.074
  145    HA   PRO  20           HA       PRO  20  12.401   9.877  -8.281
  146   1HB   PRO  20          HB2       PRO  20  10.715   7.721  -8.299
  147   2HB   PRO  20          HB1       PRO  20  11.854   8.046  -6.977
  148   1HG   PRO  20          HG2       PRO  20   8.929   8.568  -7.125
  149   2HG   PRO  20          HG1       PRO  20   9.908   8.009  -5.760
  150   1HD   PRO  20          HD2       PRO  20   9.043  10.583  -6.047
  151   2HD   PRO  20          HD1       PRO  20  10.516  10.131  -5.160
  152    H    GLY  21           HN       GLY  21  11.579   8.460 -10.324
  153   1HA   GLY  21          HA2       GLY  21   9.767  10.272 -11.844
  154   2HA   GLY  21          HA1       GLY  21  10.937   9.167 -12.568
  155    H    VAL  22           HN       VAL  22   8.595   8.433 -10.001
  156    HA   VAL  22           HA       VAL  22   7.018   6.781 -11.915
  157    HB   VAL  22           HB       VAL  22   8.801   5.344 -11.062
  158   1HG1  VAL  22          HG11      VAL  22   7.790   5.994  -8.283
  159   2HG1  VAL  22          HG12      VAL  22   9.195   6.776  -9.008
  160   3HG1  VAL  22          HG13      VAL  22   9.209   5.038  -8.710
  161   1HG2  VAL  22          HG21      VAL  22   6.730   4.316  -9.278
  162   2HG2  VAL  22          HG22      VAL  22   7.353   3.629 -10.778
  163   3HG2  VAL  22          HG23      VAL  22   6.067   4.834 -10.828
  164    H    GLN  23           HN       GLN  23   4.847   6.855 -11.384
  165    HA   GLN  23           HA       GLN  23   4.002   7.366  -8.633
  166   1HB   GLN  23          HB2       GLN  23   2.805   9.428  -9.261
  167   2HB   GLN  23          HB1       GLN  23   4.527   9.589  -9.603
  168   1HG   GLN  23          HG2       GLN  23   3.399   8.430 -11.912
  169   2HG   GLN  23          HG1       GLN  23   2.296   9.722 -11.437
  170   1HE2  GLN  23          HE21      GLN  23   5.480   9.035 -12.722
  171   2HE2  GLN  23          HE22      GLN  23   5.961  10.651 -12.924
  172    H    ASP  24           HN       ASP  24   3.081   5.188  -9.099
  173    HA   ASP  24           HA       ASP  24   1.184   4.687 -11.181
  174   1HB   ASP  24          HB2       ASP  24   2.434   3.339  -9.087
  175   2HB   ASP  24          HB1       ASP  24   0.726   3.285  -8.654
  176    H    CYS  25           HN       CYS  25  -1.154   3.856 -10.009
  177    HA   CYS  25           HA       CYS  25  -2.241   5.913  -8.242
  178   1HB   CYS  25          HB2       CYS  25  -3.310   7.242  -9.767
  179   2HB   CYS  25          HB1       CYS  25  -1.984   6.700 -10.786
  180    H    TYR  26           HN       TYR  26  -4.930   5.708  -8.836
  181    HA   TYR  26           HA       TYR  26  -5.534   2.769  -8.585
  182   1HB   TYR  26          HB2       TYR  26  -5.847   5.023  -6.716
  183   2HB   TYR  26          HB1       TYR  26  -7.292   4.031  -6.893
  184    HD1  TYR  26           HD1      TYR  26  -6.367   1.356  -7.298
  185    HD2  TYR  26           HD2      TYR  26  -4.709   4.421  -4.793
  186    HE1  TYR  26           HE1      TYR  26  -5.355  -0.378  -5.846
  187    HE2  TYR  26           HE2      TYR  26  -3.696   2.695  -3.347
  188    HH   TYR  26           HH       TYR  26  -4.425  -0.718  -3.763
  189    H    HIS  27           HN       HIS  27  -8.275   3.093  -8.133
  190    HA   HIS  27           HA       HIS  27  -9.306   4.746 -10.385
  191   1HB   HIS  27          HB2       HIS  27  -9.022   1.834 -10.251
  192   2HB   HIS  27          HB1       HIS  27 -10.688   2.323 -10.558
  193    HD1  HIS  27           HD1      HIS  27 -11.198   3.530 -12.784
  194    HD2  HIS  27           HD2      HIS  27  -7.169   2.568 -12.310
  195    HE1  HIS  27           HE1      HIS  27 -10.100   3.917 -15.034
  196    H    GLY  28           HN       GLY  28  -9.428   4.252  -7.238
  197   1HA   GLY  28          HA2       GLY  28 -11.862   5.461  -6.668
  198   2HA   GLY  28          HA1       GLY  28 -12.236   3.737  -6.727
  199    H    ASP  29           HN       ASP  29 -11.575   2.424  -5.018
  200    HA   ASP  29           HA       ASP  29  -9.919   3.708  -2.892
  201   1HB   ASP  29          HB2       ASP  29 -12.310   1.933  -2.412
  202   2HB   ASP  29          HB1       ASP  29 -11.473   2.948  -1.237
  203    H    GLY  30           HN       GLY  30  -8.870   1.992  -4.834
  204   1HA   GLY  30          HA2       GLY  30  -7.403   0.147  -4.825
  205   2HA   GLY  30          HA1       GLY  30  -7.830  -0.136  -3.135
  206    H    GLN  31           HN       GLN  31 -10.765   0.145  -4.372
  207    HA   GLN  31           HA       GLN  31 -11.056  -2.781  -4.765
  208   1HB   GLN  31          HB2       GLN  31 -13.185  -0.625  -4.724
  209   2HB   GLN  31          HB1       GLN  31 -13.378  -2.337  -4.343
  210   1HG   GLN  31          HG2       GLN  31 -11.495  -1.732  -2.530
  211   2HG   GLN  31          HG1       GLN  31 -12.245  -0.142  -2.676
  212   1HE2  GLN  31          HE21      GLN  31 -13.023  -0.549  -0.386
  213   2HE2  GLN  31          HE22      GLN  31 -14.418  -1.488  -0.156
  214    H    SER  32           HN       SER  32 -11.604   0.287  -6.441
  215    HA   SER  32           HA       SER  32 -12.543  -1.005  -8.899
  216   1HB   SER  32          HB2       SER  32 -11.553   1.829  -8.531
  217   2HB   SER  32          HB1       SER  32 -12.789   1.246  -9.642
  218    HG   SER  32           HG       SER  32 -14.213   1.253  -8.069
  219    H    TYR  33           HN       TYR  33  -9.546  -0.705  -7.415
  220    HA   TYR  33           HA       TYR  33  -7.811   0.061  -9.559
  221   1HB   TYR  33          HB2       TYR  33  -7.337  -0.256  -7.068
  222   2HB   TYR  33          HB1       TYR  33  -7.271  -1.989  -7.394
  223    HD1  TYR  33           HD1      TYR  33  -5.015  -2.643  -7.304
  224    HD2  TYR  33           HD2      TYR  33  -6.102   0.947  -9.398
  225    HE1  TYR  33           HE1      TYR  33  -2.681  -2.403  -8.107
  226    HE2  TYR  33           HE2      TYR  33  -3.769   1.187 -10.200
  227    HH   TYR  33           HH       TYR  33  -1.576   0.479  -9.704
  228    H    ARG  34           HN       ARG  34  -7.733  -0.957 -11.520
  229    HA   ARG  34           HA       ARG  34  -8.260  -3.899 -11.634
  230   1HB   ARG  34          HB2       ARG  34  -8.748  -1.522 -13.333
  231   2HB   ARG  34          HB1       ARG  34  -8.268  -2.978 -14.207
  232   1HG   ARG  34          HG2       ARG  34 -10.109  -3.911 -12.341
  233   2HG   ARG  34          HG1       ARG  34 -10.792  -2.372 -12.868
  234   1HD   ARG  34          HD2       ARG  34 -10.351  -3.154 -15.270
  235   2HD   ARG  34          HD1       ARG  34 -10.065  -4.763 -14.579
  236    HE   ARG  34           HE       ARG  34 -12.508  -3.587 -13.552
  237   1HH1  ARG  34          HH11      ARG  34 -11.162  -4.840 -16.453
  238   2HH1  ARG  34          HH12      ARG  34 -12.586  -5.720 -16.898
  239   1HH2  ARG  34          HH21      ARG  34 -14.323  -4.889 -14.014
  240   2HH2  ARG  34          HH22      ARG  34 -14.376  -5.748 -15.517
  241    H    GLY  35           HN       GLY  35  -6.263  -4.915 -11.403
  242   1HA   GLY  35          HA2       GLY  35  -4.411  -5.235 -13.369
  243   2HA   GLY  35          HA1       GLY  35  -3.853  -3.745 -12.609
  244    H    SER  36           HN       SER  36  -1.912  -4.965 -12.006
  245    HA   SER  36           HA       SER  36  -2.301  -6.434  -9.435
  246   1HB   SER  36          HB2       SER  36  -0.731  -8.171 -10.283
  247   2HB   SER  36          HB1       SER  36  -2.189  -8.078 -11.267
  248    HG   SER  36           HG       SER  36  -0.405  -8.089 -12.619
  249    H    PHE  37           HN       PHE  37  -1.480  -3.913  -9.270
  250    HA   PHE  37           HA       PHE  37   1.447  -3.691  -9.575
  251   1HB   PHE  37          HB2       PHE  37  -0.222  -1.870 -10.079
  252   2HB   PHE  37          HB1       PHE  37  -0.572  -1.792  -8.352
  253    HD1  PHE  37           HD1      PHE  37   0.314   0.300  -7.684
  254    HD2  PHE  37           HD2      PHE  37   2.704  -2.380 -10.042
  255    HE1  PHE  37           HE1      PHE  37   2.288   1.764  -7.349
  256    HE2  PHE  37           HE2      PHE  37   4.676  -0.916  -9.707
  257    HZ   PHE  37           HZ       PHE  37   4.469   1.156  -8.361
  258    H    SER  38           HN       SER  38   1.481  -5.662  -7.920
  259    HA   SER  38           HA       SER  38   0.971  -5.141  -5.139
  260   1HB   SER  38          HB2       SER  38   1.237  -7.343  -6.319
  261   2HB   SER  38          HB1       SER  38   2.965  -7.013  -6.428
  262    HG   SER  38           HG       SER  38   3.151  -7.537  -4.405
  263    H    THR  39           HN       THR  39   2.400  -2.847  -6.088
  264    HA   THR  39           HA       THR  39   5.126  -3.223  -4.916
  265    HB   THR  39           HB       THR  39   4.130  -0.871  -6.530
  266    HG1  THR  39           HG1      THR  39   5.471  -2.794  -7.922
  267   1HG2  THR  39          HG21      THR  39   6.608  -1.669  -5.362
  268   2HG2  THR  39          HG22      THR  39   6.275  -0.236  -6.335
  269   3HG2  THR  39          HG23      THR  39   6.792  -1.731  -7.115
  270    H    THR  40           HN       THR  40   5.575  -2.159  -3.005
  271    HA   THR  40           HA       THR  40   3.402  -0.611  -1.740
  272    HB   THR  40           HB       THR  40   4.919  -0.805   0.230
  273    HG1  THR  40           HG1      THR  40   6.915  -0.758  -0.619
  274   1HG2  THR  40          HG21      THR  40   4.270  -3.238  -1.423
  275   2HG2  THR  40          HG22      THR  40   3.463  -2.643   0.027
  276   3HG2  THR  40          HG23      THR  40   5.052  -3.397   0.150
  277    H    VAL  41           HN       VAL  41   3.822   1.505  -0.792
  278    HA   VAL  41           HA       VAL  41   4.800   3.494  -2.451
  279    HB   VAL  41           HB       VAL  41   4.618   3.206   0.555
  280   1HG1  VAL  41          HG11      VAL  41   5.448   5.614  -1.084
  281   2HG1  VAL  41          HG12      VAL  41   6.297   4.893   0.283
  282   3HG1  VAL  41          HG13      VAL  41   4.781   5.757   0.542
  283   1HG2  VAL  41          HG21      VAL  41   2.459   3.324  -0.279
  284   2HG2  VAL  41          HG22      VAL  41   2.938   4.288  -1.676
  285   3HG2  VAL  41          HG23      VAL  41   2.805   5.043  -0.087
  286    H    THR  42           HN       THR  42   6.636   1.858   0.154
  287    HA   THR  42           HA       THR  42   9.094   3.250  -0.189
  288    HB   THR  42           HB       THR  42   8.565   0.377   0.641
  289    HG1  THR  42           HG1      THR  42   7.565   2.455   1.676
  290   1HG2  THR  42          HG21      THR  42  10.620   0.850   2.081
  291   2HG2  THR  42          HG22      THR  42  10.878   2.273   1.073
  292   3HG2  THR  42          HG23      THR  42  10.915   0.664   0.352
  293    H    GLY  43           HN       GLY  43   7.527   0.996  -2.252
  294   1HA   GLY  43          HA2       GLY  43   8.349   0.661  -4.527
  295   2HA   GLY  43          HA1       GLY  43   9.995   0.832  -3.916
  296    H    ARG  44           HN       ARG  44   8.624  -0.968  -1.608
  297    HA   ARG  44           HA       ARG  44   9.872  -3.434  -2.485
  298   1HB   ARG  44          HB2       ARG  44   9.167  -2.270  -0.116
  299   2HB   ARG  44          HB1       ARG  44   7.884  -3.468  -0.291
  300   1HG   ARG  44          HG2       ARG  44   9.965  -5.021  -0.956
  301   2HG   ARG  44          HG1       ARG  44  10.816  -3.871   0.076
  302   1HD   ARG  44          HD2       ARG  44   8.251  -5.224   0.960
  303   2HD   ARG  44          HD1       ARG  44   9.855  -5.911   1.287
  304    HE   ARG  44           HE       ARG  44   8.727  -3.609   2.621
  305   1HH1  ARG  44          HH21      ARG  44  11.604  -5.111   1.450
  306   2HH1  ARG  44          HH22      ARG  44  12.660  -4.163   2.443
  307   1HH2  ARG  44          HH11      ARG  44  10.098  -2.299   3.853
  308   2HH2  ARG  44          HH12      ARG  44  11.807  -2.571   3.803
  309    H    THR  45           HN       THR  45   8.136  -5.425  -1.776
  310    HA   THR  45           HA       THR  45   5.851  -5.118  -3.700
  311    HB   THR  45           HB       THR  45   7.684  -7.468  -3.115
  312    HG1  THR  45           HG1      THR  45   8.765  -6.403  -4.571
  313   1HG2  THR  45          HG21      THR  45   6.365  -8.365  -5.193
  314   2HG2  THR  45          HG22      THR  45   5.131  -7.216  -4.677
  315   3HG2  THR  45          HG23      THR  45   5.645  -8.504  -3.589
  316    H    CYS  46           HN       CYS  46   3.866  -6.065  -3.018
  317    HA   CYS  46           HA       CYS  46   3.529  -6.356  -0.172
  318   1HB   CYS  46          HB2       CYS  46   1.771  -5.361  -1.420
  319   2HB   CYS  46          HB1       CYS  46   1.779  -6.663  -2.606
  320    H    GLN  47           HN       GLN  47   2.633  -8.295   0.877
  321    HA   GLN  47           HA       GLN  47   3.859 -10.781  -0.167
  322   1HB   GLN  47          HB2       GLN  47   4.301 -10.414   2.109
  323   2HB   GLN  47          HB1       GLN  47   2.688  -9.786   2.425
  324   1HG   GLN  47          HG2       GLN  47   2.836 -11.994   3.405
  325   2HG   GLN  47          HG1       GLN  47   1.792 -12.104   1.988
  326   1HE2  GLN  47          HE21      GLN  47   5.155 -12.708   3.078
  327   2HE2  GLN  47          HE22      GLN  47   5.493 -13.880   1.897
  328    H    SER  48           HN       SER  48   2.601 -12.587  -0.795
  329    HA   SER  48           HA       SER  48   0.102 -12.371  -1.964
  330   1HB   SER  48          HB2       SER  48   1.341 -14.669  -0.419
  331   2HB   SER  48          HB1       SER  48  -0.034 -14.842  -1.507
  332    HG   SER  48           HG       SER  48   1.275 -14.106  -3.191
  333    H    TRP  49           HN       TRP  49  -2.054 -12.447  -1.194
  334    HA   TRP  49           HA       TRP  49  -2.564 -11.607   1.505
  335   1HB   TRP  49          HB2       TRP  49  -4.354 -12.896  -0.583
  336   2HB   TRP  49          HB1       TRP  49  -4.921 -12.025   0.840
  337    HD1  TRP  49           HD1      TRP  49  -3.413 -11.491  -2.593
  338    HE1  TRP  49           HE1      TRP  49  -3.465  -8.988  -3.145
  339    HE3  TRP  49           HE3      TRP  49  -4.820  -9.617   1.891
  340    HZ2  TRP  49           HZ2      TRP  49  -4.015  -6.509  -1.870
  341    HZ3  TRP  49           HZ3      TRP  49  -5.108  -7.178   2.228
  342    HH2  TRP  49           HH2      TRP  49  -4.704  -5.614   0.343
  343    H    SER  50           HN       SER  50  -2.368 -14.732  -0.071
  344    HA   SER  50           HA       SER  50  -3.539 -16.258   2.125
  345   1HB   SER  50          HB2       SER  50  -3.510 -16.847  -0.323
  346   2HB   SER  50          HB1       SER  50  -1.773 -17.109  -0.190
  347    HG   SER  50           HG       SER  50  -3.768 -18.768   0.428
  348    H    SER  51           HN       SER  51  -0.895 -14.480   2.346
  349    HA   SER  51           HA       SER  51   1.221 -16.307   3.037
  350   1HB   SER  51          HB2       SER  51   1.989 -14.123   4.248
  351   2HB   SER  51          HB1       SER  51   1.824 -14.092   2.495
  352    HG   SER  51           HG       SER  51   0.490 -12.692   4.375
  353    H    MET  52           HN       MET  52   1.441 -17.465   4.910
  354    HA   MET  52           HA       MET  52  -0.257 -16.672   7.261
  355   1HB   MET  52          HB2       MET  52   0.527 -19.499   6.551
  356   2HB   MET  52          HB1       MET  52  -0.825 -18.951   7.533
  357   1HG   MET  52          HG2       MET  52  -1.190 -17.751   5.012
  358   2HG   MET  52          HG1       MET  52  -0.744 -19.425   4.689
  359   1HE   MET  52          HE1       MET  52  -4.410 -17.654   6.604
  360   2HE   MET  52          HE2       MET  52  -3.487 -17.084   5.216
  361   3HE   MET  52          HE3       MET  52  -2.757 -17.063   6.820
  362    H    THR  53           HN       THR  53   2.862 -16.910   6.148
  363    HA   THR  53           HA       THR  53   4.044 -18.086   8.591
  364    HB   THR  53           HB       THR  53   6.061 -17.041   6.980
  365    HG1  THR  53           HG1      THR  53   4.033 -18.114   5.326
  366   1HG2  THR  53          HG21      THR  53   5.043 -19.716   6.239
  367   2HG2  THR  53          HG22      THR  53   5.321 -19.470   7.963
  368   3HG2  THR  53          HG23      THR  53   6.640 -19.238   6.815
  369    HA   PRO  54           HA       PRO  54   5.787 -13.702   9.076
  370   1HB   PRO  54          HB2       PRO  54   5.239 -11.806   7.180
  371   2HB   PRO  54          HB1       PRO  54   6.631 -12.903   7.074
  372   1HG   PRO  54          HG2       PRO  54   4.005 -13.036   5.683
  373   2HG   PRO  54          HG1       PRO  54   5.624 -13.429   5.082
  374   1HD   PRO  54          HD2       PRO  54   3.803 -15.310   5.874
  375   2HD   PRO  54          HD1       PRO  54   5.564 -15.551   5.924
  376    H    HIS  55           HN       HIS  55   3.379 -12.033   7.172
  377    HA   HIS  55           HA       HIS  55   1.841 -11.479   9.671
  378   1HB   HIS  55          HB2       HIS  55   1.247 -10.088   7.103
  379   2HB   HIS  55          HB1       HIS  55   1.413  -9.420   8.726
  380    HD1  HIS  55           HD1      HIS  55   3.427 -10.472   5.733
  381    HD2  HIS  55           HD2      HIS  55   4.058  -8.639   9.422
  382    HE1  HIS  55           HE1      HIS  55   5.818  -9.667   5.727
  383    H    TRP  56           HN       TRP  56   0.749 -13.600   9.597
  384    HA   TRP  56           HA       TRP  56  -0.744 -14.692   7.499
  385   1HB   TRP  56          HB2       TRP  56  -0.307 -15.662   9.755
  386   2HB   TRP  56          HB1       TRP  56  -1.458 -14.520  10.445
  387    HD1  TRP  56           HD1      TRP  56  -3.856 -14.649   8.634
  388    HE1  TRP  56           HE1      TRP  56  -5.241 -16.750   8.278
  389    HE3  TRP  56           HE3      TRP  56  -0.437 -18.129   9.996
  390    HZ2  TRP  56           HZ2      TRP  56  -4.957 -19.570   8.535
  391    HZ3  TRP  56           HZ3      TRP  56  -1.020 -20.529   9.912
  392    HH2  TRP  56           HH2      TRP  56  -3.269 -21.264   9.196
  393    H    HIS  57           HN       HIS  57  -2.728 -14.194   6.546
  394    HA   HIS  57           HA       HIS  57  -4.194 -11.828   7.655
  395   1HB   HIS  57          HB2       HIS  57  -4.137 -10.903   5.568
  396   2HB   HIS  57          HB1       HIS  57  -2.830 -12.043   5.276
  397    HD1  HIS  57           HD1      HIS  57  -4.539 -14.647   5.032
  398    HD2  HIS  57           HD2      HIS  57  -5.447 -11.060   3.108
  399    HE1  HIS  57           HE1      HIS  57  -5.995 -15.246   3.049
  400    H    GLN  58           HN       GLN  58  -6.530 -11.921   6.323
  401    HA   GLN  58           HA       GLN  58  -7.632 -14.635   6.168
  402   1HB   GLN  58          HB2       GLN  58  -9.136 -14.306   8.112
  403   2HB   GLN  58          HB1       GLN  58  -7.442 -14.238   8.601
  404   1HG   GLN  58          HG2       GLN  58  -8.441 -11.622   7.786
  405   2HG   GLN  58          HG1       GLN  58  -9.377 -12.297   9.120
  406   1HE2  GLN  58          HE21      GLN  58  -7.351 -10.049   9.163
  407   2HE2  GLN  58          HE22      GLN  58  -6.191 -10.522  10.309
  408    H    ARG  59           HN       ARG  59  -7.513 -12.215   4.478
  409    HA   ARG  59           HA       ARG  59 -10.453 -11.863   4.067
  410   1HB   ARG  59          HB2       ARG  59  -8.301  -9.727   4.200
  411   2HB   ARG  59          HB1       ARG  59  -9.956  -9.429   3.666
  412   1HG   ARG  59          HG2       ARG  59 -10.312 -10.787   6.054
  413   2HG   ARG  59          HG1       ARG  59  -8.910  -9.769   6.383
  414   1HD   ARG  59          HD2       ARG  59 -10.103  -7.772   5.927
  415   2HD   ARG  59          HD1       ARG  59 -11.394  -8.641   5.073
  416    HE   ARG  59           HE       ARG  59 -11.355  -9.747   7.639
  417   1HH1  ARG  59          HH11      ARG  59 -10.598  -6.626   7.763
  418   2HH1  ARG  59          HH12      ARG  59 -12.116  -6.026   8.342
  419   1HH2  ARG  59          HH21      ARG  59 -13.819  -8.984   7.735
  420   2HH2  ARG  59          HH22      ARG  59 -13.939  -7.361   8.327
  421    H    THR  60           HN       THR  60  -8.196 -13.400   2.730
  422    HA   THR  60           HA       THR  60  -7.248 -12.349   0.331
  423    HB   THR  60           HB       THR  60  -6.828 -14.622   1.161
  424    HG1  THR  60           HG1      THR  60  -6.590 -15.341  -0.795
  425   1HG2  THR  60          HG21      THR  60  -9.778 -14.824   0.781
  426   2HG2  THR  60          HG22      THR  60  -8.776 -15.442   2.094
  427   3HG2  THR  60          HG23      THR  60  -8.803 -16.273   0.538
  428    H    THR  61           HN       THR  61  -8.183 -13.178  -1.881
  429    HA   THR  61           HA       THR  61 -10.665 -11.805  -2.401
  430    HB   THR  61           HB       THR  61  -8.713 -12.257  -3.970
  431    HG1  THR  61           HG1      THR  61 -10.898 -13.386  -5.229
  432   1HG2  THR  61          HG21      THR  61  -8.814 -14.771  -3.132
  433   2HG2  THR  61          HG22      THR  61  -8.270 -14.381  -4.764
  434   3HG2  THR  61          HG23      THR  61  -9.921 -14.938  -4.494
  435    H    GLU  62           HN       GLU  62  -9.889 -14.877  -1.083
  436    HA   GLU  62           HA       GLU  62 -12.033 -16.467  -2.077
  437   1HB   GLU  62          HB2       GLU  62  -9.905 -17.096  -0.750
  438   2HB   GLU  62          HB1       GLU  62 -10.809 -16.609   0.684
  439   1HG   GLU  62          HG2       GLU  62 -11.011 -19.043   0.277
  440   2HG   GLU  62          HG1       GLU  62 -12.573 -18.236   0.142
  441    H    TYR  63           HN       TYR  63 -11.734 -14.046   0.422
  442    HA   TYR  63           HA       TYR  63 -14.356 -14.588   1.571
  443   1HB   TYR  63          HB2       TYR  63 -11.986 -13.082   2.156
  444   2HB   TYR  63          HB1       TYR  63 -13.369 -11.990   2.217
  445    HD1  TYR  63           HD1      TYR  63 -15.202 -12.355   3.809
  446    HD2  TYR  63           HD2      TYR  63 -11.790 -14.961   3.696
  447    HE1  TYR  63           HE1      TYR  63 -15.851 -13.300   6.009
  448    HE2  TYR  63           HE2      TYR  63 -12.438 -15.906   5.895
  449    HH   TYR  63           HH       TYR  63 -14.215 -14.602   8.003
  450    H    TYR  64           HN       TYR  64 -13.239 -13.117  -1.249
  451    HA   TYR  64           HA       TYR  64 -15.727 -11.440  -1.446
  452   1HB   TYR  64          HB2       TYR  64 -12.908 -11.028  -2.482
  453   2HB   TYR  64          HB1       TYR  64 -14.275 -10.032  -2.979
  454    HD1  TYR  64           HD1      TYR  64 -15.415  -8.554  -1.371
  455    HD2  TYR  64           HD2      TYR  64 -11.981 -10.875  -0.243
  456    HE1  TYR  64           HE1      TYR  64 -15.157  -7.177   0.675
  457    HE2  TYR  64           HE2      TYR  64 -11.723  -9.497   1.803
  458    HH   TYR  64           HH       TYR  64 -13.018  -8.063   3.227
  459    HA   PRO  65           HA       PRO  65 -16.541 -14.159  -4.858
  460   1HB   PRO  65          HB2       PRO  65 -18.682 -12.786  -5.873
  461   2HB   PRO  65          HB1       PRO  65 -18.787 -13.807  -4.425
  462   1HG   PRO  65          HG2       PRO  65 -18.556 -10.846  -4.639
  463   2HG   PRO  65          HG1       PRO  65 -19.510 -11.826  -3.514
  464   1HD   PRO  65          HD2       PRO  65 -17.146 -10.646  -2.844
  465   2HD   PRO  65          HD1       PRO  65 -17.749 -12.135  -2.084
  466    H    ASN  66           HN       ASN  66 -15.318 -11.040  -4.959
  467    HA   ASN  66           HA       ASN  66 -14.473 -11.340  -7.762
  468   1HB   ASN  66          HB2       ASN  66 -16.838  -9.966  -7.100
  469   2HB   ASN  66          HB1       ASN  66 -15.641  -8.704  -7.391
  470   1HD2  ASN  66          HD21      ASN  66 -17.691  -8.916  -9.255
  471   2HD2  ASN  66          HD22      ASN  66 -17.107  -9.589 -10.700
  472    H    GLY  67           HN       GLY  67 -12.872 -11.358  -5.509
  473   1HA   GLY  67          HA2       GLY  67 -11.910  -8.668  -4.893
  474   2HA   GLY  67          HA1       GLY  67 -11.194 -10.179  -4.331
  475    H    GLY  68           HN       GLY  68 -10.230 -11.512  -6.300
  476   1HA   GLY  68          HA2       GLY  68  -8.885 -11.514  -8.280
  477   2HA   GLY  68          HA1       GLY  68  -9.035  -9.756  -8.354
  478    H    LEU  69           HN       LEU  69  -8.300 -10.969  -5.254
  479    HA   LEU  69           HA       LEU  69  -5.717  -9.639  -5.212
  480   1HB   LEU  69          HB2       LEU  69  -7.019 -11.553  -3.251
  481   2HB   LEU  69          HB1       LEU  69  -5.750 -10.384  -2.888
  482    HG   LEU  69           HG       LEU  69  -8.588  -9.795  -3.745
  483   1HD1  LEU  69          HD11      LEU  69  -7.882 -10.329  -1.293
  484   2HD1  LEU  69          HD12      LEU  69  -8.859  -8.891  -1.590
  485   3HD1  LEU  69          HD13      LEU  69  -7.120  -8.740  -1.335
  486   1HD2  LEU  69          HD21      LEU  69  -7.396  -7.388  -3.139
  487   2HD2  LEU  69          HD22      LEU  69  -7.673  -7.985  -4.774
  488   3HD2  LEU  69          HD23      LEU  69  -6.107  -8.228  -4.000
  489    H    THR  70           HN       THR  70  -5.299 -11.332  -7.218
  490    HA   THR  70           HA       THR  70  -4.466 -14.004  -6.532
  491    HB   THR  70           HB       THR  70  -3.661 -12.134  -8.787
  492    HG1  THR  70           HG1      THR  70  -5.666 -14.133  -8.615
  493   1HG2  THR  70          HG21      THR  70  -2.222 -13.788  -9.315
  494   2HG2  THR  70          HG22      THR  70  -3.641 -14.763  -9.696
  495   3HG2  THR  70          HG23      THR  70  -2.903 -14.866  -8.097
  496    H    ARG  71           HN       ARG  71  -2.576 -14.650  -5.544
  497    HA   ARG  71           HA       ARG  71  -0.410 -14.510  -4.599
  498   1HB   ARG  71          HB2       ARG  71  -0.240 -13.874  -7.178
  499   2HB   ARG  71          HB1       ARG  71   0.169 -12.287  -6.527
  500   1HG   ARG  71          HG2       ARG  71   2.158 -13.012  -5.631
  501   2HG   ARG  71          HG1       ARG  71   1.549 -14.639  -5.324
  502   1HD   ARG  71          HD2       ARG  71   1.590 -14.067  -8.180
  503   2HD   ARG  71          HD1       ARG  71   3.201 -13.886  -7.457
  504    HE   ARG  71           HE       ARG  71   1.842 -16.386  -7.797
  505   1HH1  ARG  71          HH21      ARG  71   4.726 -15.355  -6.807
  506   2HH1  ARG  71          HH22      ARG  71   4.886 -16.371  -5.414
  507   1HH2  ARG  71          HH11      ARG  71   1.562 -17.361  -5.429
  508   2HH2  ARG  71          HH12      ARG  71   3.094 -17.507  -4.633
  509    H    ASN  72           HN       ASN  72   0.997 -11.755  -4.870
  510    HA   ASN  72           HA       ASN  72  -0.124 -10.618  -2.371
  511   1HB   ASN  72          HB2       ASN  72   1.951  -9.134  -2.689
  512   2HB   ASN  72          HB1       ASN  72   2.243 -10.850  -2.421
  513   1HD2  ASN  72          HD21      ASN  72   1.376  -8.953  -5.395
  514   2HD2  ASN  72          HD22      ASN  72   2.659  -9.551  -6.318
  515    H    TYR  73           HN       TYR  73  -1.265 -10.356  -5.289
  516    HA   TYR  73           HA       TYR  73  -1.129  -7.939  -6.513
  517   1HB   TYR  73          HB2       TYR  73  -3.348  -9.766  -5.744
  518   2HB   TYR  73          HB1       TYR  73  -3.823  -8.183  -6.357
  519    HD1  TYR  73           HD1      TYR  73  -4.736  -8.965  -8.456
  520    HD2  TYR  73           HD2      TYR  73  -0.692  -9.890  -7.339
  521    HE1  TYR  73           HE1      TYR  73  -4.269  -9.719 -10.771
  522    HE2  TYR  73           HE2      TYR  73  -0.225 -10.644  -9.655
  523    HH   TYR  73           HH       TYR  73  -2.550 -11.376 -11.852
  524    H    CYS  74           HN       CYS  74  -1.292  -5.851  -5.973
  525    HA   CYS  74           HA       CYS  74  -1.873  -4.977  -3.242
  526   1HB   CYS  74          HB2       CYS  74  -0.171  -3.871  -4.539
  527   2HB   CYS  74          HB1       CYS  74  -1.286  -3.594  -5.876
  528    H    ARG  75           HN       ARG  75  -3.906  -4.624  -2.502
  529    HA   ARG  75           HA       ARG  75  -5.914  -3.368  -4.295
  530   1HB   ARG  75          HB2       ARG  75  -5.929  -6.130  -3.145
  531   2HB   ARG  75          HB1       ARG  75  -7.466  -5.268  -3.219
  532   1HG   ARG  75          HG2       ARG  75  -6.090  -4.877  -5.702
  533   2HG   ARG  75          HG1       ARG  75  -6.110  -6.603  -5.338
  534   1HD   ARG  75          HD2       ARG  75  -8.649  -6.121  -4.723
  535   2HD   ARG  75          HD1       ARG  75  -8.417  -4.750  -5.826
  536    HE   ARG  75           HE       ARG  75  -7.938  -7.608  -6.578
  537   1HH1  ARG  75          HH21      ARG  75 -10.317  -6.128  -7.652
  538   2HH1  ARG  75          HH22      ARG  75  -9.741  -5.590  -9.194
  539   1HH2  ARG  75          HH11      ARG  75  -6.402  -6.128  -8.432
  540   2HH2  ARG  75          HH12      ARG  75  -7.525  -5.591  -9.636
  541    H    ASN  76           HN       ASN  76  -8.093  -3.691  -2.471
  542    HA   ASN  76           HA       ASN  76  -7.119  -2.692   0.144
  543   1HB   ASN  76          HB2       ASN  76  -7.127  -0.717  -1.241
  544   2HB   ASN  76          HB1       ASN  76  -8.724  -1.109  -1.874
  545   1HD2  ASN  76          HD21      ASN  76 -10.502  -0.269  -0.743
  546   2HD2  ASN  76          HD22      ASN  76 -10.413   0.442   0.796
  547    HA   PRO  77           HA       PRO  77 -11.206  -4.908   0.222
  548   1HB   PRO  77          HB2       PRO  77 -10.375  -7.297   1.251
  549   2HB   PRO  77          HB1       PRO  77 -10.411  -6.960  -0.490
  550   1HG   PRO  77          HG2       PRO  77  -8.115  -7.125   1.345
  551   2HG   PRO  77          HG1       PRO  77  -8.193  -7.401  -0.399
  552   1HD   PRO  77          HD2       PRO  77  -7.233  -5.092   0.915
  553   2HD   PRO  77          HD1       PRO  77  -7.512  -5.295  -0.827
  554    H    ASP  78           HN       ASP  78  -9.768  -3.120   2.148
  555    HA   ASP  78           HA       ASP  78 -10.782  -4.344   4.690
  556   1HB   ASP  78          HB2       ASP  78  -8.298  -4.425   4.467
  557   2HB   ASP  78          HB1       ASP  78  -8.282  -2.671   4.281
  558    H    ALA  79           HN       ALA  79 -11.599  -2.136   2.573
  559    HA   ALA  79           HA       ALA  79 -12.942  -0.192   2.763
  560   1HB   ALA  79          HB1       ALA  79 -13.025  -1.518   5.252
  561   2HB   ALA  79          HB2       ALA  79 -14.138  -0.278   4.677
  562   3HB   ALA  79          HB3       ALA  79 -12.725   0.178   5.628
  563    H    GLU  80           HN       GLU  80  -9.729  -0.444   3.470
  564    HA   GLU  80           HA       GLU  80  -9.162   2.170   4.609
  565   1HB   GLU  80          HB2       GLU  80  -7.821  -0.147   4.324
  566   2HB   GLU  80          HB1       GLU  80  -7.198   0.701   2.907
  567   1HG   GLU  80          HG2       GLU  80  -5.972   2.135   4.163
  568   2HG   GLU  80          HG1       GLU  80  -7.277   2.365   5.328
  569    H    ILE  81           HN       ILE  81  -7.734   3.747   3.262
  570    HA   ILE  81           HA       ILE  81  -9.104   4.993   1.216
  571    HB   ILE  81           HB       ILE  81  -7.200   6.078   2.064
  572   1HG1  ILE  81          HG12      ILE  81  -6.701   5.071  -0.736
  573   2HG1  ILE  81          HG11      ILE  81  -7.186   6.674  -0.207
  574   1HG2  ILE  81          HG21      ILE  81  -4.988   4.395   1.327
  575   2HG2  ILE  81          HG22      ILE  81  -6.142   3.453   2.259
  576   3HG2  ILE  81          HG23      ILE  81  -5.476   4.939   2.928
  577   1HD1  ILE  81          HD11      ILE  81  -4.984   7.167   0.600
  578   2HD1  ILE  81          HD12      ILE  81  -4.779   6.456  -1.000
  579   3HD1  ILE  81          HD13      ILE  81  -4.478   5.486   0.439
  580    H    SER  82           HN       SER  82  -6.336   2.851   0.510
  581    HA   SER  82           HA       SER  82  -7.593   1.135  -1.343
  582   1HB   SER  82          HB2       SER  82  -8.157   3.102  -2.610
  583   2HB   SER  82          HB1       SER  82  -6.539   3.749  -2.452
  584    HG   SER  82           HG       SER  82  -7.170   2.609  -4.481
  585    HA   PRO  83           HA       PRO  83  -2.849   1.141  -2.209
  586   1HB   PRO  83          HB2       PRO  83  -1.335   3.005  -0.888
  587   2HB   PRO  83          HB1       PRO  83  -2.033   3.292  -2.492
  588   1HG   PRO  83          HG2       PRO  83  -3.022   4.159   0.181
  589   2HG   PRO  83          HG1       PRO  83  -2.942   5.065  -1.340
  590   1HD   PRO  83          HD2       PRO  83  -5.232   3.976  -0.448
  591   2HD   PRO  83          HD1       PRO  83  -4.846   4.099  -2.176
  592    H    TRP  84           HN       TRP  84  -3.265  -0.743  -0.736
  593    HA   TRP  84           HA       TRP  84  -1.544  -0.573   1.632
  594   1HB   TRP  84          HB2       TRP  84  -3.144  -0.420   3.249
  595   2HB   TRP  84          HB1       TRP  84  -4.121   0.258   1.954
  596    HD1  TRP  84           HD1      TRP  84  -6.198  -1.070   1.185
  597    HE1  TRP  84           HE1      TRP  84  -7.281  -3.295   1.909
  598    HE3  TRP  84           HE3      TRP  84  -2.502  -2.914   4.189
  599    HZ2  TRP  84           HZ2      TRP  84  -6.662  -5.556   3.546
  600    HZ3  TRP  84           HZ3      TRP  84  -2.776  -5.103   5.318
  601    HH2  TRP  84           HH2      TRP  84  -4.849  -6.425   5.001
  602    H    CYS  85           HN       CYS  85  -0.535  -2.521   1.821
  603    HA   CYS  85           HA       CYS  85  -1.973  -5.041   1.349
  604   1HB   CYS  85          HB2       CYS  85  -1.234  -3.893  -0.886
  605   2HB   CYS  85          HB1       CYS  85   0.383  -4.428  -0.427
  606    H    TYR  86           HN       TYR  86  -0.854  -6.778   2.317
  607    HA   TYR  86           HA       TYR  86   1.037  -6.322   4.354
  608   1HB   TYR  86          HB2       TYR  86   0.825  -8.829   2.658
  609   2HB   TYR  86          HB1       TYR  86   1.253  -8.724   4.365
  610    HD1  TYR  86           HD1      TYR  86  -1.166 -10.115   2.665
  611    HD2  TYR  86           HD2      TYR  86  -0.776  -6.763   5.323
  612    HE1  TYR  86           HE1      TYR  86  -3.558 -10.324   3.283
  613    HE2  TYR  86           HE2      TYR  86  -3.167  -6.972   5.940
  614    HH   TYR  86           HH       TYR  86  -5.361  -8.243   4.386
  615    H    THR  87           HN       THR  87   3.352  -7.467   4.234
  616    HA   THR  87           HA       THR  87   4.695  -6.514   1.718
  617    HB   THR  87           HB       THR  87   6.605  -6.640   3.719
  618    HG1  THR  87           HG1      THR  87   5.581  -6.594   5.507
  619   1HG2  THR  87          HG21      THR  87   5.690  -4.777   1.996
  620   2HG2  THR  87          HG22      THR  87   6.812  -4.410   3.308
  621   3HG2  THR  87          HG23      THR  87   5.086  -4.105   3.512
  622    H    MET  88           HN       MET  88   6.056  -7.978   0.703
  623    HA   MET  88           HA       MET  88   5.917 -10.776   1.306
  624   1HB   MET  88          HB2       MET  88   6.784  -9.076  -0.736
  625   2HB   MET  88          HB1       MET  88   8.247  -9.920  -0.224
  626   1HG   MET  88          HG2       MET  88   6.326 -11.928  -0.266
  627   2HG   MET  88          HG1       MET  88   5.925 -10.947  -1.675
  628   1HE   MET  88          HE1       MET  88   7.355 -14.199  -1.705
  629   2HE   MET  88          HE2       MET  88   7.704 -13.756  -3.374
  630   3HE   MET  88          HE3       MET  88   6.213 -13.203  -2.617
  631    H    ASP  89           HN       ASP  89   7.570  -8.401   3.035
  632    HA   ASP  89           HA       ASP  89   9.722 -10.320   3.812
  633   1HB   ASP  89          HB2       ASP  89   9.523  -7.333   3.528
  634   2HB   ASP  89          HB1       ASP  89  10.710  -8.019   4.638
  635    HA   PRO  90           HA       PRO  90   7.698 -10.430   7.733
  636   1HB   PRO  90          HB2       PRO  90   9.781 -11.476   9.173
  637   2HB   PRO  90          HB1       PRO  90   8.792 -12.445   8.062
  638   1HG   PRO  90          HG2       PRO  90  11.488 -11.248   7.644
  639   2HG   PRO  90          HG1       PRO  90  10.859 -12.821   7.126
  640   1HD   PRO  90          HD2       PRO  90  11.086 -10.682   5.454
  641   2HD   PRO  90          HD1       PRO  90   9.858 -11.951   5.252
  642    H    ASN  91           HN       ASN  91  10.143  -8.340   6.845
  643    HA   ASN  91           HA       ASN  91  10.640  -7.221   9.536
  644   1HB   ASN  91          HB2       ASN  91  11.787  -7.152   6.844
  645   2HB   ASN  91          HB1       ASN  91  11.715  -5.550   7.578
  646   1HD2  ASN  91          HD21      ASN  91  12.879  -8.890   8.207
  647   2HD2  ASN  91          HD22      ASN  91  14.107  -8.423   9.281
  648    H    VAL  92           HN       VAL  92   8.353  -6.918   7.030
  649    HA   VAL  92           HA       VAL  92   7.520  -4.226   8.060
  650    HB   VAL  92           HB       VAL  92   7.448  -5.435   5.268
  651   1HG1  VAL  92          HG11      VAL  92   5.484  -4.129   5.378
  652   2HG1  VAL  92          HG12      VAL  92   6.680  -3.001   4.739
  653   3HG1  VAL  92          HG13      VAL  92   6.225  -2.935   6.442
  654   1HG2  VAL  92          HG21      VAL  92   8.873  -2.972   6.333
  655   2HG2  VAL  92          HG22      VAL  92   9.032  -3.674   4.723
  656   3HG2  VAL  92          HG23      VAL  92   9.646  -4.544   6.129
  657    H    ARG  93           HN       ARG  93   5.444  -4.279   8.924
  658    HA   ARG  93           HA       ARG  93   3.877  -6.686   8.910
  659   1HB   ARG  93          HB2       ARG  93   4.033  -4.671  10.574
  660   2HB   ARG  93          HB1       ARG  93   2.836  -3.926   9.515
  661   1HG   ARG  93          HG2       ARG  93   1.767  -5.152  11.391
  662   2HG   ARG  93          HG1       ARG  93   1.333  -5.840   9.826
  663   1HD   ARG  93          HD2       ARG  93   2.152  -7.843  10.492
  664   2HD   ARG  93          HD1       ARG  93   3.750  -7.108  10.725
  665    HE   ARG  93           HE       ARG  93   3.289  -7.110  13.034
  666   1HH1  ARG  93          HH21      ARG  93   0.496  -8.068  11.411
  667   2HH1  ARG  93          HH22      ARG  93  -0.599  -7.619  12.674
  668   1HH2  ARG  93          HH11      ARG  93   1.836  -6.056  14.587
  669   2HH2  ARG  93          HH12      ARG  93   0.160  -6.478  14.474
  670    H    TRP  94           HN       TRP  94   3.383  -3.483   7.438
  671    HA   TRP  94           HA       TRP  94   2.220  -4.654   5.011
  672   1HB   TRP  94          HB2       TRP  94   0.024  -3.574   5.363
  673   2HB   TRP  94          HB1       TRP  94   0.365  -4.706   6.673
  674    HD1  TRP  94           HD1      TRP  94   0.456  -3.779   9.060
  675    HE1  TRP  94           HE1      TRP  94   0.262  -1.426  10.103
  676    HE3  TRP  94           HE3      TRP  94   0.618  -0.924   4.830
  677    HZ2  TRP  94           HZ2      TRP  94   0.186   1.306   9.251
  678    HZ3  TRP  94           HZ3      TRP  94   0.484   1.546   4.972
  679    HH2  TRP  94           HH2      TRP  94   0.269   2.664   7.174
  680    H    GLU  95           HN       GLU  95   1.653  -2.792   3.459
  681    HA   GLU  95           HA       GLU  95   2.786  -0.160   4.208
  682   1HB   GLU  95          HB2       GLU  95   4.099  -2.221   2.499
  683   2HB   GLU  95          HB1       GLU  95   4.223  -0.545   1.966
  684   1HG   GLU  95          HG2       GLU  95   4.914  -0.035   4.414
  685   2HG   GLU  95          HG1       GLU  95   5.198  -1.772   4.542
  686    H    TYR  96           HN       TYR  96   2.195   1.496   2.698
  687    HA   TYR  96           HA       TYR  96  -0.240   0.965   1.198
  688   1HB   TYR  96          HB2       TYR  96   1.476   3.232   2.024
  689   2HB   TYR  96          HB1       TYR  96   0.599   3.485   0.515
  690    HD1  TYR  96           HD1      TYR  96  -1.009   5.099   1.290
  691    HD2  TYR  96           HD2      TYR  96  -0.548   1.337   3.311
  692    HE1  TYR  96           HE1      TYR  96  -3.089   5.532   2.569
  693    HE2  TYR  96           HE2      TYR  96  -2.628   1.769   4.590
  694    HH   TYR  96           HH       TYR  96  -4.161   3.329   5.132
  695    H    CYS  97           HN       CYS  97  -0.421   1.447  -1.155
  696    HA   CYS  97           HA       CYS  97   1.924   0.400  -2.635
  697   1HB   CYS  97          HB2       CYS  97  -1.017   0.758  -3.046
  698   2HB   CYS  97          HB1       CYS  97   0.007   0.637  -4.477
  699    H    ASN  98           HN       ASN  98   2.659   1.517  -4.603
  700    HA   ASN  98           HA       ASN  98   2.981   4.391  -4.253
  701   1HB   ASN  98          HB2       ASN  98   3.733   2.283  -6.265
  702   2HB   ASN  98          HB1       ASN  98   4.007   3.985  -6.634
  703   1HD2  ASN  98          HD21      ASN  98   5.557   1.334  -5.340
  704   2HD2  ASN  98          HD22      ASN  98   6.668   2.125  -4.329
  705    H    LEU  99           HN       LEU  99   0.268   4.314  -4.405
  706    HA   LEU  99           HA       LEU  99  -0.229   5.510  -7.058
  707   1HB   LEU  99          HB2       LEU  99  -2.379   3.804  -6.911
  708   2HB   LEU  99          HB1       LEU  99  -0.939   3.519  -7.878
  709    HG   LEU  99           HG       LEU  99   0.066   2.249  -6.010
  710   1HD1  LEU  99          HD11      LEU  99  -2.016   1.681  -4.303
  711   2HD1  LEU  99          HD12      LEU  99  -2.254   3.394  -4.619
  712   3HD1  LEU  99          HD13      LEU  99  -0.727   2.829  -3.959
  713   1HD2  LEU  99          HD21      LEU  99  -1.749   1.344  -7.749
  714   2HD2  LEU  99          HD22      LEU  99  -2.680   1.095  -6.272
  715   3HD2  LEU  99          HD23      LEU  99  -1.113   0.311  -6.469
  716    H    THR 100           HN       THR 100  -1.774   7.076  -6.978
  717    HA   THR 100           HA       THR 100  -3.416   7.296  -4.490
  718    HB   THR 100           HB       THR 100  -3.301   9.695  -4.894
  719    HG1  THR 100           HG1      THR 100  -1.650  10.098  -6.759
  720   1HG2  THR 100          HG21      THR 100  -1.417   8.725  -3.680
  721   2HG2  THR 100          HG22      THR 100  -0.839  10.029  -4.717
  722   3HG2  THR 100          HG23      THR 100  -0.605   8.348  -5.199
  723    H    GLN 101           HN       GLN 101  -5.633   8.140  -4.906
  724    HA   GLN 101           HA       GLN 101  -7.075   6.842  -6.919
  725   1HB   GLN 101          HB2       GLN 101  -7.434   9.332  -5.286
  726   2HB   GLN 101          HB1       GLN 101  -8.610   8.990  -6.557
  727   1HG   GLN 101          HG2       GLN 101  -9.596   7.420  -5.286
  728   2HG   GLN 101          HG1       GLN 101  -8.060   6.579  -5.074
  729   1HE2  GLN 101          HE21      GLN 101 -10.357   7.427  -3.121
  730   2HE2  GLN 101          HE22      GLN 101  -9.516   8.145  -1.832
  731    H    CYS 102           HN       CYS 102  -6.693   6.967  -9.113
  732    HA   CYS 102           HA       CYS 102  -5.236   8.989 -10.448
  733   1HB   CYS 102          HB2       CYS 102  -6.767   6.635 -11.045
  734   2HB   CYS 102          HB1       CYS 102  -7.162   7.880 -12.223
  735    HA   PRO 103           HA       PRO 103  -9.389  10.989 -11.753
  736   1HB   PRO 103          HB2       PRO 103 -11.679  10.054 -10.579
  737   2HB   PRO 103          HB1       PRO 103 -11.014   9.380 -12.081
  738   1HG   PRO 103          HG2       PRO 103 -10.814   8.351  -9.293
  739   2HG   PRO 103          HG1       PRO 103 -11.048   7.465 -10.809
  740   1HD   PRO 103          HD2       PRO 103  -8.652   7.628  -9.533
  741   2HD   PRO 103          HD1       PRO 103  -8.808   7.439 -11.294
  742    H    VAL 104           HN       VAL 104 -10.926  12.563 -10.613
  743    HA   VAL 104           HA       VAL 104  -9.676  13.563  -8.179
  744    HB   VAL 104           HB       VAL 104 -12.288  14.425  -9.442
  745   1HG1  VAL 104          HG11      VAL 104 -10.549  16.560  -8.712
  746   2HG1  VAL 104          HG12      VAL 104 -10.581  15.423  -7.365
  747   3HG1  VAL 104          HG13      VAL 104 -12.086  16.114  -7.971
  748   1HG2  VAL 104          HG21      VAL 104 -11.192  14.855 -11.364
  749   2HG2  VAL 104          HG22      VAL 104  -9.684  14.259 -10.672
  750   3HG2  VAL 104          HG23      VAL 104 -10.135  15.953 -10.476
  751    H    THR 105           HN       THR 105 -10.901  13.949  -6.160
  752    HA   THR 105           HA       THR 105 -12.445  11.607  -5.344
  753    HB   THR 105           HB       THR 105 -11.898  14.217  -3.899
  754    HG1  THR 105           HG1      THR 105 -10.333  11.967  -3.493
  755   1HG2  THR 105          HG21      THR 105 -11.979  12.675  -1.903
  756   2HG2  THR 105          HG22      THR 105 -12.555  11.407  -2.985
  757   3HG2  THR 105          HG23      THR 105 -13.520  12.863  -2.739
  758    H    GLU 106           HN       GLU 106 -14.621  11.817  -4.340
  759    HA   GLU 106           HA       GLU 106 -16.643  12.824  -5.902
  760   1HB   GLU 106          HB2       GLU 106 -16.375  12.591  -2.896
  761   2HB   GLU 106          HB1       GLU 106 -17.913  12.954  -3.678
  762   1HG   GLU 106          HG2       GLU 106 -17.499  10.866  -5.112
  763   2HG   GLU 106          HG1       GLU 106 -16.224  10.464  -3.960
  764    H    SER 107           HN       SER 107 -17.276  14.863  -6.507
  765    HA   SER 107           HA       SER 107 -15.910  17.237  -5.683
  766   1HB   SER 107          HB2       SER 107 -18.166  18.181  -6.760
  767   2HB   SER 107          HB1       SER 107 -16.943  17.391  -7.751
  768    HG   SER 107           HG       SER 107 -18.328  15.867  -8.130
  769    H    SER 108           HN       SER 108 -19.426  16.914  -5.294
  770    HA   SER 108           HA       SER 108 -19.246  17.400  -2.379
  771   1HB   SER 108          HB2       SER 108 -20.075  19.392  -4.473
  772   2HB   SER 108          HB1       SER 108 -20.823  19.455  -2.879
  773    HG   SER 108           HG       SER 108 -18.030  19.462  -3.415
  774    H    VAL 109           HN       VAL 109 -20.547  15.576  -1.976
  775    HA   VAL 109           HA       VAL 109 -23.243  15.522  -3.290
  776    HB   VAL 109           HB       VAL 109 -21.680  13.619  -3.696
  777   1HG1  VAL 109          HG11      VAL 109 -20.429  13.669  -1.613
  778   2HG1  VAL 109          HG12      VAL 109 -21.223  12.100  -1.750
  779   3HG1  VAL 109          HG13      VAL 109 -21.890  13.337  -0.684
  780   1HG2  VAL 109          HG21      VAL 109 -23.417  12.143  -3.672
  781   2HG2  VAL 109          HG22      VAL 109 -24.352  13.522  -3.094
  782   3HG2  VAL 109          HG23      VAL 109 -23.697  12.356  -1.944
  783    H    LEU 110           HN       LEU 110 -25.072  15.407  -1.949
  784    HA   LEU 110           HA       LEU 110 -24.828  16.370   0.770
  785   1HB   LEU 110          HB2       LEU 110 -26.767  16.150  -1.237
  786   2HB   LEU 110          HB1       LEU 110 -27.361  15.113   0.061
  787    HG   LEU 110           HG       LEU 110 -26.882  17.042   1.654
  788   1HD1  LEU 110          HD11      LEU 110 -26.578  19.241   0.736
  789   2HD1  LEU 110          HD12      LEU 110 -26.832  18.656  -0.908
  790   3HD1  LEU 110          HD13      LEU 110 -25.372  18.205  -0.028
  791   1HD2  LEU 110          HD21      LEU 110 -29.131  17.101   1.417
  792   2HD2  LEU 110          HD22      LEU 110 -29.030  16.713  -0.300
  793   3HD2  LEU 110          HD23      LEU 110 -28.874  18.386   0.237
  794    H    ALA 111           HN       ALA 111 -23.484  14.705   1.793
  795    HA   ALA 111           HA       ALA 111 -24.730  12.011   2.079
  796   1HB   ALA 111          HB1       ALA 111 -22.027  13.245   2.311
  797   2HB   ALA 111          HB2       ALA 111 -22.496  11.701   1.601
  798   3HB   ALA 111          HB3       ALA 111 -22.357  11.860   3.352
  799    H    THR 112           HN       THR 112 -24.868  11.098   4.288
  800    HA   THR 112           HA       THR 112 -25.848  13.082   6.230
  801    HB   THR 112           HB       THR 112 -26.163  10.783   7.488
  802    HG1  THR 112           HG1      THR 112 -25.662   9.083   6.368
  803   1HG2  THR 112          HG21      THR 112 -27.606  12.102   5.318
  804   2HG2  THR 112          HG22      THR 112 -28.225  11.410   6.817
  805   3HG2  THR 112          HG23      THR 112 -27.962  10.378   5.411
  806    H    SER 113           HN       SER 113 -23.522  10.361   6.434
  807    HA   SER 113           HA       SER 113 -22.359  11.007   8.911
  808   1HB   SER 113          HB2       SER 113 -21.891   9.317   6.636
  809   2HB   SER 113          HB1       SER 113 -20.354  10.010   7.148
  810    HG   SER 113           HG       SER 113 -22.073   9.096   9.138
  811    H    THR 114           HN       THR 114 -20.416  12.171   9.447
  812    HA   THR 114           HA       THR 114 -19.646  14.275   7.448
  813    HB   THR 114           HB       THR 114 -19.355  14.608  10.415
  814    HG1  THR 114           HG1      THR 114 -21.439  13.846  10.238
  815   1HG2  THR 114          HG21      THR 114 -19.956  16.373   8.040
  816   2HG2  THR 114          HG22      THR 114 -18.556  16.427   9.111
  817   3HG2  THR 114          HG23      THR 114 -20.137  16.942   9.700
  818    H    ALA 115           HN       ALA 115 -18.540  12.182  10.100
  819    HA   ALA 115           HA       ALA 115 -15.872  11.978   8.859
  820   1HB   ALA 115          HB1       ALA 115 -16.296  13.133  11.637
  821   2HB   ALA 115          HB2       ALA 115 -15.844  14.072  10.214
  822   3HB   ALA 115          HB3       ALA 115 -14.738  12.859  10.857
  823    H    VAL 116           HN       VAL 116 -15.368   9.830   9.066
  824    HA   VAL 116           HA       VAL 116 -16.752   8.197  11.108
  825    HB   VAL 116           HB       VAL 116 -14.888   7.579   8.795
  826   1HG1  VAL 116          HG11      VAL 116 -14.635   5.753  10.276
  827   2HG1  VAL 116          HG12      VAL 116 -15.906   5.229   9.171
  828   3HG1  VAL 116          HG13      VAL 116 -16.324   5.817  10.780
  829   1HG2  VAL 116          HG21      VAL 116 -16.790   8.019   7.635
  830   2HG2  VAL 116          HG22      VAL 116 -17.782   8.003   9.093
  831   3HG2  VAL 116          HG23      VAL 116 -17.376   6.488   8.287
  832    H    SER 117           HN       SER 117 -15.646   7.034  12.732
  833    HA   SER 117           HA       SER 117 -12.796   7.856  13.192
  834   1HB   SER 117          HB2       SER 117 -15.197   8.009  14.763
  835   2HB   SER 117          HB1       SER 117 -14.072   6.917  15.564
  836    HG   SER 117           HG       SER 117 -13.264   9.419  14.526
  837    H    GLU 118           HN       GLU 118 -11.395   6.151  12.976
  838    HA   GLU 118           HA       GLU 118 -12.380   3.412  13.699
  839   1HB   GLU 118          HB2       GLU 118 -11.529   4.523  11.170
  840   2HB   GLU 118          HB1       GLU 118 -10.434   3.226  11.650
  841   1HG   GLU 118          HG2       GLU 118 -11.979   1.737  10.974
  842   2HG   GLU 118          HG1       GLU 118 -13.039   2.315  12.260
  843    H    GLN 119           HN       GLN 119 -11.241   3.785  15.771
  844    HA   GLN 119           HA       GLN 119  -8.323   4.200  15.696
  845   1HB   GLN 119          HB2       GLN 119 -10.418   3.756  17.836
  846   2HB   GLN 119          HB1       GLN 119  -8.701   3.903  18.215
  847   1HG   GLN 119          HG2       GLN 119  -8.605   6.134  17.557
  848   2HG   GLN 119          HG1       GLN 119  -9.996   5.982  16.482
  849   1HE2  GLN 119          HE21      GLN 119 -10.852   7.942  17.678
  850   2HE2  GLN 119          HE22      GLN 119 -11.632   7.711  19.167
  Start of MODEL   13
    1   1H    ALA   1          HT1       ALA   1  32.055  21.570  -7.303
    2   2H    ALA   1          HT2       ALA   1  32.263  23.052  -6.500
    3   3H    ALA   1          HT3       ALA   1  31.020  21.995  -6.028
    4    HA   ALA   1           HA       ALA   1  32.935  20.331  -5.571
    5   1HB   ALA   1          HB1       ALA   1  35.007  21.644  -4.984
    6   2HB   ALA   1          HB2       ALA   1  34.239  23.068  -5.687
    7   3HB   ALA   1          HB3       ALA   1  34.613  21.676  -6.703
    8    H    ARG   2           HN       ARG   2  31.401  23.268  -4.571
    9    HA   ARG   2           HA       ARG   2  32.109  23.211  -1.767
   10   1HB   ARG   2          HB2       ARG   2  29.955  24.458  -3.475
   11   2HB   ARG   2          HB1       ARG   2  29.949  24.663  -1.723
   12   1HG   ARG   2          HG2       ARG   2  32.085  25.736  -1.745
   13   2HG   ARG   2          HG1       ARG   2  32.378  25.269  -3.421
   14   1HD   ARG   2          HD2       ARG   2  30.912  26.882  -4.267
   15   2HD   ARG   2          HD1       ARG   2  29.976  26.965  -2.761
   16    HE   ARG   2           HE       ARG   2  32.595  28.270  -3.240
   17   1HH1  ARG   2          HH21      ARG   2  29.750  29.047  -1.964
   18   2HH1  ARG   2          HH22      ARG   2  30.296  29.454  -0.371
   19   1HH2  ARG   2          HH11      ARG   2  33.447  28.074  -0.812
   20   2HH2  ARG   2          HH12      ARG   2  32.389  28.902   0.282
   21    H    ILE   3           HN       ILE   3  29.550  21.711  -3.698
   22    HA   ILE   3           HA       ILE   3  27.790  20.251  -3.053
   23    HB   ILE   3           HB       ILE   3  30.045  19.393  -1.210
   24   1HG1  ILE   3          HG12      ILE   3  29.470  18.758  -4.122
   25   2HG1  ILE   3          HG11      ILE   3  30.876  19.614  -3.489
   26   1HG2  ILE   3          HG21      ILE   3  28.400  17.336  -2.470
   27   2HG2  ILE   3          HG22      ILE   3  27.448  18.414  -1.450
   28   3HG2  ILE   3          HG23      ILE   3  28.824  17.544  -0.771
   29   1HD1  ILE   3          HD11      ILE   3  30.197  16.697  -3.309
   30   2HD1  ILE   3          HD12      ILE   3  31.183  17.430  -2.044
   31   3HD1  ILE   3          HD13      ILE   3  31.733  17.460  -3.720
   32    H    HIS   4           HN       HIS   4  26.772  22.287  -1.962
   33    HA   HIS   4           HA       HIS   4  26.855  22.186   1.010
   34   1HB   HIS   4          HB2       HIS   4  26.698  24.187  -0.929
   35   2HB   HIS   4          HB1       HIS   4  25.064  24.109  -0.269
   36    HD1  HIS   4           HD1      HIS   4  25.812  23.333   2.661
   37    HD2  HIS   4           HD2      HIS   4  27.632  26.402   0.505
   38    HE1  HIS   4           HE1      HIS   4  26.783  24.931   4.370
   39    H    HIS   5           HN       HIS   5  24.481  21.995  -1.664
   40    HA   HIS   5           HA       HIS   5  22.859  20.046  -0.237
   41   1HB   HIS   5          HB2       HIS   5  22.548  22.470   0.781
   42   2HB   HIS   5          HB1       HIS   5  21.516  22.704  -0.629
   43    HD1  HIS   5           HD1      HIS   5  19.278  21.451  -0.696
   44    HD2  HIS   5           HD2      HIS   5  21.595  20.474   2.630
   45    HE1  HIS   5           HE1      HIS   5  17.781  20.120   0.854
   46    H    HIS   6           HN       HIS   6  24.049  20.607  -2.954
   47    HA   HIS   6           HA       HIS   6  21.592  20.015  -4.520
   48   1HB   HIS   6          HB2       HIS   6  22.261  21.763  -6.177
   49   2HB   HIS   6          HB1       HIS   6  21.865  22.446  -4.600
   50    HD1  HIS   6           HD1      HIS   6  23.816  23.401  -3.179
   51    HD2  HIS   6           HD2      HIS   6  25.017  21.919  -6.886
   52    HE1  HIS   6           HE1      HIS   6  26.187  24.214  -3.541
   53    H    HIS   7           HN       HIS   7  22.202  18.044  -5.355
   54    HA   HIS   7           HA       HIS   7  24.326  17.854  -7.297
   55   1HB   HIS   7          HB2       HIS   7  25.843  16.425  -5.958
   56   2HB   HIS   7          HB1       HIS   7  25.655  18.013  -5.214
   57    HD1  HIS   7           HD1      HIS   7  25.023  14.406  -4.647
   58    HD2  HIS   7           HD2      HIS   7  23.915  18.015  -2.880
   59    HE1  HIS   7           HE1      HIS   7  24.053  13.825  -2.381
   60    H    HIS   8           HN       HIS   8  21.477  17.063  -6.820
   61    HA   HIS   8           HA       HIS   8  20.066  15.180  -7.117
   62   1HB   HIS   8          HB2       HIS   8  22.391  15.114  -8.934
   63   2HB   HIS   8          HB1       HIS   8  21.560  13.567  -8.770
   64    HD1  HIS   8           HD1      HIS   8  19.612  16.735  -8.397
   65    HD2  HIS   8           HD2      HIS   8  20.335  13.878 -11.346
   66    HE1  HIS   8           HE1      HIS   8  17.930  17.168 -10.241
   67    H    HIS   9           HN       HIS   9  21.283  14.941  -4.659
   68    HA   HIS   9           HA       HIS   9  21.953  13.355  -3.036
   69   1HB   HIS   9          HB2       HIS   9  19.942  12.371  -4.643
   70   2HB   HIS   9          HB1       HIS   9  21.156  11.095  -4.752
   71    HD1  HIS   9           HD1      HIS   9  18.456  10.749  -3.169
   72    HD2  HIS   9           HD2      HIS   9  22.108  11.798  -1.453
   73    HE1  HIS   9           HE1      HIS   9  18.313  10.096  -0.727
   74    H    ILE  10           HN       ILE  10  23.294  11.202  -2.835
   75    HA   ILE  10           HA       ILE  10  25.888  11.538  -3.836
   76    HB   ILE  10           HB       ILE  10  25.447  10.063  -2.012
   77   1HG1  ILE  10          HG12      ILE  10  25.926   7.820  -3.815
   78   2HG1  ILE  10          HG11      ILE  10  26.906   9.223  -4.245
   79   1HG2  ILE  10          HG21      ILE  10  23.360   9.168  -2.052
   80   2HG2  ILE  10          HG22      ILE  10  24.118   7.835  -2.923
   81   3HG2  ILE  10          HG23      ILE  10  23.313   9.127  -3.814
   82   1HD1  ILE  10          HD11      ILE  10  27.269   9.294  -1.593
   83   2HD1  ILE  10          HD12      ILE  10  28.287   8.309  -2.644
   84   3HD1  ILE  10          HD13      ILE  10  26.950   7.568  -1.764
   85    H    GLU  11           HN       GLU  11  27.015  10.650  -5.643
   86    HA   GLU  11           HA       GLU  11  25.744  10.527  -8.138
   87   1HB   GLU  11          HB2       GLU  11  28.281   9.367  -6.989
   88   2HB   GLU  11          HB1       GLU  11  27.870   9.117  -8.686
   89   1HG   GLU  11          HG2       GLU  11  27.445  11.737  -8.617
   90   2HG   GLU  11          HG1       GLU  11  28.567  11.654  -7.259
   91    H    GLY  12           HN       GLY  12  26.702   7.738  -6.086
   92   1HA   GLY  12          HA2       GLY  12  24.540   6.137  -6.138
   93   2HA   GLY  12          HA1       GLY  12  25.100   5.943  -7.799
   94    H    ARG  13           HN       ARG  13  26.426   5.838  -4.468
   95    HA   ARG  13           HA       ARG  13  28.495   3.913  -5.344
   96   1HB   ARG  13          HB2       ARG  13  28.978   5.782  -3.787
   97   2HB   ARG  13          HB1       ARG  13  27.809   5.122  -2.643
   98   1HG   ARG  13          HG2       ARG  13  29.319   2.920  -3.043
   99   2HG   ARG  13          HG1       ARG  13  30.539   4.162  -3.326
  100   1HD   ARG  13          HD2       ARG  13  30.484   4.910  -1.137
  101   2HD   ARG  13          HD1       ARG  13  28.775   4.478  -0.925
  102    HE   ARG  13           HE       ARG  13  30.328   2.105  -1.397
  103   1HH1  ARG  13          HH11      ARG  13  32.097   3.243   0.639
  104   2HH1  ARG  13          HH12      ARG  13  31.345   2.781   2.129
  105   1HH2  ARG  13          HH21      ARG  13  28.287   2.050   0.671
  106   2HH2  ARG  13          HH22      ARG  13  29.191   2.106   2.148
  107    H    ALA  14           HN       ALA  14  26.182   3.937  -2.599
  108    HA   ALA  14           HA       ALA  14  26.248   1.165  -2.063
  109   1HB   ALA  14          HB1       ALA  14  23.719   1.892  -1.377
  110   2HB   ALA  14          HB2       ALA  14  24.455   3.482  -1.580
  111   3HB   ALA  14          HB3       ALA  14  25.139   2.334  -0.429
  112    HA   PRO  15           HA       PRO  15  23.861  -0.740  -5.212
  113   1HB   PRO  15          HB2       PRO  15  22.229  -2.445  -3.830
  114   2HB   PRO  15          HB1       PRO  15  23.975  -2.710  -4.002
  115   1HG   PRO  15          HG2       PRO  15  22.445  -1.623  -1.697
  116   2HG   PRO  15          HG1       PRO  15  23.857  -2.689  -1.713
  117   1HD   PRO  15          HD2       PRO  15  23.977  -0.007  -1.188
  118   2HD   PRO  15          HD1       PRO  15  25.329  -0.949  -1.852
  119    H    THR  16           HN       THR  16  21.237  -1.577  -5.339
  120    HA   THR  16           HA       THR  16  19.701   0.960  -4.886
  121    HB   THR  16           HB       THR  16  19.270  -1.220  -6.952
  122    HG1  THR  16           HG1      THR  16  20.848   1.101  -6.931
  123   1HG2  THR  16          HG21      THR  16  17.298   0.154  -6.493
  124   2HG2  THR  16          HG22      THR  16  17.953   0.556  -8.080
  125   3HG2  THR  16          HG23      THR  16  18.250   1.623  -6.708
  126    H    GLU  17           HN       GLU  17  19.278  -2.584  -5.170
  127    HA   GLU  17           HA       GLU  17  16.683  -2.703  -4.035
  128   1HB   GLU  17          HB2       GLU  17  17.926  -4.444  -5.372
  129   2HB   GLU  17          HB1       GLU  17  18.890  -4.773  -3.932
  130   1HG   GLU  17          HG2       GLU  17  16.121  -4.764  -3.190
  131   2HG   GLU  17          HG1       GLU  17  16.325  -5.820  -4.588
  132    H    GLN  18           HN       GLN  18  16.048  -2.496  -1.916
  133    HA   GLN  18           HA       GLN  18  17.798  -3.268   0.273
  134   1HB   GLN  18          HB2       GLN  18  18.653  -1.053  -0.315
  135   2HB   GLN  18          HB1       GLN  18  17.022  -0.384  -0.233
  136   1HG   GLN  18          HG2       GLN  18  17.176  -0.118   1.997
  137   2HG   GLN  18          HG1       GLN  18  17.650  -1.804   2.210
  138   1HE2  GLN  18          HE21      GLN  18  20.099  -1.728   0.671
  139   2HE2  GLN  18          HE22      GLN  18  21.207  -0.751   1.507
  140    H    SER  19           HN       SER  19  14.933  -3.559  -0.915
  141    HA   SER  19           HA       SER  19  12.970  -2.471   0.779
  142   1HB   SER  19          HB2       SER  19  13.330  -4.903  -0.903
  143   2HB   SER  19          HB1       SER  19  11.974  -4.917   0.221
  144    HG   SER  19           HG       SER  19  11.117  -3.890  -1.453
  145    HA   PRO  20           HA       PRO  20  14.394  -4.623   4.476
  146   1HB   PRO  20          HB2       PRO  20  13.243  -2.881   6.237
  147   2HB   PRO  20          HB1       PRO  20  14.794  -2.556   5.438
  148   1HG   PRO  20          HG2       PRO  20  12.115  -1.439   4.883
  149   2HG   PRO  20          HG1       PRO  20  13.711  -0.707   4.679
  150   1HD   PRO  20          HD2       PRO  20  12.130  -1.786   2.648
  151   2HD   PRO  20          HD1       PRO  20  13.861  -1.407   2.533
  152    H    GLY  21           HN       GLY  21  11.131  -3.330   3.874
  153   1HA   GLY  21          HA2       GLY  21   9.328  -5.109   3.805
  154   2HA   GLY  21          HA1       GLY  21  10.017  -5.704   5.317
  155    H    VAL  22           HN       VAL  22  10.360  -2.455   5.513
  156    HA   VAL  22           HA       VAL  22   7.675  -2.096   6.800
  157    HB   VAL  22           HB       VAL  22   9.075  -0.545   8.324
  158   1HG1  VAL  22          HG11      VAL  22   9.847  -2.477   9.686
  159   2HG1  VAL  22          HG12      VAL  22   9.559  -3.539   8.307
  160   3HG1  VAL  22          HG13      VAL  22   8.208  -2.708   9.078
  161   1HG2  VAL  22          HG21      VAL  22  11.028  -0.912   6.514
  162   2HG2  VAL  22          HG22      VAL  22  11.409  -2.251   7.597
  163   3HG2  VAL  22          HG23      VAL  22  11.375  -0.599   8.215
  164    H    GLN  23           HN       GLN  23   6.602  -0.193   6.269
  165    HA   GLN  23           HA       GLN  23   7.824   2.206   5.365
  166   1HB   GLN  23          HB2       GLN  23   8.079   0.250   3.518
  167   2HB   GLN  23          HB1       GLN  23   6.500   0.884   3.052
  168   1HG   GLN  23          HG2       GLN  23   7.884   3.199   3.440
  169   2HG   GLN  23          HG1       GLN  23   9.167   2.139   2.854
  170   1HE2  GLN  23          HE21      GLN  23   5.698   2.773   2.030
  171   2HE2  GLN  23          HE22      GLN  23   5.951   2.778   0.352
  172    H    ASP  24           HN       ASP  24   6.001   2.463   7.075
  173    HA   ASP  24           HA       ASP  24   3.241   2.157   6.255
  174   1HB   ASP  24          HB2       ASP  24   2.834   3.409   8.331
  175   2HB   ASP  24          HB1       ASP  24   4.097   2.206   8.595
  176    H    CYS  25           HN       CYS  25   4.169   3.388   4.072
  177    HA   CYS  25           HA       CYS  25   2.817   5.989   4.121
  178   1HB   CYS  25          HB2       CYS  25   4.654   7.362   3.972
  179   2HB   CYS  25          HB1       CYS  25   5.362   6.068   4.929
  180    H    TYR  26           HN       TYR  26   2.488   6.821   1.928
  181    HA   TYR  26           HA       TYR  26   3.362   5.095  -0.320
  182   1HB   TYR  26          HB2       TYR  26   1.092   4.554  -0.947
  183   2HB   TYR  26          HB1       TYR  26   1.274   4.141   0.756
  184    HD1  TYR  26           HD1      TYR  26  -0.032   5.208   2.429
  185    HD2  TYR  26           HD2      TYR  26   0.015   6.767  -1.572
  186    HE1  TYR  26           HE1      TYR  26  -1.900   6.732   3.002
  187    HE2  TYR  26           HE2      TYR  26  -1.852   8.296  -0.998
  188    HH   TYR  26           HH       TYR  26  -3.465   8.730   0.543
  189    H    HIS  27           HN       HIS  27   2.169   6.068  -2.414
  190    HA   HIS  27           HA       HIS  27   2.209   9.060  -2.162
  191   1HB   HIS  27          HB2       HIS  27   4.080   7.453  -3.363
  192   2HB   HIS  27          HB1       HIS  27   3.021   7.828  -4.722
  193    HD1  HIS  27           HD1      HIS  27   2.672  10.405  -5.273
  194    HD2  HIS  27           HD2      HIS  27   5.664   9.597  -2.485
  195    HE1  HIS  27           HE1      HIS  27   4.053  12.518  -5.071
  196    H    GLY  28           HN       GLY  28   0.207   9.846  -2.680
  197   1HA   GLY  28          HA2       GLY  28  -1.683  10.237  -4.056
  198   2HA   GLY  28          HA1       GLY  28  -1.141   8.934  -5.114
  199    H    ASP  29           HN       ASP  29  -1.550   6.703  -4.385
  200    HA   ASP  29           HA       ASP  29  -3.591   6.416  -2.251
  201   1HB   ASP  29          HB2       ASP  29  -3.874   5.700  -5.167
  202   2HB   ASP  29          HB1       ASP  29  -4.950   5.066  -3.921
  203    H    GLY  30           HN       GLY  30  -0.724   5.561  -2.829
  204   1HA   GLY  30          HA2       GLY  30   0.556   3.631  -2.449
  205   2HA   GLY  30          HA1       GLY  30  -0.879   2.949  -1.677
  206    H    GLN  31           HN       GLN  31  -1.701   3.985  -4.768
  207    HA   GLN  31           HA       GLN  31  -2.207   1.343  -5.749
  208   1HB   GLN  31          HB2       GLN  31  -2.226   4.146  -6.731
  209   2HB   GLN  31          HB1       GLN  31  -2.130   2.902  -7.977
  210   1HG   GLN  31          HG2       GLN  31  -4.108   1.776  -6.966
  211   2HG   GLN  31          HG1       GLN  31  -4.233   3.095  -5.801
  212   1HE2  GLN  31          HE21      GLN  31  -5.002   5.173  -6.569
  213   2HE2  GLN  31          HE22      GLN  31  -5.669   5.367  -8.118
  214    H    SER  32           HN       SER  32   0.448   3.629  -6.424
  215    HA   SER  32           HA       SER  32   1.833   1.630  -8.105
  216   1HB   SER  32          HB2       SER  32   1.680   4.434  -7.891
  217   2HB   SER  32          HB1       SER  32   3.320   4.023  -7.397
  218    HG   SER  32           HG       SER  32   3.750   3.509  -9.385
  219    H    TYR  33           HN       TYR  33   1.389   1.176  -5.157
  220    HA   TYR  33           HA       TYR  33   3.774   1.619  -3.655
  221   1HB   TYR  33          HB2       TYR  33   1.509   0.920  -2.824
  222   2HB   TYR  33          HB1       TYR  33   1.805  -0.686  -3.495
  223    HD1  TYR  33           HD1      TYR  33   3.976  -1.897  -2.744
  224    HD2  TYR  33           HD2      TYR  33   2.262   1.447  -0.667
  225    HE1  TYR  33           HE1      TYR  33   5.282  -2.485  -0.718
  226    HE2  TYR  33           HE2      TYR  33   3.567   0.859   1.360
  227    HH   TYR  33           HH       TYR  33   6.123  -1.421   1.297
  228    H    ARG  34           HN       ARG  34   5.475   0.052  -3.123
  229    HA   ARG  34           HA       ARG  34   6.900  -1.107  -5.179
  230   1HB   ARG  34          HB2       ARG  34   6.528  -1.776  -2.268
  231   2HB   ARG  34          HB1       ARG  34   7.601  -2.767  -3.257
  232   1HG   ARG  34          HG2       ARG  34   8.497  -0.364  -4.017
  233   2HG   ARG  34          HG1       ARG  34   7.886   0.088  -2.426
  234   1HD   ARG  34          HD2       ARG  34   9.324  -1.471  -1.317
  235   2HD   ARG  34          HD1       ARG  34   9.728  -2.287  -2.842
  236    HE   ARG  34           HE       ARG  34  10.388   0.604  -2.561
  237   1HH1  ARG  34          HH11      ARG  34  11.151  -1.946  -4.429
  238   2HH1  ARG  34          HH12      ARG  34  12.860  -1.930  -4.148
  239   1HH2  ARG  34          HH21      ARG  34  12.675   0.317  -1.513
  240   2HH2  ARG  34          HH22      ARG  34  13.723  -0.650  -2.497
  241    H    GLY  35           HN       GLY  35   5.657  -3.618  -3.055
  242   1HA   GLY  35          HA2       GLY  35   3.598  -4.682  -4.631
  243   2HA   GLY  35          HA1       GLY  35   5.085  -5.328  -5.302
  244    H    SER  36           HN       SER  36   4.728  -4.687  -1.841
  245    HA   SER  36           HA       SER  36   4.057  -7.490  -1.266
  246   1HB   SER  36          HB2       SER  36   6.247  -8.002  -0.277
  247   2HB   SER  36          HB1       SER  36   6.449  -7.527  -1.961
  248    HG   SER  36           HG       SER  36   7.765  -6.515  -0.093
  249    H    PHE  37           HN       PHE  37   3.002  -4.850  -0.464
  250    HA   PHE  37           HA       PHE  37   3.856  -4.498   2.342
  251   1HB   PHE  37          HB2       PHE  37   3.123  -2.670   0.724
  252   2HB   PHE  37          HB1       PHE  37   1.481  -3.278   0.927
  253    HD1  PHE  37           HD1      PHE  37   0.182  -2.278   2.585
  254    HD2  PHE  37           HD2      PHE  37   4.448  -2.431   3.072
  255    HE1  PHE  37           HE1      PHE  37  -0.017  -1.066   4.743
  256    HE2  PHE  37           HE2      PHE  37   4.247  -1.216   5.224
  257    HZ   PHE  37           HZ       PHE  37   2.015  -0.540   6.062
  258    H    SER  38           HN       SER  38   3.031  -7.075   2.164
  259    HA   SER  38           HA       SER  38   0.239  -7.553   2.592
  260   1HB   SER  38          HB2       SER  38   1.835  -9.266   1.967
  261   2HB   SER  38          HB1       SER  38   2.769  -8.986   3.431
  262    HG   SER  38           HG       SER  38   1.498 -10.636   3.999
  263    H    THR  39           HN       THR  39   0.753  -5.303   4.235
  264    HA   THR  39           HA       THR  39   0.584  -6.515   6.974
  265    HB   THR  39           HB       THR  39   1.587  -3.749   6.240
  266    HG1  THR  39           HG1      THR  39   2.940  -6.216   6.504
  267   1HG2  THR  39          HG21      THR  39   2.157  -5.424   8.690
  268   2HG2  THR  39          HG22      THR  39   0.791  -4.313   8.602
  269   3HG2  THR  39          HG23      THR  39   2.438  -3.697   8.468
  270    H    THR  40           HN       THR  40  -1.423  -6.215   7.852
  271    HA   THR  40           HA       THR  40  -3.314  -4.328   6.605
  272    HB   THR  40           HB       THR  40  -4.901  -5.468   8.105
  273    HG1  THR  40           HG1      THR  40  -4.058  -6.050   9.929
  274   1HG2  THR  40          HG21      THR  40  -3.612  -7.909   7.441
  275   2HG2  THR  40          HG22      THR  40  -3.205  -6.749   6.176
  276   3HG2  THR  40          HG23      THR  40  -4.895  -7.089   6.551
  277    H    VAL  41           HN       VAL  41  -4.443  -2.691   7.879
  278    HA   VAL  41           HA       VAL  41  -2.877  -0.921   9.363
  279    HB   VAL  41           HB       VAL  41  -5.828  -1.575   9.343
  280   1HG1  VAL  41          HG11      VAL  41  -4.313   0.254  11.117
  281   2HG1  VAL  41          HG12      VAL  41  -5.902  -0.476  11.346
  282   3HG1  VAL  41          HG13      VAL  41  -5.728   0.957  10.333
  283   1HG2  VAL  41          HG21      VAL  41  -5.991   0.201   7.824
  284   2HG2  VAL  41          HG22      VAL  41  -4.436  -0.509   7.389
  285   3HG2  VAL  41          HG23      VAL  41  -4.493   0.946   8.384
  286    H    THR  42           HN       THR  42  -4.380  -3.899  10.429
  287    HA   THR  42           HA       THR  42  -4.032  -3.281  13.294
  288    HB   THR  42           HB       THR  42  -4.732  -5.918  11.983
  289    HG1  THR  42           HG1      THR  42  -6.395  -3.690  12.541
  290   1HG2  THR  42          HG21      THR  42  -6.306  -5.572  14.203
  291   2HG2  THR  42          HG22      THR  42  -4.819  -4.756  14.687
  292   3HG2  THR  42          HG23      THR  42  -4.775  -6.447  14.189
  293    H    GLY  43           HN       GLY  43  -2.027  -4.317  10.799
  294   1HA   GLY  43          HA2       GLY  43   0.274  -4.910  11.023
  295   2HA   GLY  43          HA1       GLY  43  -0.006  -5.245  12.732
  296    H    ARG  44           HN       ARG  44  -2.436  -6.665  10.911
  297    HA   ARG  44           HA       ARG  44  -1.485  -9.352  11.487
  298   1HB   ARG  44          HB2       ARG  44  -3.891  -8.165  11.194
  299   2HB   ARG  44          HB1       ARG  44  -3.706  -8.834   9.572
  300   1HG   ARG  44          HG2       ARG  44  -4.394 -10.812  10.401
  301   2HG   ARG  44          HG1       ARG  44  -2.877 -10.885  11.300
  302   1HD   ARG  44          HD2       ARG  44  -4.625 -11.120  12.936
  303   2HD   ARG  44          HD1       ARG  44  -4.056  -9.445  13.084
  304    HE   ARG  44           HE       ARG  44  -6.240  -9.867  11.152
  305   1HH1  ARG  44          HH11      ARG  44  -6.206 -10.128  14.445
  306   2HH1  ARG  44          HH12      ARG  44  -7.222  -8.762  14.766
  307   1HH2  ARG  44          HH21      ARG  44  -7.139  -7.604  11.498
  308   2HH2  ARG  44          HH22      ARG  44  -7.749  -7.330  13.096
  309    H    THR  45           HN       THR  45  -2.121 -10.844   9.297
  310    HA   THR  45           HA       THR  45  -0.130  -9.931   7.247
  311    HB   THR  45           HB       THR  45  -0.996 -12.683   8.192
  312    HG1  THR  45           HG1      THR  45   1.154 -10.973   8.681
  313   1HG2  THR  45          HG21      THR  45   1.129 -13.251   6.741
  314   2HG2  THR  45          HG22      THR  45   0.710 -11.753   5.910
  315   3HG2  THR  45          HG23      THR  45  -0.447 -13.083   5.969
  316    H    CYS  46           HN       CYS  46  -1.199  -9.249   5.418
  317    HA   CYS  46           HA       CYS  46  -3.853  -9.567   4.701
  318   1HB   CYS  46          HB2       CYS  46  -2.589  -8.104   3.381
  319   2HB   CYS  46          HB1       CYS  46  -1.268  -9.255   3.202
  320    H    GLN  47           HN       GLN  47  -5.081 -11.217   3.780
  321    HA   GLN  47           HA       GLN  47  -3.833 -13.896   3.656
  322   1HB   GLN  47          HB2       GLN  47  -5.893 -13.933   4.759
  323   2HB   GLN  47          HB1       GLN  47  -6.606 -12.727   3.691
  324   1HG   GLN  47          HG2       GLN  47  -7.575 -14.916   3.211
  325   2HG   GLN  47          HG1       GLN  47  -6.573 -14.407   1.851
  326   1HE2  GLN  47          HE21      GLN  47  -6.311 -16.326   4.896
  327   2HE2  GLN  47          HE22      GLN  47  -5.208 -17.451   4.265
  328    H    SER  48           HN       SER  48  -3.368 -14.896   1.684
  329    HA   SER  48           HA       SER  48  -2.964 -13.711  -0.735
  330   1HB   SER  48          HB2       SER  48  -3.759 -16.416   0.192
  331   2HB   SER  48          HB1       SER  48  -3.913 -16.122  -1.538
  332    HG   SER  48           HG       SER  48  -1.838 -16.816  -1.152
  333    H    TRP  49           HN       TRP  49  -4.230 -12.849  -2.377
  334    HA   TRP  49           HA       TRP  49  -6.970 -12.216  -1.981
  335   1HB   TRP  49          HB2       TRP  49  -5.344 -12.576  -4.529
  336   2HB   TRP  49          HB1       TRP  49  -6.845 -11.657  -4.402
  337    HD1  TRP  49           HD1      TRP  49  -3.139 -11.442  -3.663
  338    HE1  TRP  49           HE1      TRP  49  -2.596  -9.095  -2.794
  339    HE3  TRP  49           HE3      TRP  49  -7.819  -9.626  -2.985
  340    HZ2  TRP  49           HZ2      TRP  49  -3.940  -6.753  -1.913
  341    HZ3  TRP  49           HZ3      TRP  49  -8.191  -7.329  -2.123
  342    HH2  TRP  49           HH2      TRP  49  -6.246  -5.884  -1.584
  343    H    SER  50           HN       SER  50  -5.373 -14.794  -3.765
  344    HA   SER  50           HA       SER  50  -7.833 -16.196  -4.489
  345   1HB   SER  50          HB2       SER  50  -5.770 -16.127  -5.846
  346   2HB   SER  50          HB1       SER  50  -4.884 -16.910  -4.541
  347    HG   SER  50           HG       SER  50  -5.512 -18.682  -5.489
  348    H    SER  51           HN       SER  51  -7.238 -15.746  -1.535
  349    HA   SER  51           HA       SER  51  -6.291 -18.083  -0.245
  350   1HB   SER  51          HB2       SER  51  -7.619 -17.132   1.662
  351   2HB   SER  51          HB1       SER  51  -6.614 -15.939   0.849
  352    HG   SER  51           HG       SER  51  -9.232 -15.902   1.209
  353    H    MET  52           HN       MET  52  -7.220 -20.059   0.087
  354    HA   MET  52           HA       MET  52 -10.148 -20.369  -0.509
  355   1HB   MET  52          HB2       MET  52  -8.101 -22.477  -1.155
  356   2HB   MET  52          HB1       MET  52  -9.663 -22.191  -1.903
  357   1HG   MET  52          HG2       MET  52  -8.264 -19.839  -2.383
  358   2HG   MET  52          HG1       MET  52  -7.062 -21.103  -2.618
  359   1HE   MET  52          HE1       MET  52  -9.268 -18.927  -4.411
  360   2HE   MET  52          HE2       MET  52 -10.422 -19.687  -3.319
  361   3HE   MET  52          HE3       MET  52 -10.602 -19.890  -5.060
  362    H    THR  53           HN       THR  53  -7.877 -20.545   1.874
  363    HA   THR  53           HA       THR  53  -8.728 -23.144   3.017
  364    HB   THR  53           HB       THR  53  -7.067 -21.854   4.826
  365    HG1  THR  53           HG1      THR  53  -5.463 -20.949   3.454
  366   1HG2  THR  53          HG21      THR  53  -7.001 -24.179   3.679
  367   2HG2  THR  53          HG22      THR  53  -5.468 -23.438   4.143
  368   3HG2  THR  53          HG23      THR  53  -6.001 -23.385   2.462
  369    HA   PRO  54           HA       PRO  54 -10.314 -20.358   6.514
  370   1HB   PRO  54          HB2       PRO  54  -9.932 -17.652   6.368
  371   2HB   PRO  54          HB1       PRO  54  -8.744 -18.754   7.091
  372   1HG   PRO  54          HG2       PRO  54  -8.760 -17.497   4.392
  373   2HG   PRO  54          HG1       PRO  54  -7.405 -17.793   5.492
  374   1HD   PRO  54          HD2       PRO  54  -7.951 -19.352   3.321
  375   2HD   PRO  54          HD1       PRO  54  -7.127 -19.947   4.779
  376    H    HIS  55           HN       HIS  55 -10.612 -17.451   4.598
  377    HA   HIS  55           HA       HIS  55 -13.459 -18.175   4.028
  378   1HB   HIS  55          HB2       HIS  55 -13.441 -15.569   3.559
  379   2HB   HIS  55          HB1       HIS  55 -13.459 -16.162   5.217
  380    HD1  HIS  55           HD1      HIS  55 -11.115 -16.182   6.483
  381    HD2  HIS  55           HD2      HIS  55 -11.148 -14.117   2.863
  382    HE1  HIS  55           HE1      HIS  55  -9.023 -14.758   6.455
  383    H    TRP  56           HN       TRP  56 -12.999 -19.416   2.122
  384    HA   TRP  56           HA       TRP  56 -11.329 -18.792  -0.026
  385   1HB   TRP  56          HB2       TRP  56 -12.695 -20.853   0.309
  386   2HB   TRP  56          HB1       TRP  56 -14.142 -19.936  -0.108
  387    HD1  TRP  56           HD1      TRP  56 -13.417 -18.398  -2.593
  388    HE1  TRP  56           HE1      TRP  56 -12.739 -19.503  -4.787
  389    HE3  TRP  56           HE3      TRP  56 -11.916 -22.916  -0.837
  390    HZ2  TRP  56           HZ2      TRP  56 -11.697 -21.978  -5.705
  391    HZ3  TRP  56           HZ3      TRP  56 -11.061 -24.627  -2.408
  392    HH2  TRP  56           HH2      TRP  56 -10.955 -24.178  -4.835
  393    H    HIS  57           HN       HIS  57 -11.387 -17.316  -1.681
  394    HA   HIS  57           HA       HIS  57 -13.798 -15.547  -1.889
  395   1HB   HIS  57          HB2       HIS  57 -12.377 -13.849  -1.399
  396   2HB   HIS  57          HB1       HIS  57 -11.068 -15.010  -1.221
  397    HD1  HIS  57           HD1      HIS  57 -10.055 -15.785  -3.736
  398    HD2  HIS  57           HD2      HIS  57 -11.857 -12.041  -3.408
  399    HE1  HIS  57           HE1      HIS  57  -9.287 -14.446  -5.740
  400    H    GLN  58           HN       GLN  58 -13.340 -14.277  -4.242
  401    HA   GLN  58           HA       GLN  58 -12.438 -16.226  -6.285
  402   1HB   GLN  58          HB2       GLN  58 -15.107 -16.082  -5.387
  403   2HB   GLN  58          HB1       GLN  58 -15.093 -15.256  -6.945
  404   1HG   GLN  58          HG2       GLN  58 -13.672 -17.313  -7.728
  405   2HG   GLN  58          HG1       GLN  58 -14.368 -18.104  -6.313
  406   1HE2  GLN  58          HE21      GLN  58 -14.957 -18.747  -9.152
  407   2HE2  GLN  58          HE22      GLN  58 -16.622 -18.487  -9.360
  408    H    ARG  59           HN       ARG  59 -14.066 -13.090  -5.698
  409    HA   ARG  59           HA       ARG  59 -13.171 -12.026  -8.287
  410   1HB   ARG  59          HB2       ARG  59 -14.733 -11.069  -5.900
  411   2HB   ARG  59          HB1       ARG  59 -14.200  -9.914  -7.123
  412   1HG   ARG  59          HG2       ARG  59 -15.656 -10.702  -8.690
  413   2HG   ARG  59          HG1       ARG  59 -15.456 -12.379  -8.179
  414   1HD   ARG  59          HD2       ARG  59 -16.814 -11.780  -6.097
  415   2HD   ARG  59          HD1       ARG  59 -17.215 -10.257  -6.916
  416    HE   ARG  59           HE       ARG  59 -18.433 -11.500  -8.570
  417   1HH1  ARG  59          HH21      ARG  59 -19.086 -13.081  -6.010
  418   2HH1  ARG  59          HH22      ARG  59 -18.891 -14.704  -6.581
  419   1HH2  ARG  59          HH11      ARG  59 -17.175 -13.771  -9.447
  420   2HH2  ARG  59          HH12      ARG  59 -17.805 -15.096  -8.526
  421    H    THR  60           HN       THR  60 -11.092 -11.337  -8.532
  422    HA   THR  60           HA       THR  60  -9.849  -9.713  -6.352
  423    HB   THR  60           HB       THR  60  -8.899 -11.866  -5.956
  424    HG1  THR  60           HG1      THR  60  -7.152 -10.667  -6.052
  425   1HG2  THR  60          HG21      THR  60  -9.858 -12.852  -8.071
  426   2HG2  THR  60          HG22      THR  60  -8.211 -13.380  -7.721
  427   3HG2  THR  60          HG23      THR  60  -8.500 -12.142  -8.943
  428    H    THR  61           HN       THR  61  -7.946  -8.526  -7.179
  429    HA   THR  61           HA       THR  61  -8.353  -7.615  -9.949
  430    HB   THR  61           HB       THR  61  -7.787  -6.150  -7.935
  431    HG1  THR  61           HG1      THR  61  -7.221  -5.844 -10.334
  432   1HG2  THR  61          HG21      THR  61  -5.288  -7.786  -8.154
  433   2HG2  THR  61          HG22      THR  61  -6.156  -7.254  -6.716
  434   3HG2  THR  61          HG23      THR  61  -5.174  -6.110  -7.627
  435    H    GLU  62           HN       GLU  62  -6.665 -10.069  -8.299
  436    HA   GLU  62           HA       GLU  62  -4.247 -10.290  -9.772
  437   1HB   GLU  62          HB2       GLU  62  -4.785 -11.474  -7.657
  438   2HB   GLU  62          HB1       GLU  62  -6.038 -12.387  -8.496
  439   1HG   GLU  62          HG2       GLU  62  -4.103 -13.063 -10.121
  440   2HG   GLU  62          HG1       GLU  62  -3.051 -12.573  -8.793
  441    H    TYR  63           HN       TYR  63  -7.570 -11.224 -10.334
  442    HA   TYR  63           HA       TYR  63  -7.135 -12.902 -12.615
  443   1HB   TYR  63          HB2       TYR  63  -9.322 -11.573 -11.172
  444   2HB   TYR  63          HB1       TYR  63  -9.627 -11.710 -12.903
  445    HD1  TYR  63           HD1      TYR  63 -10.454 -13.273 -10.041
  446    HD2  TYR  63           HD2      TYR  63  -8.426 -14.180 -13.717
  447    HE1  TYR  63           HE1      TYR  63 -11.012 -15.672  -9.757
  448    HE2  TYR  63           HE2      TYR  63  -8.984 -16.579 -13.433
  449    HH   TYR  63           HH       TYR  63  -9.688 -18.130 -11.894
  450    H    TYR  64           HN       TYR  64  -6.732  -9.578 -12.069
  451    HA   TYR  64           HA       TYR  64  -6.968  -8.906 -14.979
  452   1HB   TYR  64          HB2       TYR  64  -7.031  -7.270 -12.426
  453   2HB   TYR  64          HB1       TYR  64  -7.033  -6.558 -14.039
  454    HD1  TYR  64           HD1      TYR  64  -9.089  -6.073 -15.007
  455    HD2  TYR  64           HD2      TYR  64  -8.830  -9.230 -12.108
  456    HE1  TYR  64           HE1      TYR  64 -11.541  -6.411 -15.159
  457    HE2  TYR  64           HE2      TYR  64 -11.282  -9.570 -12.258
  458    HH   TYR  64           HH       TYR  64 -13.259  -7.691 -14.548
  459    HA   PRO  65           HA       PRO  65  -2.606  -8.584 -14.964
  460   1HB   PRO  65          HB2       PRO  65  -2.265  -6.937 -17.130
  461   2HB   PRO  65          HB1       PRO  65  -2.712  -8.649 -17.278
  462   1HG   PRO  65          HG2       PRO  65  -4.414  -6.223 -17.487
  463   2HG   PRO  65          HG1       PRO  65  -4.501  -7.748 -18.382
  464   1HD   PRO  65          HD2       PRO  65  -6.157  -7.084 -16.293
  465   2HD   PRO  65          HD1       PRO  65  -5.793  -8.751 -16.792
  466    H    ASN  66           HN       ASN  66  -4.680  -6.130 -14.105
  467    HA   ASN  66           HA       ASN  66  -2.609  -4.010 -13.896
  468   1HB   ASN  66          HB2       ASN  66  -5.503  -4.041 -12.989
  469   2HB   ASN  66          HB1       ASN  66  -4.495  -2.622 -13.279
  470   1HD2  ASN  66          HD21      ASN  66  -6.994  -3.088 -14.671
  471   2HD2  ASN  66          HD22      ASN  66  -6.634  -3.316 -16.314
  472    H    GLY  67           HN       GLY  67  -3.580  -6.660 -12.092
  473   1HA   GLY  67          HA2       GLY  67  -2.388  -5.478  -9.642
  474   2HA   GLY  67          HA1       GLY  67  -3.967  -6.257  -9.510
  475    H    GLY  68           HN       GLY  68  -0.561  -6.830 -10.256
  476   1HA   GLY  68          HA2       GLY  68  -0.712  -9.611 -10.789
  477   2HA   GLY  68          HA1       GLY  68   0.702  -8.800 -10.111
  478    H    LEU  69           HN       LEU  69  -1.155  -7.842  -7.864
  479    HA   LEU  69           HA       LEU  69  -1.258  -8.551  -5.593
  480   1HB   LEU  69          HB2       LEU  69  -2.891 -10.445  -7.283
  481   2HB   LEU  69          HB1       LEU  69  -2.935 -10.506  -5.522
  482    HG   LEU  69           HG       LEU  69  -3.714  -8.212  -7.316
  483   1HD1  LEU  69          HD11      LEU  69  -5.740  -9.178  -6.983
  484   2HD1  LEU  69          HD12      LEU  69  -5.612  -8.658  -5.304
  485   3HD1  LEU  69          HD13      LEU  69  -5.085 -10.275  -5.770
  486   1HD2  LEU  69          HD21      LEU  69  -2.833  -6.877  -5.694
  487   2HD2  LEU  69          HD22      LEU  69  -2.726  -8.198  -4.533
  488   3HD2  LEU  69          HD23      LEU  69  -4.255  -7.354  -4.768
  489    H    THR  70           HN       THR  70   1.180  -9.235  -6.160
  490    HA   THR  70           HA       THR  70   2.022 -11.887  -6.455
  491    HB   THR  70           HB       THR  70   3.265 -10.146  -4.348
  492    HG1  THR  70           HG1      THR  70   4.149  -9.150  -6.497
  493   1HG2  THR  70          HG21      THR  70   4.624 -11.271  -6.771
  494   2HG2  THR  70          HG22      THR  70   4.157 -12.365  -5.469
  495   3HG2  THR  70          HG23      THR  70   5.261 -11.029  -5.144
  496    H    ARG  71           HN       ARG  71   1.237 -13.646  -5.365
  497    HA   ARG  71           HA       ARG  71   0.191 -14.888  -3.632
  498   1HB   ARG  71          HB2       ARG  71   1.729 -14.982  -1.695
  499   2HB   ARG  71          HB1       ARG  71   2.607 -14.995  -3.222
  500   1HG   ARG  71          HG2       ARG  71   3.220 -12.697  -2.999
  501   2HG   ARG  71          HG1       ARG  71   2.087 -12.453  -1.669
  502   1HD   ARG  71          HD2       ARG  71   3.378 -13.972  -0.245
  503   2HD   ARG  71          HD1       ARG  71   4.501 -14.288  -1.582
  504    HE   ARG  71           HE       ARG  71   4.356 -11.484  -1.302
  505   1HH1  ARG  71          HH21      ARG  71   5.318 -14.256   0.522
  506   2HH1  ARG  71          HH22      ARG  71   6.527 -13.403   1.422
  507   1HH2  ARG  71          HH11      ARG  71   5.928 -10.363  -0.132
  508   2HH2  ARG  71          HH12      ARG  71   6.871 -11.203   1.053
  509    H    ASN  72           HN       ASN  72   0.835 -13.532  -0.781
  510    HA   ASN  72           HA       ASN  72  -1.839 -12.322  -0.522
  511   1HB   ASN  72          HB2       ASN  72  -1.235 -12.342   1.846
  512   2HB   ASN  72          HB1       ASN  72  -0.752 -13.879   1.125
  513   1HD2  ASN  72          HD21      ASN  72   0.605 -10.605   1.779
  514   2HD2  ASN  72          HD22      ASN  72   2.182 -11.153   2.081
  515    H    TYR  73           HN       TYR  73   0.227 -10.900  -2.192
  516    HA   TYR  73           HA       TYR  73   1.389  -8.718  -0.725
  517   1HB   TYR  73          HB2       TYR  73   2.287  -9.177  -2.846
  518   2HB   TYR  73          HB1       TYR  73   0.699  -9.347  -3.591
  519    HD1  TYR  73           HD1      TYR  73   0.323  -7.688  -5.174
  520    HD2  TYR  73           HD2      TYR  73   2.342  -6.669  -1.524
  521    HE1  TYR  73           HE1      TYR  73   0.376  -5.310  -5.870
  522    HE2  TYR  73           HE2      TYR  73   2.397  -4.289  -2.219
  523    HH   TYR  73           HH       TYR  73   1.617  -2.790  -3.701
  524    H    CYS  74           HN       CYS  74   0.604  -6.688  -0.256
  525    HA   CYS  74           HA       CYS  74  -2.303  -6.298  -0.221
  526   1HB   CYS  74          HB2       CYS  74  -0.725  -5.586   1.569
  527   2HB   CYS  74          HB1       CYS  74   0.007  -4.445   0.441
  528    H    ARG  75           HN       ARG  75  -3.483  -4.790  -1.504
  529    HA   ARG  75           HA       ARG  75  -2.011  -3.159  -3.497
  530   1HB   ARG  75          HB2       ARG  75  -3.070  -5.773  -3.988
  531   2HB   ARG  75          HB1       ARG  75  -4.031  -4.611  -4.901
  532   1HG   ARG  75          HG2       ARG  75  -1.255  -3.896  -5.111
  533   2HG   ARG  75          HG1       ARG  75  -1.448  -5.597  -5.538
  534   1HD   ARG  75          HD2       ARG  75  -3.440  -4.816  -6.996
  535   2HD   ARG  75          HD1       ARG  75  -2.753  -3.190  -6.814
  536    HE   ARG  75           HE       ARG  75  -1.276  -5.514  -7.990
  537   1HH1  ARG  75          HH11      ARG  75  -2.374  -3.068  -9.529
  538   2HH1  ARG  75          HH12      ARG  75  -0.917  -2.157  -9.748
  539   1HH2  ARG  75          HH21      ARG  75   0.873  -3.942  -7.376
  540   2HH2  ARG  75          HH22      ARG  75   0.919  -2.652  -8.531
  541    H    ASN  76           HN       ASN  76  -3.305  -1.467  -4.355
  542    HA   ASN  76           HA       ASN  76  -5.983  -1.122  -3.052
  543   1HB   ASN  76          HB2       ASN  76  -4.092   0.466  -2.524
  544   2HB   ASN  76          HB1       ASN  76  -4.090   0.938  -4.216
  545   1HD2  ASN  76          HD21      ASN  76  -4.706   2.774  -2.054
  546   2HD2  ASN  76          HD22      ASN  76  -6.324   3.254  -2.237
  547    HA   PRO  77           HA       PRO  77  -6.646  -1.601  -7.622
  548   1HB   PRO  77          HB2       PRO  77  -8.744  -3.344  -7.398
  549   2HB   PRO  77          HB1       PRO  77  -7.049  -3.871  -7.444
  550   1HG   PRO  77          HG2       PRO  77  -8.872  -3.562  -5.112
  551   2HG   PRO  77          HG1       PRO  77  -7.650  -4.801  -5.434
  552   1HD   PRO  77          HD2       PRO  77  -7.264  -2.706  -3.729
  553   2HD   PRO  77          HD1       PRO  77  -5.947  -3.524  -4.599
  554    H    ASP  78           HN       ASP  78  -8.187  -0.284  -4.976
  555    HA   ASP  78           HA       ASP  78 -10.581   0.582  -6.556
  556   1HB   ASP  78          HB2       ASP  78 -10.112  -0.329  -3.881
  557   2HB   ASP  78          HB1       ASP  78 -10.680   1.338  -3.800
  558    H    ALA  79           HN       ALA  79  -7.548   1.622  -5.395
  559    HA   ALA  79           HA       ALA  79  -6.490   3.730  -5.514
  560   1HB   ALA  79          HB1       ALA  79  -9.056   4.683  -6.797
  561   2HB   ALA  79          HB2       ALA  79  -7.912   3.656  -7.662
  562   3HB   ALA  79          HB3       ALA  79  -7.413   5.249  -7.094
  563    H    GLU  80           HN       GLU  80  -8.048   3.021  -3.145
  564    HA   GLU  80           HA       GLU  80  -9.509   5.454  -2.336
  565   1HB   GLU  80          HB2       GLU  80  -8.625   3.266  -0.470
  566   2HB   GLU  80          HB1       GLU  80 -10.143   4.160  -0.488
  567   1HG   GLU  80          HG2       GLU  80 -10.172   2.895  -2.936
  568   2HG   GLU  80          HG1       GLU  80  -9.409   1.692  -1.895
  569    H    ILE  81           HN       ILE  81  -8.590   5.557   0.373
  570    HA   ILE  81           HA       ILE  81  -6.406   7.365   0.228
  571    HB   ILE  81           HB       ILE  81  -6.272   6.866   2.694
  572   1HG1  ILE  81          HG12      ILE  81  -8.410   5.268   3.231
  573   2HG1  ILE  81          HG11      ILE  81  -7.789   4.510   1.764
  574   1HG2  ILE  81          HG21      ILE  81  -7.868   8.497   2.284
  575   2HG2  ILE  81          HG22      ILE  81  -8.855   7.248   3.046
  576   3HG2  ILE  81          HG23      ILE  81  -8.855   7.424   1.291
  577   1HD1  ILE  81          HD11      ILE  81  -6.768   4.248   4.381
  578   2HD1  ILE  81          HD12      ILE  81  -5.602   5.232   3.496
  579   3HD1  ILE  81          HD13      ILE  81  -6.051   3.638   2.890
  580    H    SER  82           HN       SER  82  -6.547   3.874   0.546
  581    HA   SER  82           HA       SER  82  -3.763   3.559  -0.269
  582   1HB   SER  82          HB2       SER  82  -2.809   3.285   1.782
  583   2HB   SER  82          HB1       SER  82  -4.244   4.095   2.404
  584    HG   SER  82           HG       SER  82  -3.775   2.011   3.366
  585    HA   PRO  83           HA       PRO  83  -5.213  -0.450  -1.286
  586   1HB   PRO  83          HB2       PRO  83  -3.129  -2.103  -0.656
  587   2HB   PRO  83          HB1       PRO  83  -3.088  -0.979  -2.028
  588   1HG   PRO  83          HG2       PRO  83  -1.857  -0.733   0.659
  589   2HG   PRO  83          HG1       PRO  83  -1.242  -0.212  -0.916
  590   1HD   PRO  83          HD2       PRO  83  -2.373   1.479   0.927
  591   2HD   PRO  83          HD1       PRO  83  -2.334   1.791  -0.822
  592    H    TRP  84           HN       TRP  84  -5.725  -2.642  -0.445
  593    HA   TRP  84           HA       TRP  84  -5.740  -2.858   2.537
  594   1HB   TRP  84          HB2       TRP  84  -8.181  -3.634   2.222
  595   2HB   TRP  84          HB1       TRP  84  -7.869  -1.908   2.043
  596    HD1  TRP  84           HD1      TRP  84  -7.680  -0.966  -0.500
  597    HE1  TRP  84           HE1      TRP  84  -8.839  -1.777  -2.655
  598    HE3  TRP  84           HE3      TRP  84  -9.087  -5.649   0.967
  599    HZ2  TRP  84           HZ2      TRP  84 -10.185  -4.105  -3.627
  600    HZ3  TRP  84           HZ3      TRP  84 -10.305  -7.141  -0.591
  601    HH2  TRP  84           HH2      TRP  84 -10.856  -6.376  -2.885
  602    H    CYS  85           HN       CYS  85  -6.826  -5.247   2.976
  603    HA   CYS  85           HA       CYS  85  -6.285  -7.225   0.908
  604   1HB   CYS  85          HB2       CYS  85  -4.091  -6.118   2.208
  605   2HB   CYS  85          HB1       CYS  85  -4.360  -7.629   3.076
  606    H    TYR  86           HN       TYR  86  -7.058  -9.265   1.535
  607    HA   TYR  86           HA       TYR  86  -8.890  -9.480   3.697
  608   1HB   TYR  86          HB2       TYR  86  -7.297 -11.618   2.241
  609   2HB   TYR  86          HB1       TYR  86  -8.802 -11.880   3.124
  610    HD1  TYR  86           HD1      TYR  86 -10.170  -9.275   2.325
  611    HD2  TYR  86           HD2      TYR  86  -8.045 -12.224   0.035
  612    HE1  TYR  86           HE1      TYR  86 -11.465  -8.642   0.308
  613    HE2  TYR  86           HE2      TYR  86  -9.342 -11.590  -1.982
  614    HH   TYR  86           HH       TYR  86 -12.086 -10.102  -2.011
  615    H    THR  87           HN       THR  87  -8.500 -11.317   5.454
  616    HA   THR  87           HA       THR  87  -5.843 -10.743   6.723
  617    HB   THR  87           HB       THR  87  -7.443 -11.781   8.676
  618    HG1  THR  87           HG1      THR  87  -9.328 -11.917   7.739
  619   1HG2  THR  87          HG21      THR  87  -7.283  -9.696   9.560
  620   2HG2  THR  87          HG22      THR  87  -7.953  -8.927   8.122
  621   3HG2  THR  87          HG23      THR  87  -6.252  -9.393   8.162
  622    H    MET  88           HN       MET  88  -4.480 -12.471   7.020
  623    HA   MET  88           HA       MET  88  -4.957 -15.047   5.927
  624   1HB   MET  88          HB2       MET  88  -2.782 -13.869   6.529
  625   2HB   MET  88          HB1       MET  88  -3.096 -14.320   8.204
  626   1HG   MET  88          HG2       MET  88  -2.109 -16.298   7.766
  627   2HG   MET  88          HG1       MET  88  -3.489 -16.679   6.737
  628   1HE   MET  88          HE1       MET  88   0.667 -16.631   5.648
  629   2HE   MET  88          HE2       MET  88  -0.453 -17.962   5.930
  630   3HE   MET  88          HE3       MET  88  -0.191 -16.758   7.189
  631    H    ASP  89           HN       ASP  89  -6.361 -13.704   8.736
  632    HA   ASP  89           HA       ASP  89  -6.640 -16.369  10.033
  633   1HB   ASP  89          HB2       ASP  89  -7.241 -13.573  11.053
  634   2HB   ASP  89          HB1       ASP  89  -7.188 -15.051  12.015
  635    HA   PRO  90           HA       PRO  90 -10.804 -16.458   8.604
  636   1HB   PRO  90          HB2       PRO  90 -11.750 -18.337  10.362
  637   2HB   PRO  90          HB1       PRO  90 -10.711 -18.742   8.980
  638   1HG   PRO  90          HG2       PRO  90  -9.999 -18.425  11.854
  639   2HG   PRO  90          HG1       PRO  90  -9.405 -19.597  10.667
  640   1HD   PRO  90          HD2       PRO  90  -7.998 -17.385  11.429
  641   2HD   PRO  90          HD1       PRO  90  -7.830 -18.151   9.833
  642    H    ASN  91           HN       ASN  91  -9.768 -15.184  11.524
  643    HA   ASN  91           HA       ASN  91 -12.459 -14.699  12.653
  644   1HB   ASN  91          HB2       ASN  91  -9.708 -14.757  13.521
  645   2HB   ASN  91          HB1       ASN  91 -10.424 -13.205  13.957
  646   1HD2  ASN  91          HD21      ASN  91 -11.040 -16.743  14.195
  647   2HD2  ASN  91          HD22      ASN  91 -11.947 -16.640  15.626
  648    H    VAL  92           HN       VAL  92 -10.392 -13.283  10.353
  649    HA   VAL  92           HA       VAL  92 -11.828 -10.665  10.629
  650    HB   VAL  92           HB       VAL  92  -8.950 -11.234   9.817
  651   1HG1  VAL  92          HG11      VAL  92  -9.743  -9.269   8.661
  652   2HG1  VAL  92          HG12      VAL  92  -8.799  -8.702  10.038
  653   3HG1  VAL  92          HG13      VAL  92 -10.561  -8.675  10.106
  654   1HG2  VAL  92          HG21      VAL  92  -9.568  -9.558  12.177
  655   2HG2  VAL  92          HG22      VAL  92  -8.345 -10.813  11.976
  656   3HG2  VAL  92          HG23      VAL  92 -10.010 -11.256  12.351
  657    H    ARG  93           HN       ARG  93 -12.647  -9.851   8.683
  658    HA   ARG  93           HA       ARG  93 -12.683 -11.647   6.391
  659   1HB   ARG  93          HB2       ARG  93 -14.690 -10.481   7.203
  660   2HB   ARG  93          HB1       ARG  93 -13.904  -8.927   6.925
  661   1HG   ARG  93          HG2       ARG  93 -15.216  -9.221   4.991
  662   2HG   ARG  93          HG1       ARG  93 -13.615  -9.756   4.480
  663   1HD   ARG  93          HD2       ARG  93 -15.335 -11.384   3.763
  664   2HD   ARG  93          HD1       ARG  93 -14.279 -12.116   4.988
  665    HE   ARG  93           HE       ARG  93 -16.797 -10.776   5.859
  666   1HH1  ARG  93          HH21      ARG  93 -15.395 -13.730   4.930
  667   2HH1  ARG  93          HH22      ARG  93 -16.055 -14.637   6.250
  668   1HH2  ARG  93          HH11      ARG  93 -17.403 -11.861   7.830
  669   2HH2  ARG  93          HH12      ARG  93 -17.193 -13.579   7.890
  670    H    TRP  94           HN       TRP  94 -11.985  -8.153   6.735
  671    HA   TRP  94           HA       TRP  94  -9.585  -8.404   5.035
  672   1HB   TRP  94          HB2       TRP  94 -10.480  -7.008   3.270
  673   2HB   TRP  94          HB1       TRP  94 -11.638  -8.310   3.546
  674    HD1  TRP  94           HD1      TRP  94 -14.004  -7.681   4.398
  675    HE1  TRP  94           HE1      TRP  94 -15.198  -5.448   4.884
  676    HE3  TRP  94           HE3      TRP  94 -10.026  -4.487   4.172
  677    HZ2  TRP  94           HZ2      TRP  94 -14.549  -2.672   5.141
  678    HZ3  TRP  94           HZ3      TRP  94 -10.341  -2.057   4.540
  679    HH2  TRP  94           HH2      TRP  94 -12.596  -1.146   5.024
  680    H    GLU  95           HN       GLU  95  -8.377  -6.322   4.982
  681    HA   GLU  95           HA       GLU  95  -9.349  -4.169   6.770
  682   1HB   GLU  95          HB2       GLU  95  -7.350  -6.252   7.446
  683   2HB   GLU  95          HB1       GLU  95  -6.892  -4.601   7.867
  684   1HG   GLU  95          HG2       GLU  95  -9.168  -4.368   8.970
  685   2HG   GLU  95          HG1       GLU  95  -9.369  -6.106   8.744
  686    H    TYR  96           HN       TYR  96  -7.989  -2.241   6.607
  687    HA   TYR  96           HA       TYR  96  -6.846  -1.840   3.977
  688   1HB   TYR  96          HB2       TYR  96  -7.386  -0.333   6.469
  689   2HB   TYR  96          HB1       TYR  96  -6.055   0.292   5.495
  690    HD1  TYR  96           HD1      TYR  96  -6.761  -0.097   2.770
  691    HD2  TYR  96           HD2      TYR  96  -9.344   0.863   6.065
  692    HE1  TYR  96           HE1      TYR  96  -8.386   0.923   1.198
  693    HE2  TYR  96           HE2      TYR  96 -10.970   1.882   4.493
  694    HH   TYR  96           HH       TYR  96 -10.229   2.222   1.046
  695    H    CYS  97           HN       CYS  97  -4.543  -0.651   4.007
  696    HA   CYS  97           HA       CYS  97  -2.661  -2.473   5.468
  697   1HB   CYS  97          HB2       CYS  97  -2.877  -1.362   2.730
  698   2HB   CYS  97          HB1       CYS  97  -1.247  -1.381   3.399
  699    H    ASN  98           HN       ASN  98  -1.084  -1.520   6.752
  700    HA   ASN  98           HA       ASN  98  -1.313   1.081   7.792
  701   1HB   ASN  98          HB2       ASN  98   0.878  -0.955   7.518
  702   2HB   ASN  98          HB1       ASN  98   1.267   0.626   8.193
  703   1HD2  ASN  98          HD21      ASN  98   1.226  -1.967   9.647
  704   2HD2  ASN  98          HD22      ASN  98   0.082  -1.791  10.889
  705    H    LEU  99           HN       LEU  99  -1.679   2.466   5.852
  706    HA   LEU  99           HA       LEU  99   0.928   3.269   4.638
  707   1HB   LEU  99          HB2       LEU  99  -1.634   2.445   3.277
  708   2HB   LEU  99          HB1       LEU  99  -0.403   3.397   2.445
  709    HG   LEU  99           HG       LEU  99   0.239   0.811   3.871
  710   1HD1  LEU  99          HD11      LEU  99   0.185  -0.249   1.637
  711   2HD1  LEU  99          HD12      LEU  99  -0.428   1.254   0.946
  712   3HD1  LEU  99          HD13      LEU  99  -1.406   0.352   2.103
  713   1HD2  LEU  99          HD21      LEU  99   1.793   2.870   2.730
  714   2HD2  LEU  99          HD22      LEU  99   1.849   1.537   1.577
  715   3HD2  LEU  99          HD23      LEU  99   2.354   1.280   3.247
  716    H    THR 100           HN       THR 100   1.156   5.413   4.370
  717    HA   THR 100           HA       THR 100  -1.190   7.235   4.655
  718    HB   THR 100           HB       THR 100   0.438   8.609   6.075
  719    HG1  THR 100           HG1      THR 100   2.093   7.287   7.026
  720   1HG2  THR 100          HG21      THR 100  -1.232   6.407   6.737
  721   2HG2  THR 100          HG22      THR 100  -0.790   7.775   7.758
  722   3HG2  THR 100          HG23      THR 100   0.197   6.314   7.767
  723    H    GLN 101           HN       GLN 101  -0.718   9.385   3.683
  724    HA   GLN 101           HA       GLN 101   0.656   9.280   1.194
  725   1HB   GLN 101          HB2       GLN 101  -0.571  11.303   2.978
  726   2HB   GLN 101          HB1       GLN 101   0.618  11.936   1.838
  727   1HG   GLN 101          HG2       GLN 101  -0.621  11.302  -0.024
  728   2HG   GLN 101          HG1       GLN 101  -1.455  10.011   0.842
  729   1HE2  GLN 101          HE21      GLN 101  -3.018  11.822  -0.627
  730   2HE2  GLN 101          HE22      GLN 101  -3.872  12.833   0.436
  731    H    CYS 102           HN       CYS 102   2.820   8.670   1.241
  732    HA   CYS 102           HA       CYS 102   4.734   9.270   3.228
  733   1HB   CYS 102          HB2       CYS 102   4.617   7.777   0.985
  734   2HB   CYS 102          HB1       CYS 102   5.592   9.118   0.383
  735    HA   PRO 103           HA       PRO 103   5.955  13.097   0.631
  736   1HB   PRO 103          HB2       PRO 103   4.092  14.130  -1.085
  737   2HB   PRO 103          HB1       PRO 103   5.294  12.918  -1.570
  738   1HG   PRO 103          HG2       PRO 103   2.416  12.583  -0.948
  739   2HG   PRO 103          HG1       PRO 103   3.425  11.737  -2.129
  740   1HD   PRO 103          HD2       PRO 103   2.660  10.715   0.307
  741   2HD   PRO 103          HD1       PRO 103   4.064  10.157  -0.624
  742    H    VAL 104           HN       VAL 104   2.373  13.449   0.722
  743    HA   VAL 104           HA       VAL 104   2.721  15.802   2.511
  744    HB   VAL 104           HB       VAL 104   0.282  14.637   1.128
  745   1HG1  VAL 104          HG11      VAL 104   0.807  17.084   2.771
  746   2HG1  VAL 104          HG12      VAL 104  -0.615  16.040   2.742
  747   3HG1  VAL 104          HG13      VAL 104  -0.341  17.195   1.437
  748   1HG2  VAL 104          HG21      VAL 104   1.968  15.318  -0.508
  749   2HG2  VAL 104          HG22      VAL 104   2.181  16.862   0.319
  750   3HG2  VAL 104          HG23      VAL 104   0.659  16.500  -0.496
  751    H    THR 105           HN       THR 105   1.187  15.951   4.398
  752    HA   THR 105           HA       THR 105   0.619  13.252   5.584
  753    HB   THR 105           HB       THR 105   1.662  15.783   6.902
  754    HG1  THR 105           HG1      THR 105   3.042  14.316   5.528
  755   1HG2  THR 105          HG21      THR 105   2.016  14.039   8.808
  756   2HG2  THR 105          HG22      THR 105   0.785  13.105   7.956
  757   3HG2  THR 105          HG23      THR 105   0.404  14.714   8.568
  758    H    GLU 106           HN       GLU 106  -1.577  13.061   5.812
  759    HA   GLU 106           HA       GLU 106  -3.558  14.941   5.468
  760   1HB   GLU 106          HB2       GLU 106  -3.220  12.356   6.724
  761   2HB   GLU 106          HB1       GLU 106  -4.402  13.316   7.616
  762   1HG   GLU 106          HG2       GLU 106  -5.552  13.810   5.438
  763   2HG   GLU 106          HG1       GLU 106  -4.445  12.683   4.653
  764    H    SER 107           HN       SER 107  -4.248  16.744   6.580
  765    HA   SER 107           HA       SER 107  -3.850  16.981   9.486
  766   1HB   SER 107          HB2       SER 107  -1.665  17.629   8.739
  767   2HB   SER 107          HB1       SER 107  -2.328  18.599   7.428
  768    HG   SER 107           HG       SER 107  -2.098  20.131   8.874
  769    H    SER 108           HN       SER 108  -3.941  19.704   7.253
  770    HA   SER 108           HA       SER 108  -5.619  21.324   6.869
  771   1HB   SER 108          HB2       SER 108  -7.482  19.018   7.482
  772   2HB   SER 108          HB1       SER 108  -7.777  20.380   6.405
  773    HG   SER 108           HG       SER 108  -6.356  18.050   5.998
  774    H    VAL 109           HN       VAL 109  -5.395  22.694   8.679
  775    HA   VAL 109           HA       VAL 109  -6.144  22.073  11.361
  776    HB   VAL 109           HB       VAL 109  -5.984  24.684   9.823
  777   1HG1  VAL 109          HG11      VAL 109  -7.253  24.541  12.139
  778   2HG1  VAL 109          HG12      VAL 109  -6.111  25.849  11.833
  779   3HG1  VAL 109          HG13      VAL 109  -5.617  24.454  12.791
  780   1HG2  VAL 109          HG21      VAL 109  -3.785  24.141   9.814
  781   2HG2  VAL 109          HG22      VAL 109  -4.033  22.807  10.940
  782   3HG2  VAL 109          HG23      VAL 109  -3.819  24.447  11.550
  783    H    LEU 110           HN       LEU 110  -7.874  24.499   9.390
  784    HA   LEU 110           HA       LEU 110 -10.359  24.008  10.847
  785   1HB   LEU 110          HB2       LEU 110  -9.159  25.973   9.120
  786   2HB   LEU 110          HB1       LEU 110 -10.759  25.563   8.500
  787    HG   LEU 110           HG       LEU 110 -10.559  25.942  11.439
  788   1HD1  LEU 110          HD11      LEU 110  -9.129  27.765  10.312
  789   2HD1  LEU 110          HD12      LEU 110 -10.426  28.310  11.376
  790   3HD1  LEU 110          HD13      LEU 110 -10.643  28.357   9.626
  791   1HD2  LEU 110          HD21      LEU 110 -12.776  26.650  11.196
  792   2HD2  LEU 110          HD22      LEU 110 -12.624  25.497   9.870
  793   3HD2  LEU 110          HD23      LEU 110 -12.515  27.228   9.551
  794    H    ALA 111           HN       ALA 111 -12.318  23.179   9.885
  795    HA   ALA 111           HA       ALA 111 -11.839  21.129   7.807
  796   1HB   ALA 111          HB1       ALA 111 -13.359  20.087   9.109
  797   2HB   ALA 111          HB2       ALA 111 -14.560  21.300   8.664
  798   3HB   ALA 111          HB3       ALA 111 -13.535  21.550  10.078
  799    H    THR 112           HN       THR 112 -11.665  22.363   5.861
  800    HA   THR 112           HA       THR 112 -13.744  24.320   5.154
  801    HB   THR 112           HB       THR 112 -11.295  24.473   4.575
  802    HG1  THR 112           HG1      THR 112 -13.282  25.219   3.237
  803   1HG2  THR 112          HG21      THR 112 -11.177  21.965   4.071
  804   2HG2  THR 112          HG22      THR 112 -10.342  23.030   2.940
  805   3HG2  THR 112          HG23      THR 112 -11.913  22.352   2.515
  806    H    SER 113           HN       SER 113 -14.918  24.035   3.023
  807    HA   SER 113           HA       SER 113 -16.307  21.488   2.951
  808   1HB   SER 113          HB2       SER 113 -16.447  23.436   0.701
  809   2HB   SER 113          HB1       SER 113 -17.753  22.665   1.596
  810    HG   SER 113           HG       SER 113 -16.494  25.047   2.021
  811    H    THR 114           HN       THR 114 -14.854  19.819   2.349
  812    HA   THR 114           HA       THR 114 -13.484  20.125  -0.299
  813    HB   THR 114           HB       THR 114 -12.056  19.703   1.666
  814    HG1  THR 114           HG1      THR 114 -11.131  17.728   0.890
  815   1HG2  THR 114          HG21      THR 114 -14.221  17.890   2.308
  816   2HG2  THR 114          HG22      THR 114 -12.918  18.476   3.343
  817   3HG2  THR 114          HG23      THR 114 -12.672  17.045   2.341
  818    H    ALA 115           HN       ALA 115 -16.233  19.562  -0.381
  819    HA   ALA 115           HA       ALA 115 -16.654  16.658  -0.520
  820   1HB   ALA 115          HB1       ALA 115 -18.341  19.029  -1.390
  821   2HB   ALA 115          HB2       ALA 115 -18.375  18.294   0.212
  822   3HB   ALA 115          HB3       ALA 115 -18.918  17.375  -1.191
  823    H    VAL 116           HN       VAL 116 -15.327  15.837  -2.195
  824    HA   VAL 116           HA       VAL 116 -15.119  17.113  -4.802
  825    HB   VAL 116           HB       VAL 116 -14.478  14.314  -3.811
  826   1HG1  VAL 116          HG11      VAL 116 -14.597  14.420  -6.259
  827   2HG1  VAL 116          HG12      VAL 116 -12.916  14.277  -5.744
  828   3HG1  VAL 116          HG13      VAL 116 -13.549  15.839  -6.264
  829   1HG2  VAL 116          HG21      VAL 116 -13.383  16.751  -3.035
  830   2HG2  VAL 116          HG22      VAL 116 -12.277  16.185  -4.287
  831   3HG2  VAL 116          HG23      VAL 116 -12.604  15.177  -2.877
  832    H    SER 117           HN       SER 117 -17.288  14.799  -3.322
  833    HA   SER 117           HA       SER 117 -18.443  14.029  -5.956
  834   1HB   SER 117          HB2       SER 117 -18.477  13.041  -3.136
  835   2HB   SER 117          HB1       SER 117 -19.868  12.660  -4.147
  836    HG   SER 117           HG       SER 117 -18.424  11.760  -5.660
  837    H    GLU 118           HN       GLU 118 -20.343  14.959  -6.667
  838    HA   GLU 118           HA       GLU 118 -21.517  17.260  -5.661
  839   1HB   GLU 118          HB2       GLU 118 -21.957  15.508  -7.716
  840   2HB   GLU 118          HB1       GLU 118 -23.406  15.251  -6.741
  841   1HG   GLU 118          HG2       GLU 118 -22.820  18.075  -6.906
  842   2HG   GLU 118          HG1       GLU 118 -22.910  17.383  -8.526
  843    H    GLN 119           HN       GLN 119 -22.955  17.742  -4.004
  844    HA   GLN 119           HA       GLN 119 -23.862  15.445  -2.298
  845   1HB   GLN 119          HB2       GLN 119 -23.295  18.336  -1.564
  846   2HB   GLN 119          HB1       GLN 119 -23.641  17.021  -0.440
  847   1HG   GLN 119          HG2       GLN 119 -21.543  16.025  -1.963
  848   2HG   GLN 119          HG1       GLN 119 -21.124  17.725  -1.752
  849   1HE2  GLN 119          HE21      GLN 119 -20.731  14.752  -0.296
  850   2HE2  GLN 119          HE22      GLN 119 -20.531  15.255   1.313
  Start of MODEL   14
    1   1H    ALA   1          HT1       ALA   1  41.209  11.791   2.236
    2   2H    ALA   1          HT2       ALA   1  41.810  12.976   1.177
    3   3H    ALA   1          HT3       ALA   1  42.771  11.639   1.593
    4    HA   ALA   1           HA       ALA   1  40.191  11.381   0.140
    5   1HB   ALA   1          HB1       ALA   1  42.816  11.110  -1.226
    6   2HB   ALA   1          HB2       ALA   1  42.357  12.748  -0.760
    7   3HB   ALA   1          HB3       ALA   1  41.309  11.807  -1.821
    8    H    ARG   2           HN       ARG   2  40.217   9.232  -1.012
    9    HA   ARG   2           HA       ARG   2  42.154   7.200  -0.256
   10   1HB   ARG   2          HB2       ARG   2  40.162   7.903   1.613
   11   2HB   ARG   2          HB1       ARG   2  39.633   6.373   0.914
   12   1HG   ARG   2          HG2       ARG   2  42.510   6.471   1.531
   13   2HG   ARG   2          HG1       ARG   2  41.467   6.601   2.948
   14   1HD   ARG   2          HD2       ARG   2  40.502   4.552   1.105
   15   2HD   ARG   2          HD1       ARG   2  42.157   4.223   1.655
   16    HE   ARG   2           HE       ARG   2  40.524   5.116   3.858
   17   1HH1  ARG   2          HH11      ARG   2  42.515   2.812   3.846
   18   2HH1  ARG   2          HH12      ARG   2  41.465   1.458   4.103
   19   1HH2  ARG   2          HH21      ARG   2  38.578   3.208   3.311
   20   2HH2  ARG   2          HH22      ARG   2  39.236   1.683   3.801
   21    H    ILE   3           HN       ILE   3  38.883   7.964  -1.408
   22    HA   ILE   3           HA       ILE   3  37.562   6.930  -3.077
   23    HB   ILE   3           HB       ILE   3  40.440   6.606  -3.934
   24   1HG1  ILE   3          HG12      ILE   3  38.572   8.161  -5.570
   25   2HG1  ILE   3          HG11      ILE   3  38.669   8.746  -3.908
   26   1HG2  ILE   3          HG21      ILE   3  38.896   6.300  -6.224
   27   2HG2  ILE   3          HG22      ILE   3  38.070   5.289  -5.038
   28   3HG2  ILE   3          HG23      ILE   3  39.774   5.013  -5.397
   29   1HD1  ILE   3          HD11      ILE   3  41.253   8.061  -5.199
   30   2HD1  ILE   3          HD12      ILE   3  40.852   9.400  -4.123
   31   3HD1  ILE   3          HD13      ILE   3  40.425   9.484  -5.832
   32    H    HIS   4           HN       HIS   4  36.877   5.259  -1.446
   33    HA   HIS   4           HA       HIS   4  38.259   2.715  -1.269
   34   1HB   HIS   4          HB2       HIS   4  36.567   3.915   0.312
   35   2HB   HIS   4          HB1       HIS   4  35.332   3.200  -0.725
   36    HD1  HIS   4           HD1      HIS   4  34.467   1.332   0.734
   37    HD2  HIS   4           HD2      HIS   4  38.628   1.333   0.481
   38    HE1  HIS   4           HE1      HIS   4  35.254  -0.794   1.864
   39    H    HIS   5           HN       HIS   5  37.142   0.640  -1.988
   40    HA   HIS   5           HA       HIS   5  36.837   0.437  -4.762
   41   1HB   HIS   5          HB2       HIS   5  36.842  -1.234  -2.611
   42   2HB   HIS   5          HB1       HIS   5  35.146  -1.333  -3.085
   43    HD1  HIS   5           HD1      HIS   5  35.605  -3.813  -3.903
   44    HD2  HIS   5           HD2      HIS   5  37.677  -0.868  -6.004
   45    HE1  HIS   5           HE1      HIS   5  36.474  -4.915  -6.012
   46    H    HIS   6           HN       HIS   6  34.096   0.329  -2.448
   47    HA   HIS   6           HA       HIS   6  32.390   1.573  -4.582
   48   1HB   HIS   6          HB2       HIS   6  32.038  -0.678  -2.640
   49   2HB   HIS   6          HB1       HIS   6  30.614   0.269  -3.072
   50    HD1  HIS   6           HD1      HIS   6  33.252  -1.965  -4.590
   51    HD2  HIS   6           HD2      HIS   6  29.679  -0.130  -5.704
   52    HE1  HIS   6           HE1      HIS   6  32.616  -2.941  -6.838
   53    H    HIS   7           HN       HIS   7  31.050   3.289  -3.923
   54    HA   HIS   7           HA       HIS   7  31.589   4.376  -1.193
   55   1HB   HIS   7          HB2       HIS   7  30.825   6.494  -2.236
   56   2HB   HIS   7          HB1       HIS   7  32.126   5.756  -3.170
   57    HD1  HIS   7           HD1      HIS   7  28.540   6.703  -3.345
   58    HD2  HIS   7           HD2      HIS   7  31.239   4.493  -5.628
   59    HE1  HIS   7           HE1      HIS   7  27.449   6.351  -5.604
   60    H    HIS   8           HN       HIS   8  30.019   3.065  -0.057
   61    HA   HIS   8           HA       HIS   8  27.161   3.581  -0.807
   62   1HB   HIS   8          HB2       HIS   8  28.166   1.227  -0.804
   63   2HB   HIS   8          HB1       HIS   8  28.288   1.386   0.948
   64    HD1  HIS   8           HD1      HIS   8  25.474   3.177   0.821
   65    HD2  HIS   8           HD2      HIS   8  26.107  -0.784  -0.314
   66    HE1  HIS   8           HE1      HIS   8  23.211   2.042   0.887
   67    H    HIS   9           HN       HIS   9  29.588   3.907   1.687
   68    HA   HIS   9           HA       HIS   9  27.598   4.560   3.777
   69   1HB   HIS   9          HB2       HIS   9  30.526   4.051   3.538
   70   2HB   HIS   9          HB1       HIS   9  30.003   5.073   4.877
   71    HD1  HIS   9           HD1      HIS   9  31.096   2.078   5.155
   72    HD2  HIS   9           HD2      HIS   9  27.093   3.240   5.245
   73    HE1  HIS   9           HE1      HIS   9  29.848   0.255   6.393
   74    H    ILE  10           HN       ILE  10  28.984   6.201   1.216
   75    HA   ILE  10           HA       ILE  10  29.244   8.789   2.667
   76    HB   ILE  10           HB       ILE  10  29.868   7.848  -0.149
   77   1HG1  ILE  10          HG12      ILE  10  31.392   6.982   1.554
   78   2HG1  ILE  10          HG11      ILE  10  32.216   8.232   0.621
   79   1HG2  ILE  10          HG21      ILE  10  31.184  10.179   0.046
   80   2HG2  ILE  10          HG22      ILE  10  29.819  10.557   1.096
   81   3HG2  ILE  10          HG23      ILE  10  29.538  10.086  -0.580
   82   1HD1  ILE  10          HD11      ILE  10  31.031   8.460   3.393
   83   2HD1  ILE  10          HD12      ILE  10  31.455   9.877   2.431
   84   3HD1  ILE  10          HD13      ILE  10  32.705   8.724   2.903
   85    H    GLU  11           HN       GLU  11  26.598   7.763   2.519
   86    HA   GLU  11           HA       GLU  11  25.295   9.932   1.002
   87   1HB   GLU  11          HB2       GLU  11  25.797   7.690  -0.372
   88   2HB   GLU  11          HB1       GLU  11  24.318   7.164   0.431
   89   1HG   GLU  11          HG2       GLU  11  23.905   9.827  -0.520
   90   2HG   GLU  11          HG1       GLU  11  24.570   8.871  -1.844
   91    H    GLY  12           HN       GLY  12  22.715   9.353   1.215
   92   1HA   GLY  12          HA2       GLY  12  21.368   7.947   3.005
   93   2HA   GLY  12          HA1       GLY  12  22.325   8.912   4.128
   94    H    ARG  13           HN       ARG  13  20.740   9.815   1.052
   95    HA   ARG  13           HA       ARG  13  19.577  12.180   2.417
   96   1HB   ARG  13          HB2       ARG  13  19.737  11.250  -0.468
   97   2HB   ARG  13          HB1       ARG  13  19.024  12.783   0.036
   98   1HG   ARG  13          HG2       ARG  13  21.413  12.912   1.327
   99   2HG   ARG  13          HG1       ARG  13  21.873  11.981  -0.099
  100   1HD   ARG  13          HD2       ARG  13  20.349  14.609  -0.204
  101   2HD   ARG  13          HD1       ARG  13  22.096  14.447  -0.473
  102    HE   ARG  13           HE       ARG  13  20.010  13.621  -2.337
  103   1HH1  ARG  13          HH21      ARG  13  22.739  14.636  -3.106
  104   2HH1  ARG  13          HH22      ARG  13  23.498  13.198  -3.701
  105   1HH2  ARG  13          HH11      ARG  13  21.177  11.060  -2.264
  106   2HH2  ARG  13          HH12      ARG  13  22.613  11.173  -3.226
  107    H    ALA  14           HN       ALA  14  17.291  12.453   0.724
  108    HA   ALA  14           HA       ALA  14  15.640  10.043   1.372
  109   1HB   ALA  14          HB1       ALA  14  14.900  12.926   1.965
  110   2HB   ALA  14          HB2       ALA  14  15.555  11.812   3.165
  111   3HB   ALA  14          HB3       ALA  14  13.988  11.488   2.423
  112    HA   PRO  15           HA       PRO  15  14.809  11.683  -2.863
  113   1HB   PRO  15          HB2       PRO  15  14.908   9.252  -4.113
  114   2HB   PRO  15          HB1       PRO  15  16.347  10.250  -3.828
  115   1HG   PRO  15          HG2       PRO  15  15.384   7.855  -2.360
  116   2HG   PRO  15          HG1       PRO  15  17.038   8.368  -2.728
  117   1HD   PRO  15          HD2       PRO  15  15.825   8.683  -0.281
  118   2HD   PRO  15          HD1       PRO  15  17.179   9.673  -0.866
  119    H    THR  16           HN       THR  16  12.612  12.145  -2.471
  120    HA   THR  16           HA       THR  16  10.643  10.232  -1.631
  121    HB   THR  16           HB       THR  16   9.222  12.174  -2.865
  122    HG1  THR  16           HG1      THR  16  10.403  13.872  -3.305
  123   1HG2  THR  16          HG21      THR  16  10.562  13.242  -0.492
  124   2HG2  THR  16          HG22      THR  16  10.018  11.577  -0.282
  125   3HG2  THR  16          HG23      THR  16   8.863  12.831  -0.733
  126    H    GLU  17           HN       GLU  17  10.735   8.377  -3.003
  127    HA   GLU  17           HA       GLU  17  10.957   8.113  -5.725
  128   1HB   GLU  17          HB2       GLU  17  10.151   6.572  -3.595
  129   2HB   GLU  17          HB1       GLU  17   8.689   6.618  -4.582
  130   1HG   GLU  17          HG2       GLU  17   9.999   4.732  -5.322
  131   2HG   GLU  17          HG1       GLU  17  10.111   5.977  -6.567
  132    H    GLN  18           HN       GLN  18  10.077   9.859  -6.941
  133    HA   GLN  18           HA       GLN  18   7.411  10.845  -6.671
  134   1HB   GLN  18          HB2       GLN  18   9.708  11.584  -7.925
  135   2HB   GLN  18          HB1       GLN  18   8.773  10.985  -9.295
  136   1HG   GLN  18          HG2       GLN  18   6.840  12.425  -8.351
  137   2HG   GLN  18          HG1       GLN  18   8.088  13.226  -7.396
  138   1HE2  GLN  18          HE21      GLN  18   7.663  12.163 -10.830
  139   2HE2  GLN  18          HE22      GLN  18   8.314  13.582 -11.497
  140    H    SER  19           HN       SER  19   8.706   8.012  -8.178
  141    HA   SER  19           HA       SER  19   6.862   7.575 -10.294
  142   1HB   SER  19          HB2       SER  19   8.706   6.017  -8.578
  143   2HB   SER  19          HB1       SER  19   7.440   5.077  -9.364
  144    HG   SER  19           HG       SER  19   8.876   6.991 -10.835
  145    HA   PRO  20           HA       PRO  20   4.035   5.208  -7.279
  146   1HB   PRO  20          HB2       PRO  20   4.723   5.101  -4.632
  147   2HB   PRO  20          HB1       PRO  20   5.282   3.908  -5.823
  148   1HG   PRO  20          HG2       PRO  20   6.719   6.243  -4.667
  149   2HG   PRO  20          HG1       PRO  20   7.324   4.627  -5.064
  150   1HD   PRO  20          HD2       PRO  20   7.742   6.822  -6.631
  151   2HD   PRO  20          HD1       PRO  20   7.688   5.159  -7.256
  152    H    GLY  21           HN       GLY  21   2.251   6.039  -5.958
  153   1HA   GLY  21          HA2       GLY  21   2.567   8.940  -5.301
  154   2HA   GLY  21          HA1       GLY  21   1.057   8.218  -5.856
  155    H    VAL  22           HN       VAL  22   2.448   9.414  -3.161
  156    HA   VAL  22           HA       VAL  22   1.652   7.357  -1.224
  157    HB   VAL  22           HB       VAL  22   2.366   9.117   0.379
  158   1HG1  VAL  22          HG11      VAL  22   4.196   7.856  -0.364
  159   2HG1  VAL  22          HG12      VAL  22   4.699   9.504  -0.740
  160   3HG1  VAL  22          HG13      VAL  22   4.067   8.462  -2.015
  161   1HG2  VAL  22          HG21      VAL  22   1.665  10.815  -1.796
  162   2HG2  VAL  22          HG22      VAL  22   3.392  11.026  -1.506
  163   3HG2  VAL  22          HG23      VAL  22   2.240  11.290  -0.198
  164    H    GLN  23           HN       GLN  23  -0.258   7.367  -0.014
  165    HA   GLN  23           HA       GLN  23  -1.999   9.536   0.424
  166   1HB   GLN  23          HB2       GLN  23  -2.350   9.735  -1.912
  167   2HB   GLN  23          HB1       GLN  23  -2.388   7.986  -2.136
  168   1HG   GLN  23          HG2       GLN  23  -4.594   7.853  -1.623
  169   2HG   GLN  23          HG1       GLN  23  -4.441   8.988  -0.283
  170   1HE2  GLN  23          HE21      GLN  23  -4.247  11.371  -0.948
  171   2HE2  GLN  23          HE22      GLN  23  -5.079  11.874  -2.340
  172    H    ASP  24           HN       ASP  24  -2.246   8.384   2.418
  173    HA   ASP  24           HA       ASP  24  -3.192   5.615   2.460
  174   1HB   ASP  24          HB2       ASP  24  -3.246   6.065   4.908
  175   2HB   ASP  24          HB1       ASP  24  -1.722   6.577   4.183
  176    H    CYS  25           HN       CYS  25  -5.186   5.903   1.166
  177    HA   CYS  25           HA       CYS  25  -7.491   6.526   2.872
  178   1HB   CYS  25          HB2       CYS  25  -8.083   8.535   1.943
  179   2HB   CYS  25          HB1       CYS  25  -6.361   8.630   1.603
  180    H    TYR  26           HN       TYR  26  -9.296   5.363   2.196
  181    HA   TYR  26           HA       TYR  26  -9.254   4.159  -0.540
  182   1HB   TYR  26          HB2       TYR  26  -9.608   1.962   0.409
  183   2HB   TYR  26          HB1       TYR  26  -8.212   2.669   1.221
  184    HD1  TYR  26           HD1      TYR  26  -8.238   3.131   3.561
  185    HD2  TYR  26           HD2      TYR  26 -11.865   2.028   1.543
  186    HE1  TYR  26           HE1      TYR  26  -9.378   2.879   5.748
  187    HE2  TYR  26           HE2      TYR  26 -13.004   1.780   3.732
  188    HH   TYR  26           HH       TYR  26 -11.265   1.821   6.725
  189    H    HIS  27           HN       HIS  27 -11.355   3.654  -1.336
  190    HA   HIS  27           HA       HIS  27 -13.594   4.958   0.147
  191   1HB   HIS  27          HB2       HIS  27 -12.920   5.566  -2.222
  192   2HB   HIS  27          HB1       HIS  27 -13.433   3.952  -2.711
  193    HD1  HIS  27           HD1      HIS  27 -15.368   5.000  -4.152
  194    HD2  HIS  27           HD2      HIS  27 -15.654   5.782  -0.067
  195    HE1  HIS  27           HE1      HIS  27 -17.712   5.874  -3.752
  196    H    GLY  28           HN       GLY  28 -15.373   3.737   0.824
  197   1HA   GLY  28          HA2       GLY  28 -16.755   1.845   1.125
  198   2HA   GLY  28          HA1       GLY  28 -15.914   1.077  -0.223
  199    H    ASP  29           HN       ASP  29 -14.659  -0.633   0.320
  200    HA   ASP  29           HA       ASP  29 -13.426  -0.674   3.035
  201   1HB   ASP  29          HB2       ASP  29 -14.964  -2.830   1.574
  202   2HB   ASP  29          HB1       ASP  29 -13.992  -3.152   3.010
  203    H    GLY  30           HN       GLY  30 -11.899   0.220   1.053
  204   1HA   GLY  30          HA2       GLY  30  -9.847  -0.208  -0.019
  205   2HA   GLY  30          HA1       GLY  30  -9.822  -1.770   0.807
  206    H    GLN  31           HN       GLN  31 -12.758  -1.433  -0.741
  207    HA   GLN  31           HA       GLN  31 -12.102  -3.466  -2.726
  208   1HB   GLN  31          HB2       GLN  31 -14.458  -1.986  -1.678
  209   2HB   GLN  31          HB1       GLN  31 -14.614  -2.633  -3.312
  210   1HG   GLN  31          HG2       GLN  31 -13.494  -4.400  -1.165
  211   2HG   GLN  31          HG1       GLN  31 -15.236  -4.129  -1.219
  212   1HE2  GLN  31          HE21      GLN  31 -16.229  -5.792  -2.358
  213   2HE2  GLN  31          HE22      GLN  31 -15.606  -6.528  -3.755
  214    H    SER  32           HN       SER  32 -12.858   0.024  -2.842
  215    HA   SER  32           HA       SER  32 -12.664   0.075  -5.784
  216   1HB   SER  32          HB2       SER  32 -14.256   1.437  -4.391
  217   2HB   SER  32          HB1       SER  32 -12.871   2.313  -3.745
  218    HG   SER  32           HG       SER  32 -14.041   2.389  -6.267
  219    H    TYR  33           HN       TYR  33 -10.260  -0.729  -4.197
  220    HA   TYR  33           HA       TYR  33  -8.404   1.547  -4.390
  221   1HB   TYR  33          HB2       TYR  33  -8.618  -0.552  -2.740
  222   2HB   TYR  33          HB1       TYR  33  -7.557  -1.284  -3.944
  223    HD1  TYR  33           HD1      TYR  33  -5.456  -1.360  -2.891
  224    HD2  TYR  33           HD2      TYR  33  -7.728   2.285  -2.836
  225    HE1  TYR  33           HE1      TYR  33  -3.520  -0.166  -1.917
  226    HE2  TYR  33           HE2      TYR  33  -5.786   3.481  -1.865
  227    HH   TYR  33           HH       TYR  33  -3.390   3.264  -1.705
  228    H    ARG  34           HN       ARG  34  -8.430   1.940  -6.710
  229    HA   ARG  34           HA       ARG  34  -7.598  -0.245  -8.520
  230   1HB   ARG  34          HB2       ARG  34  -8.156   2.708  -8.961
  231   2HB   ARG  34          HB1       ARG  34  -7.989   1.494 -10.229
  232   1HG   ARG  34          HG2       ARG  34  -9.948   0.302  -9.414
  233   2HG   ARG  34          HG1       ARG  34 -10.079   1.395  -8.035
  234   1HD   ARG  34          HD2       ARG  34 -11.669   2.023  -9.849
  235   2HD   ARG  34          HD1       ARG  34 -10.461   3.297  -9.588
  236    HE   ARG  34           HE       ARG  34  -9.481   2.746 -11.680
  237   1HH1  ARG  34          HH11      ARG  34 -12.390   1.833 -12.251
  238   2HH1  ARG  34          HH12      ARG  34 -12.088   0.312 -13.021
  239   1HH2  ARG  34          HH21      ARG  34  -8.787   0.137 -11.975
  240   2HH2  ARG  34          HH22      ARG  34 -10.049  -0.648 -12.864
  241    H    GLY  35           HN       GLY  35  -5.565   0.162  -6.686
  242   1HA   GLY  35          HA2       GLY  35  -3.434   1.243  -8.425
  243   2HA   GLY  35          HA1       GLY  35  -3.607   2.001  -6.842
  244    H    SER  36           HN       SER  36  -1.226   0.853  -7.212
  245    HA   SER  36           HA       SER  36  -1.391  -1.863  -5.956
  246   1HB   SER  36          HB2       SER  36   0.922  -2.076  -6.892
  247   2HB   SER  36          HB1       SER  36  -0.285  -1.758  -8.134
  248    HG   SER  36           HG       SER  36   1.445  -0.372  -8.437
  249    H    PHE  37           HN       PHE  37  -1.797  -0.392  -3.929
  250    HA   PHE  37           HA       PHE  37   0.417   1.138  -2.852
  251   1HB   PHE  37          HB2       PHE  37  -2.144   1.154  -2.357
  252   2HB   PHE  37          HB1       PHE  37  -1.774  -0.175  -1.258
  253    HD1  PHE  37           HD1      PHE  37  -0.616   0.191   0.810
  254    HD2  PHE  37           HD2      PHE  37  -1.069   3.386  -2.024
  255    HE1  PHE  37           HE1      PHE  37   0.175   1.811   2.512
  256    HE2  PHE  37           HE2      PHE  37  -0.278   5.007  -0.322
  257    HZ   PHE  37           HZ       PHE  37   0.344   4.221   1.946
  258    H    SER  38           HN       SER  38   2.019  -0.723  -3.362
  259    HA   SER  38           HA       SER  38   2.013  -3.123  -1.786
  260   1HB   SER  38          HB2       SER  38   3.866  -1.549  -3.505
  261   2HB   SER  38          HB1       SER  38   4.599  -2.738  -2.433
  262    HG   SER  38           HG       SER  38   3.509  -4.327  -3.435
  263    H    THR  39           HN       THR  39   1.483  -0.927   0.041
  264    HA   THR  39           HA       THR  39   3.951  -1.062   1.733
  265    HB   THR  39           HB       THR  39   2.081   1.291   1.762
  266    HG1  THR  39           HG1      THR  39   4.129   0.772  -0.125
  267   1HG2  THR  39          HG21      THR  39   4.367   2.409   2.150
  268   2HG2  THR  39          HG22      THR  39   4.997   0.772   2.337
  269   3HG2  THR  39          HG23      THR  39   3.753   1.370   3.436
  270    H    THR  40           HN       THR  40   3.520  -1.268   4.006
  271    HA   THR  40           HA       THR  40   0.781  -2.242   4.640
  272    HB   THR  40           HB       THR  40   2.089  -2.890   6.795
  273    HG1  THR  40           HG1      THR  40   3.819  -1.374   6.076
  274   1HG2  THR  40          HG21      THR  40   1.947  -4.851   5.706
  275   2HG2  THR  40          HG22      THR  40   3.488  -4.480   4.934
  276   3HG2  THR  40          HG23      THR  40   1.975  -4.034   4.144
  277    H    VAL  41           HN       VAL  41   0.182  -1.688   7.080
  278    HA   VAL  41           HA       VAL  41  -0.257   1.168   7.230
  279    HB   VAL  41           HB       VAL  41  -0.731  -1.243   8.983
  280   1HG1  VAL  41          HG11      VAL  41  -0.834   0.083  10.805
  281   2HG1  VAL  41          HG12      VAL  41  -2.211   0.887  10.052
  282   3HG1  VAL  41          HG13      VAL  41  -0.585   1.533   9.834
  283   1HG2  VAL  41          HG21      VAL  41  -2.992  -0.947   8.365
  284   2HG2  VAL  41          HG22      VAL  41  -2.107  -0.580   6.885
  285   3HG2  VAL  41          HG23      VAL  41  -2.733   0.730   7.885
  286    H    THR  42           HN       THR  42   1.821  -1.090   9.074
  287    HA   THR  42           HA       THR  42   2.892   0.822  10.905
  288    HB   THR  42           HB       THR  42   4.138  -1.673   9.703
  289    HG1  THR  42           HG1      THR  42   2.167  -1.200  11.613
  290   1HG2  THR  42          HG21      THR  42   5.659  -0.149  11.018
  291   2HG2  THR  42          HG22      THR  42   5.473  -1.761  11.708
  292   3HG2  THR  42          HG23      THR  42   4.602  -0.397  12.408
  293    H    GLY  43           HN       GLY  43   3.329   0.532   7.529
  294   1HA   GLY  43          HA2       GLY  43   4.539   2.151   6.220
  295   2HA   GLY  43          HA1       GLY  43   5.518   2.528   7.638
  296    H    ARG  44           HN       ARG  44   5.153  -0.807   7.303
  297    HA   ARG  44           HA       ARG  44   7.968  -1.100   6.484
  298   1HB   ARG  44          HB2       ARG  44   6.230  -2.397   8.185
  299   2HB   ARG  44          HB1       ARG  44   6.271  -3.486   6.797
  300   1HG   ARG  44          HG2       ARG  44   8.879  -3.067   6.947
  301   2HG   ARG  44          HG1       ARG  44   8.500  -2.657   8.621
  302   1HD   ARG  44          HD2       ARG  44   7.488  -5.216   7.358
  303   2HD   ARG  44          HD1       ARG  44   9.065  -5.127   8.169
  304    HE   ARG  44           HE       ARG  44   6.459  -4.972   9.490
  305   1HH1  ARG  44          HH21      ARG  44   9.728  -5.436   9.918
  306   2HH1  ARG  44          HH22      ARG  44   9.825  -4.680  11.472
  307   1HH2  ARG  44          HH11      ARG  44   6.599  -3.417  11.355
  308   2HH2  ARG  44          HH12      ARG  44   8.055  -3.536  12.286
  309    H    THR  45           HN       THR  45   7.881  -3.494   5.099
  310    HA   THR  45           HA       THR  45   6.555  -2.684   2.533
  311    HB   THR  45           HB       THR  45   9.110  -4.149   3.217
  312    HG1  THR  45           HG1      THR  45   8.933  -2.107   1.353
  313   1HG2  THR  45          HG21      THR  45   7.929  -5.333   1.380
  314   2HG2  THR  45          HG22      THR  45   9.410  -4.554   0.823
  315   3HG2  THR  45          HG23      THR  45   7.844  -3.817   0.484
  316    H    CYS  46           HN       CYS  46   4.750  -3.930   2.231
  317    HA   CYS  46           HA       CYS  46   4.187  -6.404   3.490
  318   1HB   CYS  46          HB2       CYS  46   2.457  -5.003   2.604
  319   2HB   CYS  46          HB1       CYS  46   3.189  -5.012   1.002
  320    H    GLN  47           HN       GLN  47   4.268  -8.569   2.627
  321    HA   GLN  47           HA       GLN  47   6.485  -9.014   0.724
  322   1HB   GLN  47          HB2       GLN  47   6.506 -10.321   2.712
  323   2HB   GLN  47          HB1       GLN  47   4.799 -10.726   2.558
  324   1HG   GLN  47          HG2       GLN  47   6.155 -12.643   1.884
  325   2HG   GLN  47          HG1       GLN  47   5.329 -11.985   0.471
  326   1HE2  GLN  47          HE21      GLN  47   8.434 -11.382   2.231
  327   2HE2  GLN  47          HE22      GLN  47   9.369 -11.242   0.822
  328    H    SER  48           HN       SER  48   6.247 -10.182  -1.227
  329    HA   SER  48           HA       SER  48   3.993  -9.843  -2.856
  330   1HB   SER  48          HB2       SER  48   6.328 -11.734  -2.777
  331   2HB   SER  48          HB1       SER  48   5.111 -11.890  -4.041
  332    HG   SER  48           HG       SER  48   6.413 -10.441  -4.922
  333    H    TRP  49           HN       TRP  49   2.219 -11.235  -3.360
  334    HA   TRP  49           HA       TRP  49   1.217 -12.871  -1.207
  335   1HB   TRP  49          HB2       TRP  49   0.467 -12.659  -4.143
  336   2HB   TRP  49          HB1       TRP  49  -0.536 -13.394  -2.892
  337    HD1  TRP  49           HD1      TRP  49   0.717 -10.016  -4.125
  338    HE1  TRP  49           HE1      TRP  49  -0.651  -8.170  -2.984
  339    HE3  TRP  49           HE3      TRP  49  -1.892 -12.777  -0.788
  340    HZ2  TRP  49           HZ2      TRP  49  -2.590  -7.884  -0.927
  341    HZ3  TRP  49           HZ3      TRP  49  -3.507 -11.721   0.769
  342    HH2  TRP  49           HH2      TRP  49  -3.860  -9.268   0.701
  343    H    SER  50           HN       SER  50   2.890 -13.525  -4.250
  344    HA   SER  50           HA       SER  50   2.712 -16.429  -4.031
  345   1HB   SER  50          HB2       SER  50   2.869 -15.055  -6.129
  346   2HB   SER  50          HB1       SER  50   4.523 -14.644  -5.684
  347    HG   SER  50           HG       SER  50   3.585 -17.312  -5.885
  348    H    SER  51           HN       SER  51   4.120 -14.705  -1.824
  349    HA   SER  51           HA       SER  51   6.925 -15.338  -1.916
  350   1HB   SER  51          HB2       SER  51   5.598 -13.604  -0.525
  351   2HB   SER  51          HB1       SER  51   5.227 -14.945   0.555
  352    HG   SER  51           HG       SER  51   7.838 -14.175  -0.258
  353    H    MET  52           HN       MET  52   7.941 -17.225  -1.310
  354    HA   MET  52           HA       MET  52   6.245 -19.369  -0.059
  355   1HB   MET  52          HB2       MET  52   8.533 -19.812  -1.983
  356   2HB   MET  52          HB1       MET  52   7.220 -20.909  -1.578
  357   1HG   MET  52          HG2       MET  52   6.073 -18.496  -2.592
  358   2HG   MET  52          HG1       MET  52   7.318 -19.036  -3.714
  359   1HE   MET  52          HE1       MET  52   3.949 -19.145  -2.541
  360   2HE   MET  52          HE2       MET  52   4.498 -20.357  -1.388
  361   3HE   MET  52          HE3       MET  52   3.336 -20.801  -2.637
  362    H    THR  53           HN       THR  53   8.849 -17.333   0.400
  363    HA   THR  53           HA       THR  53  10.596 -19.289   1.767
  364    HB   THR  53           HB       THR  53  11.508 -16.682   2.215
  365    HG1  THR  53           HG1      THR  53  10.723 -16.820  -0.471
  366   1HG2  THR  53          HG21      THR  53  13.281 -17.354   0.878
  367   2HG2  THR  53          HG22      THR  53  12.231 -18.164  -0.285
  368   3HG2  THR  53          HG23      THR  53  12.562 -18.914   1.277
  369    HA   PRO  54           HA       PRO  54   9.446 -16.685   5.554
  370   1HB   PRO  54          HB2       PRO  54   7.781 -14.533   5.268
  371   2HB   PRO  54          HB1       PRO  54   9.543 -14.423   5.095
  372   1HG   PRO  54          HG2       PRO  54   7.439 -14.533   3.001
  373   2HG   PRO  54          HG1       PRO  54   8.956 -13.622   3.034
  374   1HD   PRO  54          HD2       PRO  54   8.598 -15.945   1.622
  375   2HD   PRO  54          HD1       PRO  54  10.172 -15.367   2.210
  376    H    HIS  55           HN       HIS  55   6.410 -15.479   4.268
  377    HA   HIS  55           HA       HIS  55   5.001 -17.697   5.696
  378   1HB   HIS  55          HB2       HIS  55   3.540 -15.344   4.589
  379   2HB   HIS  55          HB1       HIS  55   3.360 -16.140   6.150
  380    HD1  HIS  55           HD1      HIS  55   5.591 -13.682   4.340
  381    HD2  HIS  55           HD2      HIS  55   4.855 -14.980   8.231
  382    HE1  HIS  55           HE1      HIS  55   6.922 -12.169   5.858
  383    H    TRP  56           HN       TRP  56   5.449 -19.179   3.805
  384    HA   TRP  56           HA       TRP  56   4.616 -18.787   1.150
  385   1HB   TRP  56          HB2       TRP  56   5.842 -20.746   2.117
  386   2HB   TRP  56          HB1       TRP  56   4.337 -21.281   2.863
  387    HD1  TRP  56           HD1      TRP  56   2.296 -20.973   0.625
  388    HE1  TRP  56           HE1      TRP  56   2.375 -22.330  -1.514
  389    HE3  TRP  56           HE3      TRP  56   7.200 -22.232   0.644
  390    HZ2  TRP  56           HZ2      TRP  56   4.281 -23.786  -3.059
  391    HZ3  TRP  56           HZ3      TRP  56   8.129 -23.591  -1.196
  392    HH2  TRP  56           HH2      TRP  56   6.690 -24.383  -3.043
  393    H    HIS  57           HN       HIS  57   2.585 -18.655   0.168
  394    HA   HIS  57           HA       HIS  57   0.216 -19.205   1.917
  395   1HB   HIS  57          HB2       HIS  57  -0.755 -17.209   1.160
  396   2HB   HIS  57          HB1       HIS  57   0.950 -16.773   1.233
  397    HD1  HIS  57           HD1      HIS  57   1.538 -18.556  -1.462
  398    HD2  HIS  57           HD2      HIS  57  -1.142 -15.391  -1.039
  399    HE1  HIS  57           HE1      HIS  57   1.132 -17.648  -3.789
  400    H    GLN  58           HN       GLN  58  -1.751 -18.890  -0.047
  401    HA   GLN  58           HA       GLN  58  -1.076 -20.816  -2.221
  402   1HB   GLN  58          HB2       GLN  58  -2.428 -21.406   0.239
  403   2HB   GLN  58          HB1       GLN  58  -3.593 -21.543  -1.077
  404   1HG   GLN  58          HG2       GLN  58  -2.661 -23.463  -1.788
  405   2HG   GLN  58          HG1       GLN  58  -1.061 -22.722  -1.842
  406   1HE2  GLN  58          HE21      GLN  58  -1.654 -25.442  -0.855
  407   2HE2  GLN  58          HE22      GLN  58  -1.194 -25.474   0.779
  408    H    ARG  59           HN       ARG  59  -1.884 -17.896  -1.989
  409    HA   ARG  59           HA       ARG  59  -4.352 -18.044  -3.690
  410   1HB   ARG  59          HB2       ARG  59  -3.717 -16.621  -1.217
  411   2HB   ARG  59          HB1       ARG  59  -4.276 -15.528  -2.483
  412   1HG   ARG  59          HG2       ARG  59  -6.384 -16.405  -2.493
  413   2HG   ARG  59          HG1       ARG  59  -5.808 -18.049  -2.216
  414   1HD   ARG  59          HD2       ARG  59  -5.173 -17.034   0.180
  415   2HD   ARG  59          HD1       ARG  59  -6.504 -15.931  -0.223
  416    HE   ARG  59           HE       ARG  59  -7.870 -18.023  -0.698
  417   1HH1  ARG  59          HH21      ARG  59  -6.354 -17.514   2.158
  418   2HH1  ARG  59          HH22      ARG  59  -6.275 -19.170   2.660
  419   1HH2  ARG  59          HH11      ARG  59  -7.217 -20.429  -0.430
  420   2HH2  ARG  59          HH12      ARG  59  -6.763 -20.819   1.195
  421    H    THR  60           HN       THR  60  -1.495 -18.002  -4.512
  422    HA   THR  60           HA       THR  60  -0.411 -15.553  -5.295
  423    HB   THR  60           HB       THR  60   0.610 -17.729  -5.736
  424    HG1  THR  60           HG1      THR  60   0.497 -17.233  -8.303
  425   1HG2  THR  60          HG21      THR  60  -1.109 -19.218  -6.219
  426   2HG2  THR  60          HG22      THR  60  -0.422 -18.955  -7.822
  427   3HG2  THR  60          HG23      THR  60  -1.887 -18.101  -7.340
  428    H    THR  61           HN       THR  61  -0.370 -14.912  -7.754
  429    HA   THR  61           HA       THR  61  -2.953 -13.844  -8.443
  430    HB   THR  61           HB       THR  61  -1.462 -13.630 -10.701
  431    HG1  THR  61           HG1      THR  61   0.592 -13.983 -10.324
  432   1HG2  THR  61          HG21      THR  61  -1.515 -11.498  -9.999
  433   2HG2  THR  61          HG22      THR  61  -0.342 -11.854  -8.731
  434   3HG2  THR  61          HG23      THR  61  -2.065 -12.069  -8.424
  435    H    GLU  62           HN       GLU  62  -1.534 -16.938  -8.796
  436    HA   GLU  62           HA       GLU  62  -2.648 -17.748 -11.293
  437   1HB   GLU  62          HB2       GLU  62  -0.881 -18.858  -9.751
  438   2HB   GLU  62          HB1       GLU  62  -2.263 -19.493  -8.856
  439   1HG   GLU  62          HG2       GLU  62  -1.782 -21.201 -10.411
  440   2HG   GLU  62          HG1       GLU  62  -3.113 -20.318 -11.162
  441    H    TYR  63           HN       TYR  63  -3.870 -17.365  -8.067
  442    HA   TYR  63           HA       TYR  63  -6.431 -18.663  -8.720
  443   1HB   TYR  63          HB2       TYR  63  -4.932 -17.753  -6.350
  444   2HB   TYR  63          HB1       TYR  63  -6.672 -17.482  -6.244
  445    HD1  TYR  63           HD1      TYR  63  -4.212 -19.764  -5.436
  446    HD2  TYR  63           HD2      TYR  63  -8.050 -19.599  -7.357
  447    HE1  TYR  63           HE1      TYR  63  -4.558 -22.171  -4.951
  448    HE2  TYR  63           HE2      TYR  63  -8.396 -22.006  -6.872
  449    HH   TYR  63           HH       TYR  63  -7.616 -23.789  -5.779
  450    H    TYR  64           HN       TYR  64  -4.980 -15.705  -9.237
  451    HA   TYR  64           HA       TYR  64  -7.635 -14.322  -9.406
  452   1HB   TYR  64          HB2       TYR  64  -4.990 -13.356  -8.277
  453   2HB   TYR  64          HB1       TYR  64  -6.329 -12.269  -8.650
  454    HD1  TYR  64           HD1      TYR  64  -8.715 -13.503  -7.813
  455    HD2  TYR  64           HD2      TYR  64  -4.834 -13.793  -5.995
  456    HE1  TYR  64           HE1      TYR  64  -9.775 -14.056  -5.641
  457    HE2  TYR  64           HE2      TYR  64  -5.894 -14.345  -3.821
  458    HH   TYR  64           HH       TYR  64  -9.441 -14.429  -3.476
  459    HA   PRO  65           HA       PRO  65  -5.547 -14.110 -13.445
  460   1HB   PRO  65          HB2       PRO  65  -7.867 -13.962 -14.891
  461   2HB   PRO  65          HB1       PRO  65  -7.171 -15.495 -14.332
  462   1HG   PRO  65          HG2       PRO  65  -9.419 -13.913 -13.195
  463   2HG   PRO  65          HG1       PRO  65  -9.234 -15.667 -13.340
  464   1HD   PRO  65          HD2       PRO  65  -8.832 -14.293 -11.015
  465   2HD   PRO  65          HD1       PRO  65  -8.032 -15.832 -11.401
  466    H    ASN  66           HN       ASN  66  -7.820 -12.022 -11.836
  467    HA   ASN  66           HA       ASN  66  -6.665  -9.697 -13.270
  468   1HB   ASN  66          HB2       ASN  66  -8.908 -10.857 -14.252
  469   2HB   ASN  66          HB1       ASN  66  -9.630  -9.746 -13.086
  470   1HD2  ASN  66          HD21      ASN  66  -9.885  -9.410 -15.959
  471   2HD2  ASN  66          HD22      ASN  66  -9.083  -7.976 -16.381
  472    H    GLY  67           HN       GLY  67  -5.951  -9.866 -10.791
  473   1HA   GLY  67          HA2       GLY  67  -7.957  -8.306  -9.207
  474   2HA   GLY  67          HA1       GLY  67  -6.873  -9.484  -8.466
  475    H    GLY  68           HN       GLY  68  -4.723  -8.503 -10.438
  476   1HA   GLY  68          HA2       GLY  68  -3.171  -6.709 -10.584
  477   2HA   GLY  68          HA1       GLY  68  -4.187  -5.777  -9.479
  478    H    LEU  69           HN       LEU  69  -3.633  -8.970  -8.456
  479    HA   LEU  69           HA       LEU  69  -2.188  -8.110  -6.105
  480   1HB   LEU  69          HB2       LEU  69  -3.202 -10.650  -7.327
  481   2HB   LEU  69          HB1       LEU  69  -2.055 -10.763  -5.990
  482    HG   LEU  69           HG       LEU  69  -4.678  -9.244  -5.967
  483   1HD1  LEU  69          HD11      LEU  69  -3.908 -11.964  -5.273
  484   2HD1  LEU  69          HD12      LEU  69  -5.517 -11.247  -5.352
  485   3HD1  LEU  69          HD13      LEU  69  -4.560 -11.105  -3.878
  486   1HD2  LEU  69          HD21      LEU  69  -3.438  -7.981  -4.497
  487   2HD2  LEU  69          HD22      LEU  69  -2.290  -9.281  -4.195
  488   3HD2  LEU  69          HD23      LEU  69  -3.861  -9.295  -3.399
  489    H    THR  70           HN       THR  70  -0.554  -7.162  -7.934
  490    HA   THR  70           HA       THR  70   1.480  -9.114  -8.791
  491    HB   THR  70           HB       THR  70   1.409  -6.078  -8.854
  492    HG1  THR  70           HG1      THR  70  -0.320  -6.943  -9.983
  493   1HG2  THR  70          HG21      THR  70   2.976  -8.028 -10.559
  494   2HG2  THR  70          HG22      THR  70   3.648  -7.177  -9.169
  495   3HG2  THR  70          HG23      THR  70   3.097  -6.269 -10.576
  496    H    ARG  71           HN       ARG  71   3.580  -9.274  -7.879
  497    HA   ARG  71           HA       ARG  71   5.047  -9.352  -6.010
  498   1HB   ARG  71          HB2       ARG  71   4.925  -6.899  -7.261
  499   2HB   ARG  71          HB1       ARG  71   4.671  -6.459  -5.571
  500   1HG   ARG  71          HG2       ARG  71   6.690  -8.050  -5.107
  501   2HG   ARG  71          HG1       ARG  71   7.035  -7.839  -6.824
  502   1HD   ARG  71          HD2       ARG  71   6.542  -5.240  -5.968
  503   2HD   ARG  71          HD1       ARG  71   7.443  -5.956  -4.617
  504    HE   ARG  71           HE       ARG  71   8.534  -5.406  -7.236
  505   1HH1  ARG  71          HH21      ARG  71   9.152  -6.691  -4.202
  506   2HH1  ARG  71          HH22      ARG  71  10.458  -7.712  -4.704
  507   1HH2  ARG  71          HH11      ARG  71   9.953  -7.143  -8.087
  508   2HH2  ARG  71          HH12      ARG  71  10.912  -7.968  -6.903
  509    H    ASN  72           HN       ASN  72   4.837  -7.198  -3.869
  510    HA   ASN  72           HA       ASN  72   2.921  -8.638  -2.153
  511   1HB   ASN  72          HB2       ASN  72   4.014  -7.477  -0.406
  512   2HB   ASN  72          HB1       ASN  72   5.284  -7.794  -1.585
  513   1HD2  ASN  72          HD21      ASN  72   2.867  -5.224  -0.788
  514   2HD2  ASN  72          HD22      ASN  72   3.900  -3.941  -1.181
  515    H    TYR  73           HN       TYR  73   2.156  -6.691  -4.475
  516    HA   TYR  73           HA       TYR  73   1.069  -4.276  -3.833
  517   1HB   TYR  73          HB2       TYR  73   0.053  -6.650  -5.369
  518   2HB   TYR  73          HB1       TYR  73  -0.985  -5.234  -5.209
  519    HD1  TYR  73           HD1      TYR  73  -0.890  -4.639  -7.571
  520    HD2  TYR  73           HD2      TYR  73   2.693  -4.984  -5.225
  521    HE1  TYR  73           HE1      TYR  73   0.392  -3.494  -9.359
  522    HE2  TYR  73           HE2      TYR  73   3.974  -3.839  -7.014
  523    HH   TYR  73           HH       TYR  73   3.537  -3.608  -9.726
  524    H    CYS  74           HN       CYS  74  -0.819  -3.506  -2.810
  525    HA   CYS  74           HA       CYS  74  -1.840  -5.183  -0.589
  526   1HB   CYS  74          HB2       CYS  74  -1.578  -2.306  -1.304
  527   2HB   CYS  74          HB1       CYS  74  -2.935  -2.732  -0.261
  528    H    ARG  75           HN       ARG  75  -3.701  -6.322  -0.976
  529    HA   ARG  75           HA       ARG  75  -5.807  -5.060  -2.707
  530   1HB   ARG  75          HB2       ARG  75  -4.391  -7.617  -2.798
  531   2HB   ARG  75          HB1       ARG  75  -6.140  -7.831  -2.791
  532   1HG   ARG  75          HG2       ARG  75  -5.183  -7.594  -5.098
  533   2HG   ARG  75          HG1       ARG  75  -6.378  -6.355  -4.712
  534   1HD   ARG  75          HD2       ARG  75  -4.677  -4.707  -4.321
  535   2HD   ARG  75          HD1       ARG  75  -3.395  -5.935  -4.349
  536    HE   ARG  75           HE       ARG  75  -4.310  -6.352  -6.783
  537   1HH1  ARG  75          HH21      ARG  75  -2.477  -3.897  -5.843
  538   2HH1  ARG  75          HH22      ARG  75  -3.084  -2.695  -6.932
  539   1HH2  ARG  75          HH11      ARG  75  -5.843  -4.571  -7.882
  540   2HH2  ARG  75          HH12      ARG  75  -4.990  -3.077  -8.087
  541    H    ASN  76           HN       ASN  76  -8.046  -5.713  -2.075
  542    HA   ASN  76           HA       ASN  76  -8.230  -6.633   0.777
  543   1HB   ASN  76          HB2       ASN  76  -8.563  -4.214   0.597
  544   2HB   ASN  76          HB1       ASN  76  -9.753  -4.449  -0.684
  545   1HD2  ASN  76          HD21      ASN  76 -11.884  -5.200  -0.081
  546   2HD2  ASN  76          HD22      ASN  76 -12.382  -5.294   1.540
  547    HA   PRO  77           HA       PRO  77 -11.038  -9.121  -1.923
  548   1HB   PRO  77          HB2       PRO  77  -9.947 -11.570  -1.407
  549   2HB   PRO  77          HB1       PRO  77  -9.363 -10.509  -2.702
  550   1HG   PRO  77          HG2       PRO  77  -8.162 -11.117  -0.081
  551   2HG   PRO  77          HG1       PRO  77  -7.389 -10.633  -1.595
  552   1HD   PRO  77          HD2       PRO  77  -7.901  -8.989   0.630
  553   2HD   PRO  77          HD1       PRO  77  -7.378  -8.461  -0.983
  554    H    ASP  78           HN       ASP  78 -10.938  -8.331   1.108
  555    HA   ASP  78           HA       ASP  78 -12.703 -10.571   2.044
  556   1HB   ASP  78          HB2       ASP  78 -10.195  -9.611   3.037
  557   2HB   ASP  78          HB1       ASP  78 -11.437  -9.226   4.228
  558    H    ALA  79           HN       ALA  79 -12.816  -7.495   1.027
  559    HA   ALA  79           HA       ALA  79 -14.301  -5.697   1.423
  560   1HB   ALA  79          HB1       ALA  79 -16.431  -6.475   1.820
  561   2HB   ALA  79          HB2       ALA  79 -15.932  -7.408   3.231
  562   3HB   ALA  79          HB3       ALA  79 -15.650  -8.042   1.609
  563    H    GLU  80           HN       GLU  80 -12.033  -6.132   3.279
  564    HA   GLU  80           HA       GLU  80 -13.090  -5.440   5.953
  565   1HB   GLU  80          HB2       GLU  80 -10.727  -6.583   4.769
  566   2HB   GLU  80          HB1       GLU  80 -10.262  -5.208   5.772
  567   1HG   GLU  80          HG2       GLU  80 -10.342  -7.316   7.080
  568   2HG   GLU  80          HG1       GLU  80 -11.511  -6.133   7.667
  569    H    ILE  81           HN       ILE  81 -11.830  -3.530   7.047
  570    HA   ILE  81           HA       ILE  81 -12.570  -1.064   6.045
  571    HB   ILE  81           HB       ILE  81 -10.612  -0.216   7.430
  572   1HG1  ILE  81          HG12      ILE  81  -9.811  -2.523   8.736
  573   2HG1  ILE  81          HG11      ILE  81  -9.846  -3.022   7.045
  574   1HG2  ILE  81          HG21      ILE  81 -12.549  -0.479   8.691
  575   2HG2  ILE  81          HG22      ILE  81 -11.446  -1.575   9.524
  576   3HG2  ILE  81          HG23      ILE  81 -12.633  -2.214   8.387
  577   1HD1  ILE  81          HD11      ILE  81  -7.979  -1.851   6.609
  578   2HD1  ILE  81          HD12      ILE  81  -7.851  -1.501   8.333
  579   3HD1  ILE  81          HD13      ILE  81  -8.703  -0.384   7.267
  580    H    SER  82           HN       SER  82  -9.612  -2.870   5.219
  581    HA   SER  82           HA       SER  82  -9.348  -1.348   2.723
  582   1HB   SER  82          HB2       SER  82  -8.149  -0.423   5.110
  583   2HB   SER  82          HB1       SER  82  -6.843  -1.115   4.153
  584    HG   SER  82           HG       SER  82  -8.738   0.499   2.875
  585    HA   PRO  83           HA       PRO  83  -7.038  -4.840   1.419
  586   1HB   PRO  83          HB2       PRO  83  -4.807  -3.833   0.201
  587   2HB   PRO  83          HB1       PRO  83  -6.433  -3.705  -0.500
  588   1HG   PRO  83          HG2       PRO  83  -4.844  -1.673   0.983
  589   2HG   PRO  83          HG1       PRO  83  -5.898  -1.473  -0.426
  590   1HD   PRO  83          HD2       PRO  83  -6.650  -0.828   2.115
  591   2HD   PRO  83          HD1       PRO  83  -7.795  -1.323   0.850
  592    H    TRP  84           HN       TRP  84  -5.628  -6.312   2.285
  593    HA   TRP  84           HA       TRP  84  -3.392  -5.324   4.028
  594   1HB   TRP  84          HB2       TRP  84  -4.065  -7.165   5.599
  595   2HB   TRP  84          HB1       TRP  84  -5.317  -5.937   5.411
  596    HD1  TRP  84           HD1      TRP  84  -7.590  -6.665   4.441
  597    HE1  TRP  84           HE1      TRP  84  -8.569  -8.903   3.619
  598    HE3  TRP  84           HE3      TRP  84  -3.345  -9.504   4.346
  599    HZ2  TRP  84           HZ2      TRP  84  -7.671 -11.549   3.003
  600    HZ3  TRP  84           HZ3      TRP  84  -3.436 -11.878   3.638
  601    HH2  TRP  84           HH2      TRP  84  -5.592 -12.903   2.967
  602    H    CYS  85           HN       CYS  85  -1.944  -7.404   4.575
  603    HA   CYS  85           HA       CYS  85  -1.966  -9.632   2.756
  604   1HB   CYS  85          HB2       CYS  85  -0.123  -8.861   1.271
  605   2HB   CYS  85          HB1       CYS  85  -1.555  -7.844   1.122
  606    H    TYR  86           HN       TYR  86   0.736 -10.163   2.491
  607    HA   TYR  86           HA       TYR  86   1.513 -10.698   5.290
  608   1HB   TYR  86          HB2       TYR  86   3.019 -11.418   2.768
  609   2HB   TYR  86          HB1       TYR  86   2.967 -12.296   4.295
  610    HD1  TYR  86           HD1      TYR  86   2.160 -12.964   1.188
  611    HD2  TYR  86           HD2      TYR  86   0.052 -12.273   4.867
  612    HE1  TYR  86           HE1      TYR  86   0.257 -14.317   0.354
  613    HE2  TYR  86           HE2      TYR  86  -1.850 -13.626   4.032
  614    HH   TYR  86           HH       TYR  86  -2.573 -14.976   2.411
  615    H    THR  87           HN       THR  87   3.964 -10.410   5.773
  616    HA   THR  87           HA       THR  87   4.777  -7.658   4.913
  617    HB   THR  87           HB       THR  87   6.361  -8.395   7.039
  618    HG1  THR  87           HG1      THR  87   5.448 -10.191   7.666
  619   1HG2  THR  87          HG21      THR  87   4.528  -6.468   6.511
  620   2HG2  THR  87          HG22      THR  87   5.280  -6.694   8.091
  621   3HG2  THR  87          HG23      THR  87   3.684  -7.373   7.768
  622    H    MET  88           HN       MET  88   6.800  -7.341   3.966
  623    HA   MET  88           HA       MET  88   8.161  -9.578   2.739
  624   1HB   MET  88          HB2       MET  88   7.935  -7.196   1.914
  625   2HB   MET  88          HB1       MET  88   9.106  -6.729   3.148
  626   1HG   MET  88          HG2       MET  88  10.855  -7.617   2.000
  627   2HG   MET  88          HG1       MET  88   9.929  -9.033   1.501
  628   1HE   MET  88          HE1       MET  88  11.046  -7.818  -1.921
  629   2HE   MET  88          HE2       MET  88  10.552  -9.238  -1.002
  630   3HE   MET  88          HE3       MET  88  11.836  -8.201  -0.385
  631    H    ASP  89           HN       ASP  89   8.175  -8.783   5.943
  632    HA   ASP  89           HA       ASP  89  11.053  -9.508   6.270
  633   1HB   ASP  89          HB2       ASP  89   9.430  -7.346   7.249
  634   2HB   ASP  89          HB1       ASP  89   9.939  -8.333   8.620
  635    HA   PRO  90           HA       PRO  90   9.518 -13.115   8.257
  636   1HB   PRO  90          HB2       PRO  90  11.789 -13.790   9.632
  637   2HB   PRO  90          HB1       PRO  90  11.614 -14.016   7.880
  638   1HG   PRO  90          HG2       PRO  90  13.032 -11.873   9.379
  639   2HG   PRO  90          HG1       PRO  90  13.475 -12.676   7.865
  640   1HD   PRO  90          HD2       PRO  90  12.348 -10.182   7.995
  641   2HD   PRO  90          HD1       PRO  90  12.199 -11.264   6.594
  642    H    ASN  91           HN       ASN  91  10.039 -10.217   9.771
  643    HA   ASN  91           HA       ASN  91   9.702 -11.250  12.538
  644   1HB   ASN  91          HB2       ASN  91   9.996  -8.427  11.457
  645   2HB   ASN  91          HB1       ASN  91  10.174  -8.929  13.139
  646   1HD2  ASN  91          HD21      ASN  91  12.057  -8.004  10.641
  647   2HD2  ASN  91          HD22      ASN  91  13.426  -8.971  10.905
  648    H    VAL  92           HN       VAL  92   7.801 -10.333   9.894
  649    HA   VAL  92           HA       VAL  92   5.479  -9.771  11.706
  650    HB   VAL  92           HB       VAL  92   6.192  -8.487   9.042
  651   1HG1  VAL  92          HG11      VAL  92   3.798  -8.574   9.262
  652   2HG1  VAL  92          HG12      VAL  92   4.283  -6.942   9.725
  653   3HG1  VAL  92          HG13      VAL  92   3.875  -8.127  10.966
  654   1HG2  VAL  92          HG21      VAL  92   7.335  -6.955  10.238
  655   2HG2  VAL  92          HG22      VAL  92   7.098  -7.945  11.679
  656   3HG2  VAL  92          HG23      VAL  92   5.936  -6.680  11.277
  657    H    ARG  93           HN       ARG  93   3.605 -10.908  11.138
  658    HA   ARG  93           HA       ARG  93   3.838 -12.982   9.103
  659   1HB   ARG  93          HB2       ARG  93   2.558 -12.637  11.547
  660   2HB   ARG  93          HB1       ARG  93   1.238 -12.577  10.379
  661   1HG   ARG  93          HG2       ARG  93   3.337 -14.760  10.521
  662   2HG   ARG  93          HG1       ARG  93   1.689 -14.896  11.136
  663   1HD   ARG  93          HD2       ARG  93   2.003 -14.018   8.296
  664   2HD   ARG  93          HD1       ARG  93   2.314 -15.726   8.664
  665    HE   ARG  93           HE       ARG  93  -0.194 -14.401   9.616
  666   1HH1  ARG  93          HH21      ARG  93  -0.514 -15.385   6.865
  667   2HH1  ARG  93          HH22      ARG  93  -1.013 -17.029   7.090
  668   1HH2  ARG  93          HH11      ARG  93   0.035 -17.174  10.393
  669   2HH2  ARG  93          HH12      ARG  93  -0.702 -18.042   9.089
  670    H    TRP  94           HN       TRP  94   1.411 -10.458   9.798
  671    HA   TRP  94           HA       TRP  94   1.251  -9.726   6.941
  672   1HB   TRP  94          HB2       TRP  94  -1.060 -10.390   6.718
  673   2HB   TRP  94          HB1       TRP  94  -0.190 -11.782   7.361
  674    HD1  TRP  94           HD1      TRP  94  -0.788 -12.612   9.746
  675    HE1  TRP  94           HE1      TRP  94  -2.598 -11.956  11.460
  676    HE3  TRP  94           HE3      TRP  94  -2.469  -8.274   7.638
  677    HZ2  TRP  94           HZ2      TRP  94  -4.506  -9.868  11.882
  678    HZ3  TRP  94           HZ3      TRP  94  -4.283  -6.974   8.717
  679    HH2  TRP  94           HH2      TRP  94  -5.302  -7.764  10.834
  680    H    GLU  95           HN       GLU  95  -0.230  -7.794   6.686
  681    HA   GLU  95           HA       GLU  95  -1.172  -6.449   9.119
  682   1HB   GLU  95          HB2       GLU  95   1.513  -6.061   8.010
  683   2HB   GLU  95          HB1       GLU  95   0.617  -4.549   8.159
  684   1HG   GLU  95          HG2       GLU  95   0.025  -5.794  10.540
  685   2HG   GLU  95          HG1       GLU  95   1.692  -6.305  10.262
  686    H    TYR  96           HN       TYR  96  -2.320  -4.460   8.601
  687    HA   TYR  96           HA       TYR  96  -3.541  -4.476   5.952
  688   1HB   TYR  96          HB2       TYR  96  -3.764  -2.964   8.533
  689   2HB   TYR  96          HB1       TYR  96  -4.493  -2.260   7.089
  690    HD1  TYR  96           HD1      TYR  96  -4.716  -4.886   9.598
  691    HD2  TYR  96           HD2      TYR  96  -6.217  -3.543   5.803
  692    HE1  TYR  96           HE1      TYR  96  -6.649  -6.422   9.820
  693    HE2  TYR  96           HE2      TYR  96  -8.150  -5.081   6.024
  694    HH   TYR  96           HH       TYR  96  -9.350  -6.195   8.371
  695    H    CYS  97           HN       CYS  97  -3.619  -2.367   4.664
  696    HA   CYS  97           HA       CYS  97  -0.865  -1.236   4.499
  697   1HB   CYS  97          HB2       CYS  97  -3.176  -0.963   2.560
  698   2HB   CYS  97          HB1       CYS  97  -1.457  -0.765   2.220
  699    H    ASN  98           HN       ASN  98  -0.522   1.022   4.562
  700    HA   ASN  98           HA       ASN  98  -2.025   2.636   6.284
  701   1HB   ASN  98          HB2       ASN  98  -0.079   3.055   4.055
  702   2HB   ASN  98          HB1       ASN  98  -0.917   4.476   4.679
  703   1HD2  ASN  98          HD21      ASN  98   1.969   3.809   5.028
  704   2HD2  ASN  98          HD22      ASN  98   2.224   3.709   6.703
  705    H    LEU  99           HN       LEU  99  -4.310   2.276   5.694
  706    HA   LEU  99           HA       LEU  99  -5.155   4.121   3.511
  707   1HB   LEU  99          HB2       LEU  99  -5.799   1.186   3.839
  708   2HB   LEU  99          HB1       LEU  99  -6.780   2.255   2.834
  709    HG   LEU  99           HG       LEU  99  -3.784   2.017   2.512
  710   1HD1  LEU  99          HD11      LEU  99  -4.206   0.486   0.663
  711   2HD1  LEU  99          HD12      LEU  99  -5.945   0.583   0.943
  712   3HD1  LEU  99          HD13      LEU  99  -4.900  -0.183   2.139
  713   1HD2  LEU  99          HD21      LEU  99  -5.811   2.827   0.438
  714   2HD2  LEU  99          HD22      LEU  99  -4.099   3.239   0.532
  715   3HD2  LEU  99          HD23      LEU  99  -5.250   3.997   1.633
  716    H    THR 100           HN       THR 100  -6.944   5.272   4.051
  717    HA   THR 100           HA       THR 100  -8.574   4.422   6.407
  718    HB   THR 100           HB       THR 100  -8.616   6.847   6.971
  719    HG1  THR 100           HG1      THR 100  -6.477   7.322   5.283
  720   1HG2  THR 100          HG21      THR 100  -6.109   5.244   6.857
  721   2HG2  THR 100          HG22      THR 100  -6.987   5.855   8.260
  722   3HG2  THR 100          HG23      THR 100  -5.965   6.941   7.316
  723    H    GLN 101           HN       GLN 101 -10.804   5.298   6.306
  724    HA   GLN 101           HA       GLN 101 -12.123   4.993   3.849
  725   1HB   GLN 101          HB2       GLN 101 -12.660   5.990   6.527
  726   2HB   GLN 101          HB1       GLN 101 -13.592   6.878   5.321
  727   1HG   GLN 101          HG2       GLN 101 -14.477   4.800   4.405
  728   2HG   GLN 101          HG1       GLN 101 -13.466   3.854   5.498
  729   1HE2  GLN 101          HE21      GLN 101 -15.812   3.048   6.093
  730   2HE2  GLN 101          HE22      GLN 101 -16.599   3.901   7.332
  731    H    CYS 102           HN       CYS 102 -11.074   6.118   2.133
  732    HA   CYS 102           HA       CYS 102 -10.255   8.842   2.143
  733   1HB   CYS 102          HB2       CYS 102  -9.969   6.802   0.479
  734   2HB   CYS 102          HB1       CYS 102 -11.391   7.499  -0.293
  735    HA   PRO 103           HA       PRO 103 -14.173  10.899   2.084
  736   1HB   PRO 103          HB2       PRO 103 -13.291  13.355   1.257
  737   2HB   PRO 103          HB1       PRO 103 -13.046  12.748   2.907
  738   1HG   PRO 103          HG2       PRO 103 -11.140  12.846   0.625
  739   2HG   PRO 103          HG1       PRO 103 -10.854  13.130   2.349
  740   1HD   PRO 103          HD2       PRO 103 -10.208  10.805   1.069
  741   2HD   PRO 103          HD1       PRO 103 -10.584  10.906   2.803
  742    H    VAL 104           HN       VAL 104 -15.746  11.223   0.482
  743    HA   VAL 104           HA       VAL 104 -14.777  11.160  -2.358
  744    HB   VAL 104           HB       VAL 104 -17.387  10.165  -1.174
  745   1HG1  VAL 104          HG11      VAL 104 -16.718   8.810  -3.543
  746   2HG1  VAL 104          HG12      VAL 104 -16.374  10.508  -3.870
  747   3HG1  VAL 104          HG13      VAL 104 -17.984  10.021  -3.341
  748   1HG2  VAL 104          HG21      VAL 104 -15.125   9.044  -0.463
  749   2HG2  VAL 104          HG22      VAL 104 -15.130   8.405  -2.106
  750   3HG2  VAL 104          HG23      VAL 104 -16.453   8.020  -1.005
  751    H    THR 105           HN       THR 105 -17.600  12.223  -0.401
  752    HA   THR 105           HA       THR 105 -18.819  13.934  -2.246
  753    HB   THR 105           HB       THR 105 -18.445  14.545   0.696
  754    HG1  THR 105           HG1      THR 105 -20.440  13.112   0.696
  755   1HG2  THR 105          HG21      THR 105 -20.191  15.941   0.418
  756   2HG2  THR 105          HG22      THR 105 -21.112  14.716  -0.454
  757   3HG2  THR 105          HG23      THR 105 -19.964  15.737  -1.319
  758    H    GLU 106           HN       GLU 106 -16.757  15.248   0.371
  759    HA   GLU 106           HA       GLU 106 -15.424  17.206   0.383
  760   1HB   GLU 106          HB2       GLU 106 -14.778  15.463  -1.908
  761   2HB   GLU 106          HB1       GLU 106 -14.187  17.117  -2.073
  762   1HG   GLU 106          HG2       GLU 106 -13.639  16.410   0.589
  763   2HG   GLU 106          HG1       GLU 106 -13.207  14.988  -0.363
  764    H    SER 107           HN       SER 107 -18.221  17.319  -0.917
  765    HA   SER 107           HA       SER 107 -17.739  19.807  -2.528
  766   1HB   SER 107          HB2       SER 107 -18.643  17.512  -3.539
  767   2HB   SER 107          HB1       SER 107 -20.170  18.092  -2.879
  768    HG   SER 107           HG       SER 107 -19.650  20.109  -4.019
  769    H    SER 108           HN       SER 108 -18.140  21.287  -0.830
  770    HA   SER 108           HA       SER 108 -20.888  21.158   0.375
  771   1HB   SER 108          HB2       SER 108 -18.330  22.272   1.568
  772   2HB   SER 108          HB1       SER 108 -19.880  22.105   2.386
  773    HG   SER 108           HG       SER 108 -17.923  20.289   2.032
  774    H    VAL 109           HN       VAL 109 -18.829  22.855  -1.678
  775    HA   VAL 109           HA       VAL 109 -19.479  25.589  -1.021
  776    HB   VAL 109           HB       VAL 109 -17.553  24.809  -2.390
  777   1HG1  VAL 109          HG11      VAL 109 -19.066  24.508  -4.866
  778   2HG1  VAL 109          HG12      VAL 109 -19.507  23.283  -3.676
  779   3HG1  VAL 109          HG13      VAL 109 -17.826  23.459  -4.179
  780   1HG2  VAL 109          HG21      VAL 109 -17.720  26.987  -3.011
  781   2HG2  VAL 109          HG22      VAL 109 -19.473  26.890  -3.180
  782   3HG2  VAL 109          HG23      VAL 109 -18.429  26.366  -4.502
  783    H    LEU 110           HN       LEU 110 -21.395  23.079  -2.237
  784    HA   LEU 110           HA       LEU 110 -23.159  24.914  -3.793
  785   1HB   LEU 110          HB2       LEU 110 -23.009  21.901  -3.462
  786   2HB   LEU 110          HB1       LEU 110 -24.185  22.725  -4.486
  787    HG   LEU 110           HG       LEU 110 -21.200  23.123  -4.776
  788   1HD1  LEU 110          HD11      LEU 110 -22.386  20.723  -5.205
  789   2HD1  LEU 110          HD12      LEU 110 -21.037  21.319  -6.173
  790   3HD1  LEU 110          HD13      LEU 110 -22.691  21.496  -6.761
  791   1HD2  LEU 110          HD21      LEU 110 -23.632  23.761  -6.468
  792   2HD2  LEU 110          HD22      LEU 110 -21.983  23.841  -7.089
  793   3HD2  LEU 110          HD23      LEU 110 -22.481  24.900  -5.770
  794    H    ALA 111           HN       ALA 111 -24.028  25.989  -1.855
  795    HA   ALA 111           HA       ALA 111 -25.970  24.261  -0.353
  796   1HB   ALA 111          HB1       ALA 111 -24.884  26.765   0.845
  797   2HB   ALA 111          HB2       ALA 111 -23.760  25.416   0.682
  798   3HB   ALA 111          HB3       ALA 111 -25.244  25.219   1.615
  799    H    THR 112           HN       THR 112 -28.019  24.848  -0.955
  800    HA   THR 112           HA       THR 112 -28.781  27.081  -2.478
  801    HB   THR 112           HB       THR 112 -30.879  26.394  -0.656
  802    HG1  THR 112           HG1      THR 112 -29.702  24.073  -1.690
  803   1HG2  THR 112          HG21      THR 112 -30.228  25.378  -3.436
  804   2HG2  THR 112          HG22      THR 112 -31.109  26.861  -3.068
  805   3HG2  THR 112          HG23      THR 112 -31.805  25.295  -2.652
  806    H    SER 113           HN       SER 113 -30.052  29.010  -1.758
  807    HA   SER 113           HA       SER 113 -28.736  30.704   0.025
  808   1HB   SER 113          HB2       SER 113 -30.608  32.099  -0.286
  809   2HB   SER 113          HB1       SER 113 -30.692  31.031  -1.684
  810    HG   SER 113           HG       SER 113 -32.699  31.209  -0.575
  811    H    THR 114           HN       THR 114 -28.272  30.166   2.139
  812    HA   THR 114           HA       THR 114 -30.298  28.724   3.769
  813    HB   THR 114           HB       THR 114 -28.178  28.943   5.374
  814    HG1  THR 114           HG1      THR 114 -26.339  29.330   4.296
  815   1HG2  THR 114          HG21      THR 114 -28.220  27.194   2.898
  816   2HG2  THR 114          HG22      THR 114 -29.061  26.848   4.409
  817   3HG2  THR 114          HG23      THR 114 -27.298  26.879   4.368
  818    H    ALA 115           HN       ALA 115 -28.882  31.896   3.372
  819    HA   ALA 115           HA       ALA 115 -30.759  32.988   5.380
  820   1HB   ALA 115          HB1       ALA 115 -27.751  33.342   5.586
  821   2HB   ALA 115          HB2       ALA 115 -28.696  32.245   6.594
  822   3HB   ALA 115          HB3       ALA 115 -28.958  33.986   6.699
  823    H    VAL 116           HN       VAL 116 -31.067  33.543   2.781
  824    HA   VAL 116           HA       VAL 116 -29.719  36.192   2.351
  825    HB   VAL 116           HB       VAL 116 -30.802  34.162   0.369
  826   1HG1  VAL 116          HG11      VAL 116 -29.559  36.891   0.092
  827   2HG1  VAL 116          HG12      VAL 116 -30.984  36.237  -0.715
  828   3HG1  VAL 116          HG13      VAL 116 -29.376  35.694  -1.191
  829   1HG2  VAL 116          HG21      VAL 116 -28.136  34.371  -0.122
  830   2HG2  VAL 116          HG22      VAL 116 -28.831  33.149   0.944
  831   3HG2  VAL 116          HG23      VAL 116 -28.152  34.629   1.622
  832    H    SER 117           HN       SER 117 -32.048  36.079   3.933
  833    HA   SER 117           HA       SER 117 -34.314  36.776   2.134
  834   1HB   SER 117          HB2       SER 117 -34.535  35.194   4.073
  835   2HB   SER 117          HB1       SER 117 -34.138  36.527   5.153
  836    HG   SER 117           HG       SER 117 -35.969  37.625   4.310
  837    H    GLU 118           HN       GLU 118 -34.461  38.912   1.566
  838    HA   GLU 118           HA       GLU 118 -33.163  40.996   3.211
  839   1HB   GLU 118          HB2       GLU 118 -34.277  40.641   0.485
  840   2HB   GLU 118          HB1       GLU 118 -34.414  42.268   1.152
  841   1HG   GLU 118          HG2       GLU 118 -31.822  40.709   1.185
  842   2HG   GLU 118          HG1       GLU 118 -32.268  41.784  -0.140
  843    H    GLN 119           HN       GLN 119 -36.428  40.638   1.762
  844    HA   GLN 119           HA       GLN 119 -37.515  42.227   4.057
  845   1HB   GLN 119          HB2       GLN 119 -38.747  41.636   1.351
  846   2HB   GLN 119          HB1       GLN 119 -39.240  42.882   2.499
  847   1HG   GLN 119          HG2       GLN 119 -36.492  42.791   1.231
  848   2HG   GLN 119          HG1       GLN 119 -37.834  43.722   0.564
  849   1HE2  GLN 119          HE21      GLN 119 -38.900  45.287   2.237
  850   2HE2  GLN 119          HE22      GLN 119 -37.851  46.074   3.316
  Start of MODEL   15
    1   1H    ALA   1          HT1       ALA   1  20.057  -7.148  -6.771
    2   2H    ALA   1          HT2       ALA   1  21.741  -6.923  -6.727
    3   3H    ALA   1          HT3       ALA   1  20.761  -5.858  -7.617
    4    HA   ALA   1           HA       ALA   1  20.475  -6.169  -4.680
    5   1HB   ALA   1          HB1       ALA   1  21.856  -3.813  -5.224
    6   2HB   ALA   1          HB2       ALA   1  22.588  -4.982  -6.323
    7   3HB   ALA   1          HB3       ALA   1  22.567  -5.296  -4.588
    8    H    ARG   2           HN       ARG   2  18.193  -5.757  -4.965
    9    HA   ARG   2           HA       ARG   2  16.296  -4.367  -5.203
   10   1HB   ARG   2          HB2       ARG   2  18.529  -2.314  -5.048
   11   2HB   ARG   2          HB1       ARG   2  16.817  -1.957  -4.820
   12   1HG   ARG   2          HG2       ARG   2  17.104  -2.444  -2.638
   13   2HG   ARG   2          HG1       ARG   2  17.316  -4.127  -3.121
   14   1HD   ARG   2          HD2       ARG   2  19.615  -4.040  -2.912
   15   2HD   ARG   2          HD1       ARG   2  19.693  -2.327  -3.372
   16    HE   ARG   2           HE       ARG   2  18.247  -2.580  -0.909
   17   1HH1  ARG   2          HH21      ARG   2  20.755  -0.891  -1.850
   18   2HH1  ARG   2          HH22      ARG   2  21.852  -1.298  -0.573
   19   1HH2  ARG   2          HH11      ARG   2  19.942  -3.951   0.582
   20   2HH2  ARG   2          HH12      ARG   2  21.392  -3.029   0.804
   21    H    ILE   3           HN       ILE   3  15.278  -2.764  -6.756
   22    HA   ILE   3           HA       ILE   3  16.377  -3.188  -9.485
   23    HB   ILE   3           HB       ILE   3  13.730  -2.270  -8.332
   24   1HG1  ILE   3          HG12      ILE   3  14.089  -4.657  -8.162
   25   2HG1  ILE   3          HG11      ILE   3  12.971  -4.382  -9.498
   26   1HG2  ILE   3          HG21      ILE   3  14.154  -1.052 -10.428
   27   2HG2  ILE   3          HG22      ILE   3  12.899  -2.268 -10.665
   28   3HG2  ILE   3          HG23      ILE   3  14.538  -2.569 -11.242
   29   1HD1  ILE   3          HD11      ILE   3  15.813  -5.287  -9.560
   30   2HD1  ILE   3          HD12      ILE   3  15.261  -4.253 -10.878
   31   3HD1  ILE   3          HD13      ILE   3  14.452  -5.788 -10.564
   32    H    HIS   4           HN       HIS   4  16.501  -1.360 -10.982
   33    HA   HIS   4           HA       HIS   4  17.082   0.853 -11.573
   34   1HB   HIS   4          HB2       HIS   4  15.074   0.946  -9.430
   35   2HB   HIS   4          HB1       HIS   4  16.059   2.406  -9.523
   36    HD1  HIS   4           HD1      HIS   4  16.513   2.631 -12.530
   37    HD2  HIS   4           HD2      HIS   4  12.813   1.670 -10.867
   38    HE1  HIS   4           HE1      HIS   4  14.770   3.235 -14.265
   39    H    HIS   5           HN       HIS   5  18.162   2.924 -10.449
   40    HA   HIS   5           HA       HIS   5  20.351   1.865  -8.703
   41   1HB   HIS   5          HB2       HIS   5  20.328   3.234 -11.118
   42   2HB   HIS   5          HB1       HIS   5  20.663   4.507  -9.944
   43    HD1  HIS   5           HD1      HIS   5  21.793   0.882  -9.767
   44    HD2  HIS   5           HD2      HIS   5  23.433   4.694 -10.161
   45    HE1  HIS   5           HE1      HIS   5  24.305   0.598  -9.623
   46    H    HIS   6           HN       HIS   6  17.519   3.630  -8.478
   47    HA   HIS   6           HA       HIS   6  18.531   5.061  -6.049
   48   1HB   HIS   6          HB2       HIS   6  17.744   6.183  -8.505
   49   2HB   HIS   6          HB1       HIS   6  16.380   6.451  -7.419
   50    HD1  HIS   6           HD1      HIS   6  16.738   8.013  -5.402
   51    HD2  HIS   6           HD2      HIS   6  20.179   7.472  -7.694
   52    HE1  HIS   6           HE1      HIS   6  18.414   9.732  -4.596
   53    H    HIS   7           HN       HIS   7  17.553   3.245  -4.856
   54    HA   HIS   7           HA       HIS   7  14.644   2.826  -5.091
   55   1HB   HIS   7          HB2       HIS   7  16.917   1.390  -4.251
   56   2HB   HIS   7          HB1       HIS   7  15.961   1.640  -2.790
   57    HD1  HIS   7           HD1      HIS   7  14.927   0.908  -6.397
   58    HD2  HIS   7           HD2      HIS   7  14.351  -0.586  -2.548
   59    HE1  HIS   7           HE1      HIS   7  13.302  -1.023  -6.614
   60    H    HIS   8           HN       HIS   8  13.673   2.622  -2.608
   61    HA   HIS   8           HA       HIS   8  13.444   5.351  -1.683
   62   1HB   HIS   8          HB2       HIS   8  11.995   4.321   0.007
   63   2HB   HIS   8          HB1       HIS   8  11.688   3.581  -1.564
   64    HD1  HIS   8           HD1      HIS   8  12.482   1.136  -1.917
   65    HD2  HIS   8           HD2      HIS   8  13.265   2.611   1.902
   66    HE1  HIS   8           HE1      HIS   8  13.126  -0.860  -0.497
   67    H    HIS   9           HN       HIS   9  13.449   4.635   1.203
   68    HA   HIS   9           HA       HIS   9  14.957   4.637   3.029
   69   1HB   HIS   9          HB2       HIS   9  15.685   2.623   1.337
   70   2HB   HIS   9          HB1       HIS   9  17.165   3.580   1.358
   71    HD1  HIS   9           HD1      HIS   9  18.711   2.900   3.179
   72    HD2  HIS   9           HD2      HIS   9  14.730   2.304   4.263
   73    HE1  HIS   9           HE1      HIS   9  18.744   1.923   5.515
   74    H    ILE  10           HN       ILE  10  14.746   6.990   1.387
   75    HA   ILE  10           HA       ILE  10  17.473   7.983   0.890
   76    HB   ILE  10           HB       ILE  10  14.675   9.132   0.708
   77   1HG1  ILE  10          HG12      ILE  10  16.731   8.311  -1.371
   78   2HG1  ILE  10          HG11      ILE  10  15.260   7.425  -0.967
   79   1HG2  ILE  10          HG21      ILE  10  15.784  11.025  -0.512
   80   2HG2  ILE  10          HG22      ILE  10  17.344  10.389   0.008
   81   3HG2  ILE  10          HG23      ILE  10  16.186  10.970   1.204
   82   1HD1  ILE  10          HD11      ILE  10  14.994  10.302  -1.731
   83   2HD1  ILE  10          HD12      ILE  10  13.881   8.961  -2.005
   84   3HD1  ILE  10          HD13      ILE  10  15.320   9.132  -3.010
   85    H    GLU  11           HN       GLU  11  17.992  10.229   1.864
   86    HA   GLU  11           HA       GLU  11  17.718  10.046   4.794
   87   1HB   GLU  11          HB2       GLU  11  19.880  10.559   3.935
   88   2HB   GLU  11          HB1       GLU  11  19.235  11.768   2.825
   89   1HG   GLU  11          HG2       GLU  11  18.887  13.337   4.526
   90   2HG   GLU  11          HG1       GLU  11  18.853  12.105   5.788
   91    H    GLY  12           HN       GLY  12  17.476  12.896   2.646
   92   1HA   GLY  12          HA2       GLY  12  16.061  14.765   2.790
   93   2HA   GLY  12          HA1       GLY  12  14.792  13.578   3.096
   94    H    ARG  13           HN       ARG  13  17.252  15.580   4.678
   95    HA   ARG  13           HA       ARG  13  15.616  15.410   7.187
   96   1HB   ARG  13          HB2       ARG  13  18.227  14.478   6.682
   97   2HB   ARG  13          HB1       ARG  13  18.432  15.959   7.619
   98   1HG   ARG  13          HG2       ARG  13  16.293  14.630   8.849
   99   2HG   ARG  13          HG1       ARG  13  17.465  13.361   8.489
  100   1HD   ARG  13          HD2       ARG  13  18.939  15.600   9.460
  101   2HD   ARG  13          HD1       ARG  13  17.588  15.322  10.578
  102    HE   ARG  13           HE       ARG  13  19.547  13.209   9.762
  103   1HH1  ARG  13          HH21      ARG  13  16.773  12.432  10.821
  104   2HH1  ARG  13          HH22      ARG  13  17.133  12.147  12.491
  105   1HH2  ARG  13          HH11      ARG  13  20.202  13.757  12.378
  106   2HH2  ARG  13          HH12      ARG  13  19.074  12.896  13.373
  107    H    ALA  14           HN       ALA  14  14.696  17.445   6.063
  108    HA   ALA  14           HA       ALA  14  16.498  19.812   6.354
  109   1HB   ALA  14          HB1       ALA  14  15.542  20.198   4.334
  110   2HB   ALA  14          HB2       ALA  14  14.069  20.591   5.223
  111   3HB   ALA  14          HB3       ALA  14  14.317  18.958   4.604
  112    HA   PRO  15           HA       PRO  15  14.295  21.132   9.916
  113   1HB   PRO  15          HB2       PRO  15  14.579  23.842   9.699
  114   2HB   PRO  15          HB1       PRO  15  15.916  22.764  10.148
  115   1HG   PRO  15          HG2       PRO  15  15.318  24.055   7.542
  116   2HG   PRO  15          HG1       PRO  15  16.878  23.721   8.306
  117   1HD   PRO  15          HD2       PRO  15  15.789  22.222   6.273
  118   2HD   PRO  15          HD1       PRO  15  16.994  21.620   7.432
  119    H    THR  16           HN       THR  16  13.520  22.956   6.935
  120    HA   THR  16           HA       THR  16  10.822  23.600   7.950
  121    HB   THR  16           HB       THR  16  10.717  24.782   5.726
  122    HG1  THR  16           HG1      THR  16  12.032  23.951   4.324
  123   1HG2  THR  16          HG21      THR  16  11.729  26.526   6.731
  124   2HG2  THR  16          HG22      THR  16  13.301  25.727   6.679
  125   3HG2  THR  16          HG23      THR  16  12.191  25.403   8.010
  126    H    GLU  17           HN       GLU  17  11.942  20.777   6.976
  127    HA   GLU  17           HA       GLU  17  10.468  19.987   4.693
  128   1HB   GLU  17          HB2       GLU  17  12.208  18.885   6.573
  129   2HB   GLU  17          HB1       GLU  17  10.724  17.953   6.775
  130   1HG   GLU  17          HG2       GLU  17  10.768  17.890   4.135
  131   2HG   GLU  17          HG1       GLU  17  12.489  18.207   4.363
  132    H    GLN  18           HN       GLN  18   8.259  19.911   4.462
  133    HA   GLN  18           HA       GLN  18   6.583  18.951   6.654
  134   1HB   GLN  18          HB2       GLN  18   7.045  21.482   6.855
  135   2HB   GLN  18          HB1       GLN  18   6.029  21.648   5.422
  136   1HG   GLN  18          HG2       GLN  18   4.137  21.316   6.608
  137   2HG   GLN  18          HG1       GLN  18   4.820  19.920   7.442
  138   1HE2  GLN  18          HE21      GLN  18   4.051  20.622   9.556
  139   2HE2  GLN  18          HE22      GLN  18   4.725  21.965  10.346
  140    H    SER  19           HN       SER  19   6.586  20.480   3.426
  141    HA   SER  19           HA       SER  19   4.058  19.331   2.613
  142   1HB   SER  19          HB2       SER  19   6.242  20.967   1.540
  143   2HB   SER  19          HB1       SER  19   5.529  19.906   0.327
  144    HG   SER  19           HG       SER  19   3.456  20.750   1.364
  145    HA   PRO  20           HA       PRO  20   6.757  16.149   0.283
  146   1HB   PRO  20          HB2       PRO  20   9.463  16.204   0.685
  147   2HB   PRO  20          HB1       PRO  20   8.656  17.162  -0.573
  148   1HG   PRO  20          HG2       PRO  20   9.664  18.006   2.093
  149   2HG   PRO  20          HG1       PRO  20   9.677  18.876   0.552
  150   1HD   PRO  20          HD2       PRO  20   7.881  19.353   2.567
  151   2HD   PRO  20          HD1       PRO  20   7.567  19.693   0.851
  152    H    GLY  21           HN       GLY  21   6.622  14.139   1.243
  153   1HA   GLY  21          HA2       GLY  21   8.239  13.329   3.475
  154   2HA   GLY  21          HA1       GLY  21   6.612  13.726   4.030
  155    H    VAL  22           HN       VAL  22   8.316  11.123   3.413
  156    HA   VAL  22           HA       VAL  22   6.680   9.672   1.494
  157    HB   VAL  22           HB       VAL  22   8.677   8.827   3.619
  158   1HG1  VAL  22          HG11      VAL  22   7.318   7.317   1.380
  159   2HG1  VAL  22          HG12      VAL  22   7.414   6.881   3.087
  160   3HG1  VAL  22          HG13      VAL  22   8.852   6.784   2.069
  161   1HG2  VAL  22          HG21      VAL  22   9.981  10.017   2.137
  162   2HG2  VAL  22          HG22      VAL  22   8.850   9.793   0.802
  163   3HG2  VAL  22          HG23      VAL  22   9.936   8.484   1.267
  164    H    GLN  23           HN       GLN  23   4.692   8.800   1.931
  165    HA   GLN  23           HA       GLN  23   3.980   7.250   4.150
  166   1HB   GLN  23          HB2       GLN  23   4.101  10.123   4.636
  167   2HB   GLN  23          HB1       GLN  23   2.503   9.469   4.998
  168   1HG   GLN  23          HG2       GLN  23   3.275   8.161   6.722
  169   2HG   GLN  23          HG1       GLN  23   4.845   7.901   5.960
  170   1HE2  GLN  23          HE21      GLN  23   6.239   8.654   7.622
  171   2HE2  GLN  23          HE22      GLN  23   6.193  10.235   8.238
  172    H    ASP  24           HN       ASP  24   2.794   6.222   2.428
  173    HA   ASP  24           HA       ASP  24   0.881   7.543   0.752
  174   1HB   ASP  24          HB2       ASP  24   1.950   4.954   1.221
  175   2HB   ASP  24          HB1       ASP  24   0.196   4.800   1.319
  176    H    CYS  25           HN       CYS  25  -1.546   6.511   0.953
  177    HA   CYS  25           HA       CYS  25  -2.536   6.395   3.701
  178   1HB   CYS  25          HB2       CYS  25  -3.682   8.488   3.703
  179   2HB   CYS  25          HB1       CYS  25  -2.059   8.842   3.117
  180    H    TYR  26           HN       TYR  26  -5.199   6.841   3.351
  181    HA   TYR  26           HA       TYR  26  -6.101   5.578   0.833
  182   1HB   TYR  26          HB2       TYR  26  -7.006   3.628   1.878
  183   2HB   TYR  26          HB1       TYR  26  -5.363   3.781   2.490
  184    HD1  TYR  26           HD1      TYR  26  -5.015   3.691   4.786
  185    HD2  TYR  26           HD2      TYR  26  -8.874   4.847   3.336
  186    HE1  TYR  26           HE1      TYR  26  -5.863   3.702   7.104
  187    HE2  TYR  26           HE2      TYR  26  -9.728   4.880   5.662
  188    HH   TYR  26           HH       TYR  26  -8.951   3.584   7.925
  189    H    HIS  27           HN       HIS  27  -8.595   5.344   0.916
  190    HA   HIS  27           HA       HIS  27  -9.764   7.575   2.550
  191   1HB   HIS  27          HB2       HIS  27  -9.334   8.008   0.085
  192   2HB   HIS  27          HB1       HIS  27 -10.511   6.742  -0.268
  193    HD1  HIS  27           HD1      HIS  27 -10.896   9.837  -0.938
  194    HD2  HIS  27           HD2      HIS  27 -12.546   7.825   2.318
  195    HE1  HIS  27           HE1      HIS  27 -12.926  11.173  -0.225
  196    H    GLY  28           HN       GLY  28 -10.722   6.167   4.114
  197   1HA   GLY  28          HA2       GLY  28 -13.030   5.274   4.510
  198   2HA   GLY  28          HA1       GLY  28 -12.837   4.355   3.017
  199    H    ASP  29           HN       ASP  29 -11.703   2.407   3.074
  200    HA   ASP  29           HA       ASP  29 -10.484   1.622   5.676
  201   1HB   ASP  29          HB2       ASP  29 -12.461   0.082   3.983
  202   2HB   ASP  29          HB1       ASP  29 -11.638  -0.578   5.396
  203    H    GLY  30           HN       GLY  30  -9.139   2.494   3.312
  204   1HA   GLY  30          HA2       GLY  30  -7.273   1.793   2.062
  205   2HA   GLY  30          HA1       GLY  30  -7.359   0.247   2.911
  206    H    GLN  31           HN       GLN  31 -10.413   0.759   1.811
  207    HA   GLN  31           HA       GLN  31 -10.175  -1.243  -0.286
  208   1HB   GLN  31          HB2       GLN  31 -12.100  -0.762   1.346
  209   2HB   GLN  31          HB1       GLN  31 -12.508   0.593   0.293
  210   1HG   GLN  31          HG2       GLN  31 -13.629  -0.831  -1.039
  211   2HG   GLN  31          HG1       GLN  31 -12.103  -1.637  -1.403
  212   1HE2  GLN  31          HE21      GLN  31 -11.596  -3.612  -0.238
  213   2HE2  GLN  31          HE22      GLN  31 -12.752  -4.413   0.711
  214    H    SER  32           HN       SER  32 -10.780  -0.880  -2.548
  215    HA   SER  32           HA       SER  32 -10.848   0.347  -4.577
  216   1HB   SER  32          HB2       SER  32 -12.040   1.941  -2.722
  217   2HB   SER  32          HB1       SER  32 -10.673   2.956  -3.173
  218    HG   SER  32           HG       SER  32 -12.673   3.124  -4.474
  219    H    TYR  33           HN       TYR  33  -8.397   0.340  -2.328
  220    HA   TYR  33           HA       TYR  33  -6.559   2.270  -3.431
  221   1HB   TYR  33          HB2       TYR  33  -6.640   1.132  -1.135
  222   2HB   TYR  33          HB1       TYR  33  -5.953  -0.285  -1.923
  223    HD1  TYR  33           HD1      TYR  33  -3.850  -0.308  -0.779
  224    HD2  TYR  33           HD2      TYR  33  -5.143   3.227  -2.849
  225    HE1  TYR  33           HE1      TYR  33  -1.583   0.660  -0.544
  226    HE2  TYR  33           HE2      TYR  33  -2.873   4.190  -2.620
  227    HH   TYR  33           HH       TYR  33  -0.681   3.638  -2.166
  228    H    ARG  34           HN       ARG  34  -7.202   1.419  -5.762
  229    HA   ARG  34           HA       ARG  34  -6.249  -1.058  -6.781
  230   1HB   ARG  34          HB2       ARG  34  -7.787   0.565  -7.885
  231   2HB   ARG  34          HB1       ARG  34  -6.423   1.659  -8.122
  232   1HG   ARG  34          HG2       ARG  34  -5.370   0.218  -9.653
  233   2HG   ARG  34          HG1       ARG  34  -6.298  -1.182  -9.113
  234   1HD   ARG  34          HD2       ARG  34  -8.245   0.648  -9.967
  235   2HD   ARG  34          HD1       ARG  34  -6.960   0.748 -11.187
  236    HE   ARG  34           HE       ARG  34  -7.190  -1.641 -11.572
  237   1HH1  ARG  34          HH21      ARG  34  -8.022  -2.444  -8.797
  238   2HH1  ARG  34          HH22      ARG  34  -9.691  -2.848  -9.026
  239   1HH2  ARG  34          HH11      ARG  34  -9.934  -1.235 -12.086
  240   2HH2  ARG  34          HH12      ARG  34 -10.773  -2.164 -10.890
  241    H    GLY  35           HN       GLY  35  -4.581   2.018  -6.225
  242   1HA   GLY  35          HA2       GLY  35  -2.260   1.771  -7.701
  243   2HA   GLY  35          HA1       GLY  35  -2.258   2.408  -6.056
  244    H    SER  36           HN       SER  36  -0.670   0.256  -7.841
  245    HA   SER  36           HA       SER  36  -0.736  -2.178  -6.289
  246   1HB   SER  36          HB2       SER  36   1.762  -1.981  -7.496
  247   2HB   SER  36          HB1       SER  36   0.313  -2.636  -8.252
  248    HG   SER  36           HG       SER  36   1.649  -0.590  -9.061
  249    H    PHE  37           HN       PHE  37  -0.689  -0.452  -4.276
  250    HA   PHE  37           HA       PHE  37   1.821   0.566  -3.374
  251   1HB   PHE  37          HB2       PHE  37  -0.614   0.930  -2.578
  252   2HB   PHE  37          HB1       PHE  37  -0.376  -0.533  -1.622
  253    HD1  PHE  37           HD1      PHE  37  -0.054   0.064   0.609
  254    HD2  PHE  37           HD2      PHE  37   1.907   2.321  -2.475
  255    HE1  PHE  37           HE1      PHE  37   1.137   1.385   2.334
  256    HE2  PHE  37           HE2      PHE  37   3.101   3.643  -0.748
  257    HZ   PHE  37           HZ       PHE  37   2.716   3.174   1.657
  258    H    SER  38           HN       SER  38   3.131  -1.391  -4.114
  259    HA   SER  38           HA       SER  38   2.979  -3.900  -2.705
  260   1HB   SER  38          HB2       SER  38   5.407  -2.657  -3.999
  261   2HB   SER  38          HB1       SER  38   4.959  -4.356  -3.937
  262    HG   SER  38           HG       SER  38   4.383  -3.625  -5.938
  263    H    THR  39           HN       THR  39   2.946  -1.778  -0.721
  264    HA   THR  39           HA       THR  39   5.561  -2.312   0.642
  265    HB   THR  39           HB       THR  39   3.958   0.225   0.954
  266    HG1  THR  39           HG1      THR  39   5.990  -0.273  -0.959
  267   1HG2  THR  39          HG21      THR  39   5.813   1.012   2.028
  268   2HG2  THR  39          HG22      THR  39   6.921   0.143   0.966
  269   3HG2  THR  39          HG23      THR  39   6.121  -0.705   2.290
  270    H    THR  40           HN       THR  40   5.390  -2.659   2.913
  271    HA   THR  40           HA       THR  40   2.632  -3.263   3.873
  272    HB   THR  40           HB       THR  40   3.957  -4.512   5.633
  273    HG1  THR  40           HG1      THR  40   5.949  -3.898   5.758
  274   1HG2  THR  40          HG21      THR  40   4.371  -5.071   2.694
  275   2HG2  THR  40          HG22      THR  40   3.183  -5.792   3.780
  276   3HG2  THR  40          HG23      THR  40   4.893  -6.195   3.948
  277    H    VAL  41           HN       VAL  41   2.367  -2.819   6.336
  278    HA   VAL  41           HA       VAL  41   2.495  -0.036   6.870
  279    HB   VAL  41           HB       VAL  41   2.164  -2.550   8.502
  280   1HG1  VAL  41          HG11      VAL  41   2.780  -1.427  10.365
  281   2HG1  VAL  41          HG12      VAL  41   1.328  -0.454  10.134
  282   3HG1  VAL  41          HG13      VAL  41   2.874   0.105   9.497
  283   1HG2  VAL  41          HG21      VAL  41   0.373  -1.607   6.957
  284   2HG2  VAL  41          HG22      VAL  41   0.289  -0.217   8.039
  285   3HG2  VAL  41          HG23      VAL  41  -0.121  -1.825   8.636
  286    H    THR  42           HN       THR  42   4.585  -2.657   8.150
  287    HA   THR  42           HA       THR  42   6.367  -1.022   9.639
  288    HB   THR  42           HB       THR  42   6.959  -3.575   8.108
  289    HG1  THR  42           HG1      THR  42   5.610  -3.060  10.532
  290   1HG2  THR  42          HG21      THR  42   8.320  -3.867  10.353
  291   2HG2  THR  42          HG22      THR  42   8.234  -2.105  10.387
  292   3HG2  THR  42          HG23      THR  42   8.992  -2.925   9.022
  293    H    GLY  43           HN       GLY  43   5.950  -1.291   6.237
  294   1HA   GLY  43          HA2       GLY  43   7.022   0.302   4.736
  295   2HA   GLY  43          HA1       GLY  43   8.405   0.346   5.830
  296    H    ARG  44           HN       ARG  44   7.577  -2.822   5.698
  297    HA   ARG  44           HA       ARG  44   9.830  -3.512   3.986
  298   1HB   ARG  44          HB2       ARG  44   8.068  -4.701   5.940
  299   2HB   ARG  44          HB1       ARG  44   8.180  -5.756   4.531
  300   1HG   ARG  44          HG2       ARG  44  10.343  -6.286   4.956
  301   2HG   ARG  44          HG1       ARG  44  10.764  -4.619   5.352
  302   1HD   ARG  44          HD2       ARG  44  10.938  -6.248   7.303
  303   2HD   ARG  44          HD1       ARG  44   9.865  -4.866   7.601
  304    HE   ARG  44           HE       ARG  44   8.716  -7.399   6.521
  305   1HH1  ARG  44          HH21      ARG  44   9.473  -6.623   9.564
  306   2HH1  ARG  44          HH22      ARG  44   7.862  -6.402  10.163
  307   1HH2  ARG  44          HH11      ARG  44   6.409  -6.400   7.013
  308   2HH2  ARG  44          HH12      ARG  44   6.127  -6.275   8.717
  309    H    THR  45           HN       THR  45   9.110  -5.591   2.453
  310    HA   THR  45           HA       THR  45   7.124  -4.435   0.530
  311    HB   THR  45           HB       THR  45   9.430  -6.382   0.173
  312    HG1  THR  45           HG1      THR  45  10.194  -4.452  -1.037
  313   1HG2  THR  45          HG21      THR  45   8.221  -6.910  -1.685
  314   2HG2  THR  45          HG22      THR  45   8.872  -5.390  -2.297
  315   3HG2  THR  45          HG23      THR  45   7.255  -5.438  -1.596
  316    H    CYS  46           HN       CYS  46   5.258  -5.632   0.180
  317    HA   CYS  46           HA       CYS  46   4.876  -8.088   1.659
  318   1HB   CYS  46          HB2       CYS  46   2.724  -7.402   1.516
  319   2HB   CYS  46          HB1       CYS  46   3.329  -5.974   0.691
  320    H    GLN  47           HN       GLN  47   5.169 -10.140   0.863
  321    HA   GLN  47           HA       GLN  47   6.401 -10.613  -1.669
  322   1HB   GLN  47          HB2       GLN  47   6.579 -12.050   0.333
  323   2HB   GLN  47          HB1       GLN  47   4.873 -12.466   0.188
  324   1HG   GLN  47          HG2       GLN  47   6.012 -14.266  -0.855
  325   2HG   GLN  47          HG1       GLN  47   5.457 -13.261  -2.194
  326   1HE2  GLN  47          HE21      GLN  47   7.079 -11.916  -3.305
  327   2HE2  GLN  47          HE22      GLN  47   8.736 -12.250  -3.150
  328    H    SER  48           HN       SER  48   5.475 -10.858  -3.681
  329    HA   SER  48           HA       SER  48   2.860 -10.286  -4.393
  330   1HB   SER  48          HB2       SER  48   4.918 -12.196  -5.514
  331   2HB   SER  48          HB1       SER  48   3.401 -11.879  -6.352
  332    HG   SER  48           HG       SER  48   5.548 -10.151  -5.781
  333    H    TRP  49           HN       TRP  49   0.969 -11.603  -4.748
  334    HA   TRP  49           HA       TRP  49   0.521 -13.663  -2.765
  335   1HB   TRP  49          HB2       TRP  49  -1.101 -13.152  -5.268
  336   2HB   TRP  49          HB1       TRP  49  -1.673 -13.754  -3.716
  337    HD1  TRP  49           HD1      TRP  49  -0.643 -10.553  -5.494
  338    HE1  TRP  49           HE1      TRP  49  -1.392  -8.552  -4.078
  339    HE3  TRP  49           HE3      TRP  49  -2.192 -12.944  -1.314
  340    HZ2  TRP  49           HZ2      TRP  49  -2.507  -8.015  -1.522
  341    HZ3  TRP  49           HZ3      TRP  49  -3.106 -11.689   0.618
  342    HH2  TRP  49           HH2      TRP  49  -3.269  -9.217   0.517
  343    H    SER  50           HN       SER  50   1.475 -13.658  -6.146
  344    HA   SER  50           HA       SER  50   1.040 -16.509  -6.580
  345   1HB   SER  50          HB2       SER  50   0.966 -14.742  -8.325
  346   2HB   SER  50          HB1       SER  50   2.682 -14.437  -8.069
  347    HG   SER  50           HG       SER  50   2.896 -16.790  -8.519
  348    H    SER  51           HN       SER  51   3.101 -15.244  -4.452
  349    HA   SER  51           HA       SER  51   5.605 -16.527  -5.323
  350   1HB   SER  51          HB2       SER  51   5.704 -14.432  -4.122
  351   2HB   SER  51          HB1       SER  51   4.668 -15.059  -2.842
  352    HG   SER  51           HG       SER  51   7.367 -15.446  -3.324
  353    H    MET  52           HN       MET  52   5.604 -18.762  -5.181
  354    HA   MET  52           HA       MET  52   4.215 -20.027  -2.860
  355   1HB   MET  52          HB2       MET  52   5.360 -21.312  -5.356
  356   2HB   MET  52          HB1       MET  52   4.169 -21.992  -4.251
  357   1HG   MET  52          HG2       MET  52   3.408 -19.396  -5.437
  358   2HG   MET  52          HG1       MET  52   3.518 -20.736  -6.576
  359   1HE   MET  52          HE1       MET  52   2.736 -20.974  -2.765
  360   2HE   MET  52          HE2       MET  52   1.039 -20.530  -2.768
  361   3HE   MET  52          HE3       MET  52   2.244 -19.385  -3.343
  362    H    THR  53           HN       THR  53   6.960 -18.715  -2.829
  363    HA   THR  53           HA       THR  53   8.685 -21.081  -2.287
  364    HB   THR  53           HB       THR  53  10.136 -18.733  -1.881
  365    HG1  THR  53           HG1      THR  53   9.291 -17.919  -4.175
  366   1HG2  THR  53          HG21      THR  53  10.797 -19.237  -4.370
  367   2HG2  THR  53          HG22      THR  53   9.741 -20.635  -4.171
  368   3HG2  THR  53          HG23      THR  53  11.144 -20.434  -3.122
  369    HA   PRO  54           HA       PRO  54   8.944 -18.902   1.908
  370   1HB   PRO  54          HB2       PRO  54   7.778 -16.456   2.268
  371   2HB   PRO  54          HB1       PRO  54   9.428 -16.655   1.648
  372   1HG   PRO  54          HG2       PRO  54   6.919 -16.049   0.181
  373   2HG   PRO  54          HG1       PRO  54   8.566 -15.467  -0.105
  374   1HD   PRO  54          HD2       PRO  54   7.346 -17.449  -1.562
  375   2HD   PRO  54          HD1       PRO  54   9.103 -17.252  -1.402
  376    H    HIS  55           HN       HIS  55   6.071 -16.925   1.682
  377    HA   HIS  55           HA       HIS  55   4.561 -18.899   3.280
  378   1HB   HIS  55          HB2       HIS  55   3.441 -16.312   2.236
  379   2HB   HIS  55          HB1       HIS  55   3.195 -17.074   3.806
  380    HD1  HIS  55           HD1      HIS  55   5.642 -14.971   1.883
  381    HD2  HIS  55           HD2      HIS  55   5.190 -16.472   5.744
  382    HE1  HIS  55           HE1      HIS  55   7.407 -13.852   3.293
  383    H    TRP  56           HN       TRP  56   3.557 -20.519   2.134
  384    HA   TRP  56           HA       TRP  56   2.576 -20.014  -0.612
  385   1HB   TRP  56          HB2       TRP  56   3.903 -22.049   0.286
  386   2HB   TRP  56          HB1       TRP  56   2.370 -22.558   0.997
  387    HD1  TRP  56           HD1      TRP  56   0.275 -22.140  -1.061
  388    HE1  TRP  56           HE1      TRP  56   0.302 -23.205  -3.382
  389    HE3  TRP  56           HE3      TRP  56   5.231 -23.097  -1.475
  390    HZ2  TRP  56           HZ2      TRP  56   2.192 -24.325  -5.200
  391    HZ3  TRP  56           HZ3      TRP  56   6.124 -24.129  -3.520
  392    HH2  TRP  56           HH2      TRP  56   4.630 -24.765  -5.388
  393    H    HIS  57           HN       HIS  57   0.410 -19.955  -1.154
  394    HA   HIS  57           HA       HIS  57  -1.703 -20.871   0.632
  395   1HB   HIS  57          HB2       HIS  57  -2.604 -18.491   0.879
  396   2HB   HIS  57          HB1       HIS  57  -1.130 -18.832   1.788
  397    HD1  HIS  57           HD1      HIS  57  -2.093 -17.446  -1.635
  398    HD2  HIS  57           HD2      HIS  57   0.909 -17.052   1.230
  399    HE1  HIS  57           HE1      HIS  57  -0.539 -15.631  -2.471
  400    H    GLN  58           HN       GLN  58  -3.890 -19.697  -0.364
  401    HA   GLN  58           HA       GLN  58  -3.605 -19.533  -3.330
  402   1HB   GLN  58          HB2       GLN  58  -4.386 -21.820  -1.914
  403   2HB   GLN  58          HB1       GLN  58  -5.900 -21.124  -2.495
  404   1HG   GLN  58          HG2       GLN  58  -5.078 -21.096  -4.778
  405   2HG   GLN  58          HG1       GLN  58  -3.475 -21.608  -4.249
  406   1HE2  GLN  58          HE21      GLN  58  -3.424 -23.667  -5.300
  407   2HE2  GLN  58          HE22      GLN  58  -4.505 -24.921  -4.929
  408    H    ARG  59           HN       ARG  59  -4.341 -17.666  -1.030
  409    HA   ARG  59           HA       ARG  59  -7.193 -17.078  -1.613
  410   1HB   ARG  59          HB2       ARG  59  -5.990 -17.113   0.691
  411   2HB   ARG  59          HB1       ARG  59  -5.317 -15.558   0.202
  412   1HG   ARG  59          HG2       ARG  59  -7.259 -14.497   0.630
  413   2HG   ARG  59          HG1       ARG  59  -8.173 -15.669  -0.320
  414   1HD   ARG  59          HD2       ARG  59  -8.556 -17.066   1.530
  415   2HD   ARG  59          HD1       ARG  59  -7.178 -16.405   2.432
  416    HE   ARG  59           HE       ARG  59  -8.490 -14.269   2.626
  417   1HH1  ARG  59          HH11      ARG  59  -9.869 -16.780   3.900
  418   2HH1  ARG  59          HH12      ARG  59 -11.517 -16.444   3.488
  419   1HH2  ARG  59          HH21      ARG  59 -10.717 -14.001   1.163
  420   2HH2  ARG  59          HH22      ARG  59 -11.997 -14.873   1.938
  421    H    THR  60           HN       THR  60  -4.380 -16.448  -3.152
  422    HA   THR  60           HA       THR  60  -4.086 -13.694  -3.556
  423    HB   THR  60           HB       THR  60  -2.710 -15.500  -4.551
  424    HG1  THR  60           HG1      THR  60  -2.779 -14.581  -6.770
  425   1HG2  THR  60          HG21      THR  60  -4.029 -17.205  -5.317
  426   2HG2  THR  60          HG22      THR  60  -3.864 -16.318  -6.832
  427   3HG2  THR  60          HG23      THR  60  -5.308 -16.110  -5.841
  428    H    THR  61           HN       THR  61  -4.677 -12.812  -5.950
  429    HA   THR  61           HA       THR  61  -7.569 -12.452  -5.973
  430    HB   THR  61           HB       THR  61  -5.988 -10.673  -6.620
  431    HG1  THR  61           HG1      THR  61  -6.896 -10.362  -8.813
  432   1HG2  THR  61          HG21      THR  61  -5.295 -11.890  -9.204
  433   2HG2  THR  61          HG22      THR  61  -4.578 -12.707  -7.815
  434   3HG2  THR  61          HG23      THR  61  -4.281 -10.988  -8.079
  435    H    GLU  62           HN       GLU  62  -5.408 -14.811  -7.187
  436    HA   GLU  62           HA       GLU  62  -6.590 -15.515  -9.659
  437   1HB   GLU  62          HB2       GLU  62  -4.446 -16.375  -8.632
  438   2HB   GLU  62          HB1       GLU  62  -5.429 -17.333  -7.525
  439   1HG   GLU  62          HG2       GLU  62  -4.728 -18.699  -9.445
  440   2HG   GLU  62          HG1       GLU  62  -6.478 -18.474  -9.453
  441    H    TYR  63           HN       TYR  63  -7.541 -15.933  -6.358
  442    HA   TYR  63           HA       TYR  63  -9.781 -17.704  -7.119
  443   1HB   TYR  63          HB2       TYR  63  -8.156 -17.124  -4.756
  444   2HB   TYR  63          HB1       TYR  63  -9.880 -17.180  -4.386
  445    HD1  TYR  63           HD1      TYR  63  -7.178 -19.081  -6.146
  446    HD2  TYR  63           HD2      TYR  63 -10.981 -19.241  -4.157
  447    HE1  TYR  63           HE1      TYR  63  -7.122 -21.558  -6.239
  448    HE2  TYR  63           HE2      TYR  63 -10.926 -21.719  -4.250
  449    HH   TYR  63           HH       TYR  63  -8.685 -23.500  -4.450
  450    H    TYR  64           HN       TYR  64  -9.202 -14.521  -7.254
  451    HA   TYR  64           HA       TYR  64 -12.017 -13.791  -6.539
  452   1HB   TYR  64          HB2       TYR  64  -9.502 -12.951  -5.368
  453   2HB   TYR  64          HB1       TYR  64 -10.366 -11.568  -6.040
  454    HD1  TYR  64           HD1      TYR  64 -10.277 -14.056  -3.398
  455    HD2  TYR  64           HD2      TYR  64 -12.752 -11.139  -5.352
  456    HE1  TYR  64           HE1      TYR  64 -11.829 -14.077  -1.464
  457    HE2  TYR  64           HE2      TYR  64 -14.304 -11.160  -3.418
  458    HH   TYR  64           HH       TYR  64 -13.635 -13.164  -0.546
  459    HA   PRO  65           HA       PRO  65 -11.633 -12.184 -10.681
  460   1HB   PRO  65          HB2       PRO  65 -14.202 -11.267 -10.877
  461   2HB   PRO  65          HB1       PRO  65 -13.776 -12.981 -11.046
  462   1HG   PRO  65          HG2       PRO  65 -14.943 -11.544  -8.723
  463   2HG   PRO  65          HG1       PRO  65 -15.261 -13.180  -9.316
  464   1HD   PRO  65          HD2       PRO  65 -13.667 -12.605  -7.158
  465   2HD   PRO  65          HD1       PRO  65 -13.525 -14.078  -8.142
  466    H    ASN  66           HN       ASN  66 -12.019 -10.551  -7.760
  467    HA   ASN  66           HA       ASN  66 -11.762  -7.889  -9.119
  468   1HB   ASN  66          HB2       ASN  66 -13.925  -8.549  -7.814
  469   2HB   ASN  66          HB1       ASN  66 -12.932  -8.321  -6.374
  470   1HD2  ASN  66          HD21      ASN  66 -13.222  -6.253  -5.546
  471   2HD2  ASN  66          HD22      ASN  66 -13.429  -4.847  -6.476
  472    H    GLY  67           HN       GLY  67  -9.590  -9.701  -8.303
  473   1HA   GLY  67          HA2       GLY  67  -8.441  -8.233  -5.985
  474   2HA   GLY  67          HA1       GLY  67  -7.916  -9.830  -6.524
  475    H    GLY  68           HN       GLY  68  -7.978  -6.426  -7.469
  476   1HA   GLY  68          HA2       GLY  68  -6.096  -6.835  -9.661
  477   2HA   GLY  68          HA1       GLY  68  -6.680  -5.275  -9.076
  478    H    LEU  69           HN       LEU  69  -5.087  -7.880  -7.259
  479    HA   LEU  69           HA       LEU  69  -2.950  -5.932  -6.550
  480   1HB   LEU  69          HB2       LEU  69  -2.840  -7.530  -4.493
  481   2HB   LEU  69          HB1       LEU  69  -4.180  -6.400  -4.604
  482    HG   LEU  69           HG       LEU  69  -5.631  -8.155  -5.525
  483   1HD1  LEU  69          HD11      LEU  69  -3.038  -9.679  -5.518
  484   2HD1  LEU  69          HD12      LEU  69  -4.261  -9.569  -6.784
  485   3HD1  LEU  69          HD13      LEU  69  -4.561 -10.552  -5.351
  486   1HD2  LEU  69          HD21      LEU  69  -4.230  -8.450  -2.928
  487   2HD2  LEU  69          HD22      LEU  69  -5.110  -9.875  -3.477
  488   3HD2  LEU  69          HD23      LEU  69  -5.956  -8.343  -3.271
  489    H    THR  70           HN       THR  70  -3.332  -8.079  -8.720
  490    HA   THR  70           HA       THR  70  -1.789 -10.371  -8.402
  491    HB   THR  70           HB       THR  70  -2.994  -9.709 -10.450
  492    HG1  THR  70           HG1      THR  70  -1.049 -10.047 -11.910
  493   1HG2  THR  70          HG21      THR  70  -2.517  -7.338 -10.480
  494   2HG2  THR  70          HG22      THR  70  -1.888  -8.039 -11.972
  495   3HG2  THR  70          HG23      THR  70  -0.788  -7.643 -10.651
  496    H    ARG  71           HN       ARG  71   0.522 -10.789  -8.938
  497    HA   ARG  71           HA       ARG  71   2.840 -10.292  -8.767
  498   1HB   ARG  71          HB2       ARG  71   1.732  -8.285 -10.222
  499   2HB   ARG  71          HB1       ARG  71   2.284  -7.364  -8.822
  500   1HG   ARG  71          HG2       ARG  71   4.462  -8.935  -9.285
  501   2HG   ARG  71          HG1       ARG  71   3.858  -8.714 -10.928
  502   1HD   ARG  71          HD2       ARG  71   3.932  -6.298 -10.700
  503   2HD   ARG  71          HD1       ARG  71   4.341  -6.434  -8.978
  504    HE   ARG  71           HE       ARG  71   6.352  -7.868  -9.998
  505   1HH1  ARG  71          HH21      ARG  71   5.681  -4.625  -9.994
  506   2HH1  ARG  71          HH22      ARG  71   6.770  -4.195 -11.270
  507   1HH2  ARG  71          HH11      ARG  71   7.436  -7.478 -12.165
  508   2HH2  ARG  71          HH12      ARG  71   7.763  -5.810 -12.500
  509    H    ASN  72           HN       ASN  72   3.558  -7.589  -7.427
  510    HA   ASN  72           HA       ASN  72   2.897  -8.467  -4.664
  511   1HB   ASN  72          HB2       ASN  72   5.242  -8.475  -5.004
  512   2HB   ASN  72          HB1       ASN  72   5.193  -7.012  -5.988
  513   1HD2  ASN  72          HD21      ASN  72   3.245  -7.021  -3.110
  514   2HD2  ASN  72          HD22      ASN  72   4.237  -5.996  -2.203
  515    H    TYR  73           HN       TYR  73   0.758  -7.284  -5.396
  516    HA   TYR  73           HA       TYR  73   1.025  -4.340  -4.847
  517   1HB   TYR  73          HB2       TYR  73  -1.068  -5.930  -6.380
  518   2HB   TYR  73          HB1       TYR  73  -1.089  -4.182  -6.155
  519    HD1  TYR  73           HD1      TYR  73   2.134  -4.175  -6.312
  520    HD2  TYR  73           HD2      TYR  73  -1.044  -5.555  -8.853
  521    HE1  TYR  73           HE1      TYR  73   3.598  -3.901  -8.293
  522    HE2  TYR  73           HE2      TYR  73   0.422  -5.280 -10.833
  523    HH   TYR  73           HH       TYR  73   3.265  -3.524 -10.784
  524    H    CYS  74           HN       CYS  74   0.030  -3.647  -3.016
  525    HA   CYS  74           HA       CYS  74  -1.174  -5.458  -1.126
  526   1HB   CYS  74          HB2       CYS  74  -0.510  -2.593  -1.409
  527   2HB   CYS  74          HB1       CYS  74  -1.849  -2.929  -0.313
  528    H    ARG  75           HN       ARG  75  -3.380  -5.625  -0.494
  529    HA   ARG  75           HA       ARG  75  -5.434  -4.108  -1.992
  530   1HB   ARG  75          HB2       ARG  75  -4.478  -6.611  -2.826
  531   2HB   ARG  75          HB1       ARG  75  -6.007  -6.959  -2.031
  532   1HG   ARG  75          HG2       ARG  75  -6.141  -6.457  -4.534
  533   2HG   ARG  75          HG1       ARG  75  -7.218  -5.517  -3.505
  534   1HD   ARG  75          HD2       ARG  75  -5.744  -3.586  -3.621
  535   2HD   ARG  75          HD1       ARG  75  -4.504  -4.536  -4.461
  536    HE   ARG  75           HE       ARG  75  -6.024  -4.699  -6.381
  537   1HH1  ARG  75          HH11      ARG  75  -6.220  -1.981  -4.414
  538   2HH1  ARG  75          HH12      ARG  75  -7.703  -1.389  -5.081
  539   1HH2  ARG  75          HH21      ARG  75  -8.289  -4.223  -6.989
  540   2HH2  ARG  75          HH22      ARG  75  -8.874  -2.656  -6.539
  541    H    ASN  76           HN       ASN  76  -7.576  -4.349  -1.014
  542    HA   ASN  76           HA       ASN  76  -7.540  -5.605   1.711
  543   1HB   ASN  76          HB2       ASN  76  -7.250  -3.265   2.044
  544   2HB   ASN  76          HB1       ASN  76  -8.411  -2.866   0.782
  545   1HD2  ASN  76          HD21      ASN  76 -10.573  -2.575   1.429
  546   2HD2  ASN  76          HD22      ASN  76 -11.166  -2.953   2.974
  547    HA   PRO  77           HA       PRO  77 -11.297  -6.831  -0.718
  548   1HB   PRO  77          HB2       PRO  77 -10.865  -9.526  -0.678
  549   2HB   PRO  77          HB1       PRO  77 -10.202  -8.466  -1.936
  550   1HG   PRO  77          HG2       PRO  77  -8.859  -9.710   0.386
  551   2HG   PRO  77          HG1       PRO  77  -8.216  -9.305  -1.211
  552   1HD   PRO  77          HD2       PRO  77  -7.815  -7.841   1.125
  553   2HD   PRO  77          HD1       PRO  77  -7.542  -7.254  -0.529
  554    H    ASP  78           HN       ASP  78 -10.286  -6.813   2.354
  555    HA   ASP  78           HA       ASP  78 -12.432  -8.630   3.380
  556   1HB   ASP  78          HB2       ASP  78  -9.741  -8.474   3.945
  557   2HB   ASP  78          HB1       ASP  78 -10.441  -7.501   5.239
  558    H    ALA  79           HN       ALA  79 -11.765  -5.390   2.775
  559    HA   ALA  79           HA       ALA  79 -12.969  -3.442   3.383
  560   1HB   ALA  79          HB1       ALA  79 -14.656  -5.090   5.226
  561   2HB   ALA  79          HB2       ALA  79 -14.735  -5.430   3.497
  562   3HB   ALA  79          HB3       ALA  79 -15.143  -3.824   4.100
  563    H    GLU  80           HN       GLU  80 -10.678  -4.583   4.990
  564    HA   GLU  80           HA       GLU  80 -11.281  -3.852   7.782
  565   1HB   GLU  80          HB2       GLU  80  -9.443  -5.450   6.354
  566   2HB   GLU  80          HB1       GLU  80  -8.481  -4.166   7.086
  567   1HG   GLU  80          HG2       GLU  80 -10.300  -6.141   8.468
  568   2HG   GLU  80          HG1       GLU  80  -8.573  -5.898   8.716
  569    H    ILE  81           HN       ILE  81  -9.856  -2.185   8.866
  570    HA   ILE  81           HA       ILE  81 -10.041   0.395   7.883
  571    HB   ILE  81           HB       ILE  81  -9.246  -0.466  10.134
  572   1HG1  ILE  81          HG12      ILE  81  -9.055   1.954   9.264
  573   2HG1  ILE  81          HG11      ILE  81  -8.031   1.515  10.630
  574   1HG2  ILE  81          HG21      ILE  81  -6.577  -0.605   8.709
  575   2HG2  ILE  81          HG22      ILE  81  -7.533  -2.010   9.181
  576   3HG2  ILE  81          HG23      ILE  81  -6.876  -0.936  10.416
  577   1HD1  ILE  81          HD11      ILE  81  -7.221   2.525   8.090
  578   2HD1  ILE  81          HD12      ILE  81  -6.629   0.870   8.210
  579   3HD1  ILE  81          HD13      ILE  81  -6.197   2.051   9.443
  580    H    SER  82           HN       SER  82  -7.488  -1.975   7.273
  581    HA   SER  82           HA       SER  82  -6.676  -0.427   4.857
  582   1HB   SER  82          HB2       SER  82  -4.302  -0.610   5.597
  583   2HB   SER  82          HB1       SER  82  -5.270   0.345   6.715
  584    HG   SER  82           HG       SER  82  -4.173  -1.089   7.957
  585    HA   PRO  83           HA       PRO  83  -6.243  -4.404   3.101
  586   1HB   PRO  83          HB2       PRO  83  -4.082  -4.096   1.448
  587   2HB   PRO  83          HB1       PRO  83  -5.671  -3.384   1.108
  588   1HG   PRO  83          HG2       PRO  83  -3.233  -2.113   2.240
  589   2HG   PRO  83          HG1       PRO  83  -4.417  -1.467   1.093
  590   1HD   PRO  83          HD2       PRO  83  -4.388  -0.818   3.740
  591   2HD   PRO  83          HD1       PRO  83  -5.859  -0.816   2.744
  592    H    TRP  84           HN       TRP  84  -4.289  -6.010   2.467
  593    HA   TRP  84           HA       TRP  84  -2.107  -6.042   4.456
  594   1HB   TRP  84          HB2       TRP  84  -2.983  -8.302   5.293
  595   2HB   TRP  84          HB1       TRP  84  -3.912  -6.889   5.797
  596    HD1  TRP  84           HD1      TRP  84  -6.254  -6.448   4.581
  597    HE1  TRP  84           HE1      TRP  84  -7.848  -8.036   3.322
  598    HE3  TRP  84           HE3      TRP  84  -3.116 -10.397   3.777
  599    HZ2  TRP  84           HZ2      TRP  84  -7.798 -10.637   2.130
  600    HZ3  TRP  84           HZ3      TRP  84  -3.914 -12.414   2.580
  601    HH2  TRP  84           HH2      TRP  84  -6.249 -12.540   1.756
  602    H    CYS  85           HN       CYS  85  -0.642  -7.932   4.030
  603    HA   CYS  85           HA       CYS  85  -1.114  -9.643   1.724
  604   1HB   CYS  85          HB2       CYS  85  -0.814  -7.529   0.564
  605   2HB   CYS  85          HB1       CYS  85   0.665  -7.200   1.468
  606    H    TYR  86           HN       TYR  86   0.672 -11.115   1.359
  607    HA   TYR  86           HA       TYR  86   2.163 -11.863   3.680
  608   1HB   TYR  86          HB2       TYR  86   2.642 -12.470   0.739
  609   2HB   TYR  86          HB1       TYR  86   3.218 -13.432   2.100
  610    HD1  TYR  86           HD1      TYR  86   0.602 -13.055  -0.262
  611    HD2  TYR  86           HD2      TYR  86   1.345 -14.175   3.820
  612    HE1  TYR  86           HE1      TYR  86  -1.552 -14.283  -0.201
  613    HE2  TYR  86           HE2      TYR  86  -0.808 -15.400   3.877
  614    HH   TYR  86           HH       TYR  86  -3.049 -15.233   2.585
  615    H    THR  87           HN       THR  87   4.543 -11.750   3.955
  616    HA   THR  87           HA       THR  87   5.635  -9.173   2.961
  617    HB   THR  87           HB       THR  87   7.490 -10.292   4.651
  618    HG1  THR  87           HG1      THR  87   6.520 -11.960   5.457
  619   1HG2  THR  87          HG21      THR  87   5.204  -9.008   6.007
  620   2HG2  THR  87          HG22      THR  87   5.865  -8.113   4.639
  621   3HG2  THR  87          HG23      THR  87   6.908  -8.555   5.990
  622    H    MET  88           HN       MET  88   7.321  -9.057   1.516
  623    HA   MET  88           HA       MET  88   8.053 -11.115  -0.234
  624   1HB   MET  88          HB2       MET  88   9.908  -9.624  -0.797
  625   2HB   MET  88          HB1       MET  88   8.472  -8.662  -0.450
  626   1HG   MET  88          HG2       MET  88   9.355  -7.788   1.471
  627   2HG   MET  88          HG1       MET  88  10.217  -9.273   1.873
  628   1HE   MET  88          HE1       MET  88  11.991  -8.679   2.605
  629   2HE   MET  88          HE2       MET  88  12.717  -7.101   2.309
  630   3HE   MET  88          HE3       MET  88  13.452  -8.544   1.616
  631    H    ASP  89           HN       ASP  89   9.009 -10.747   3.093
  632    HA   ASP  89           HA       ASP  89  11.262 -12.659   2.677
  633   1HB   ASP  89          HB2       ASP  89  10.948 -10.221   4.107
  634   2HB   ASP  89          HB1       ASP  89  11.106 -11.501   5.310
  635    HA   PRO  90           HA       PRO  90   8.711 -15.680   4.615
  636   1HB   PRO  90          HB2       PRO  90  10.705 -17.435   5.304
  637   2HB   PRO  90          HB1       PRO  90  10.098 -17.261   3.644
  638   1HG   PRO  90          HG2       PRO  90  12.547 -16.107   4.893
  639   2HG   PRO  90          HG1       PRO  90  12.325 -16.799   3.278
  640   1HD   PRO  90          HD2       PRO  90  12.387 -14.123   3.728
  641   2HD   PRO  90          HD1       PRO  90  11.428 -14.856   2.422
  642    H    ASN  91           HN       ASN  91  11.122 -13.801   6.134
  643    HA   ASN  91           HA       ASN  91  10.975 -14.927   8.805
  644   1HB   ASN  91          HB2       ASN  91  11.922 -12.372   7.512
  645   2HB   ASN  91          HB1       ASN  91  11.898 -12.516   9.269
  646   1HD2  ASN  91          HD21      ASN  91  12.742 -15.071   9.777
  647   2HD2  ASN  91          HD22      ASN  91  14.277 -15.354   9.111
  648    H    VAL  92           HN       VAL  92   8.955 -12.854   6.893
  649    HA   VAL  92           HA       VAL  92   7.391 -12.081   9.330
  650    HB   VAL  92           HB       VAL  92   7.672 -10.841   6.565
  651   1HG1  VAL  92          HG11      VAL  92   5.938 -10.158   8.954
  652   2HG1  VAL  92          HG12      VAL  92   5.442 -10.384   7.277
  653   3HG1  VAL  92          HG13      VAL  92   6.365  -8.955   7.738
  654   1HG2  VAL  92          HG21      VAL  92   8.420  -9.662   9.252
  655   2HG2  VAL  92          HG22      VAL  92   8.929  -9.135   7.648
  656   3HG2  VAL  92          HG23      VAL  92   9.556 -10.639   8.322
  657    H    ARG  93           HN       ARG  93   5.333 -12.934   9.465
  658    HA   ARG  93           HA       ARG  93   4.374 -14.843   7.554
  659   1HB   ARG  93          HB2       ARG  93   3.903 -14.118  10.184
  660   2HB   ARG  93          HB1       ARG  93   2.415 -13.631   9.373
  661   1HG   ARG  93          HG2       ARG  93   3.688 -16.380   9.346
  662   2HG   ARG  93          HG1       ARG  93   2.150 -15.928  10.081
  663   1HD   ARG  93          HD2       ARG  93   1.081 -16.270   8.117
  664   2HD   ARG  93          HD1       ARG  93   2.169 -15.131   7.299
  665    HE   ARG  93           HE       ARG  93   3.817 -17.064   7.168
  666   1HH1  ARG  93          HH11      ARG  93   0.531 -17.267   6.491
  667   2HH1  ARG  93          HH12      ARG  93   0.495 -18.990   6.320
  668   1HH2  ARG  93          HH21      ARG  93   3.749 -19.435   7.435
  669   2HH2  ARG  93          HH22      ARG  93   2.316 -20.218   6.856
  670    H    TRP  94           HN       TRP  94   2.976 -11.718   8.563
  671    HA   TRP  94           HA       TRP  94   2.400 -10.946   5.788
  672   1HB   TRP  94          HB2       TRP  94  -0.034 -10.984   6.099
  673   2HB   TRP  94          HB1       TRP  94   0.616 -12.594   6.406
  674    HD1  TRP  94           HD1      TRP  94   0.417 -13.564   8.799
  675    HE1  TRP  94           HE1      TRP  94  -0.737 -12.761  10.964
  676    HE3  TRP  94           HE3      TRP  94  -0.674  -8.751   7.485
  677    HZ2  TRP  94           HZ2      TRP  94  -1.959 -10.390  11.998
  678    HZ3  TRP  94           HZ3      TRP  94  -1.833  -7.244   9.075
  679    HH2  TRP  94           HH2      TRP  94  -2.476  -8.057  11.327
  680    H    GLU  95           HN       GLU  95   1.031  -8.781   5.926
  681    HA   GLU  95           HA       GLU  95   1.070  -7.319   8.427
  682   1HB   GLU  95          HB2       GLU  95   3.528  -7.683   7.647
  683   2HB   GLU  95          HB1       GLU  95   3.160  -6.459   6.432
  684   1HG   GLU  95          HG2       GLU  95   3.770  -4.980   8.047
  685   2HG   GLU  95          HG1       GLU  95   2.160  -5.289   8.700
  686    H    TYR  96           HN       TYR  96   0.000  -5.317   8.198
  687    HA   TYR  96           HA       TYR  96  -1.640  -4.921   5.867
  688   1HB   TYR  96          HB2       TYR  96  -0.962  -3.491   8.412
  689   2HB   TYR  96          HB1       TYR  96  -1.812  -2.584   7.165
  690    HD1  TYR  96           HD1      TYR  96  -2.499  -6.103   6.994
  691    HD2  TYR  96           HD2      TYR  96  -3.607  -2.488   9.037
  692    HE1  TYR  96           HE1      TYR  96  -4.638  -7.145   7.686
  693    HE2  TYR  96           HE2      TYR  96  -5.746  -3.534   9.727
  694    HH   TYR  96           HH       TYR  96  -7.025  -5.339   9.624
  695    H    CYS  97           HN       CYS  97  -1.587  -2.516   4.882
  696    HA   CYS  97           HA       CYS  97   1.231  -2.048   3.975
  697   1HB   CYS  97          HB2       CYS  97  -1.325  -1.238   2.577
  698   2HB   CYS  97          HB1       CYS  97   0.283  -1.416   1.876
  699    H    ASN  98           HN       ASN  98   2.000   0.100   3.872
  700    HA   ASN  98           HA       ASN  98   1.336   1.927   5.879
  701   1HB   ASN  98          HB2       ASN  98   2.646   2.050   3.188
  702   2HB   ASN  98          HB1       ASN  98   2.329   3.568   4.027
  703   1HD2  ASN  98          HD21      ASN  98   4.806   3.649   4.136
  704   2HD2  ASN  98          HD22      ASN  98   5.570   2.838   5.417
  705    H    LEU  99           HN       LEU  99  -1.054   2.057   5.931
  706    HA   LEU  99           HA       LEU  99  -2.056   4.031   3.940
  707   1HB   LEU  99          HB2       LEU  99  -3.197   1.332   4.681
  708   2HB   LEU  99          HB1       LEU  99  -4.151   2.563   3.861
  709    HG   LEU  99           HG       LEU  99  -1.489   1.570   2.836
  710   1HD1  LEU  99          HD11      LEU  99  -3.013   0.446   1.098
  711   2HD1  LEU  99          HD12      LEU  99  -4.321   0.691   2.256
  712   3HD1  LEU  99          HD13      LEU  99  -2.933  -0.306   2.691
  713   1HD2  LEU  99          HD21      LEU  99  -2.165   3.826   2.094
  714   2HD2  LEU  99          HD22      LEU  99  -3.727   3.192   1.574
  715   3HD2  LEU  99          HD23      LEU  99  -2.250   2.680   0.759
  716    H    THR 100           HN       THR 100  -3.578   5.443   4.765
  717    HA   THR 100           HA       THR 100  -4.756   5.100   7.435
  718    HB   THR 100           HB       THR 100  -3.635   7.557   7.737
  719    HG1  THR 100           HG1      THR 100  -1.870   7.725   6.618
  720   1HG2  THR 100          HG21      THR 100  -2.083   5.071   8.433
  721   2HG2  THR 100          HG22      THR 100  -3.616   5.450   9.218
  722   3HG2  THR 100          HG23      THR 100  -2.251   6.557   9.367
  723    H    GLN 101           HN       GLN 101  -6.354   6.854   7.818
  724    HA   GLN 101           HA       GLN 101  -7.904   7.559   5.553
  725   1HB   GLN 101          HB2       GLN 101  -7.683   8.303   8.416
  726   2HB   GLN 101          HB1       GLN 101  -8.522   9.474   7.397
  727   1HG   GLN 101          HG2       GLN 101 -10.078   7.792   6.628
  728   2HG   GLN 101          HG1       GLN 101  -9.167   6.515   7.434
  729   1HE2  GLN 101          HE21      GLN 101  -9.874   5.981   9.503
  730   2HE2  GLN 101          HE22      GLN 101 -10.850   6.967  10.482
  731    H    CYS 102           HN       CYS 102  -6.770   8.599   3.876
  732    HA   CYS 102           HA       CYS 102  -4.709  10.420   3.923
  733   1HB   CYS 102          HB2       CYS 102  -7.233  10.609   2.243
  734   2HB   CYS 102          HB1       CYS 102  -5.655  11.270   1.814
  735    HA   PRO 103           HA       PRO 103  -6.287  13.804   6.296
  736   1HB   PRO 103          HB2       PRO 103  -4.317  15.609   5.696
  737   2HB   PRO 103          HB1       PRO 103  -4.089  14.268   6.836
  738   1HG   PRO 103          HG2       PRO 103  -3.245  14.497   3.991
  739   2HG   PRO 103          HG1       PRO 103  -2.392  13.783   5.367
  740   1HD   PRO 103          HD2       PRO 103  -3.705  12.307   3.494
  741   2HD   PRO 103          HD1       PRO 103  -3.488  11.780   5.178
  742    H    VAL 104           HN       VAL 104  -6.168  13.611   2.936
  743    HA   VAL 104           HA       VAL 104  -7.042  16.384   2.404
  744    HB   VAL 104           HB       VAL 104  -6.638  13.886   0.732
  745   1HG1  VAL 104          HG11      VAL 104  -8.209  15.017  -0.559
  746   2HG1  VAL 104          HG12      VAL 104  -6.715  15.758  -1.133
  747   3HG1  VAL 104          HG13      VAL 104  -7.719  16.599   0.048
  748   1HG2  VAL 104          HG21      VAL 104  -4.499  14.623   1.175
  749   2HG2  VAL 104          HG22      VAL 104  -5.019  16.284   1.461
  750   3HG2  VAL 104          HG23      VAL 104  -4.864  15.680  -0.189
  751    H    THR 105           HN       THR 105  -8.527  13.710   3.662
  752    HA   THR 105           HA       THR 105 -10.962  13.524   2.131
  753    HB   THR 105           HB       THR 105 -10.071  11.825   3.715
  754    HG1  THR 105           HG1      THR 105 -12.560  12.853   4.588
  755   1HG2  THR 105          HG21      THR 105  -9.564  13.901   5.369
  756   2HG2  THR 105          HG22      THR 105  -9.717  12.238   5.937
  757   3HG2  THR 105          HG23      THR 105 -11.089  13.340   6.055
  758    H    GLU 106           HN       GLU 106 -11.736  15.701   1.815
  759    HA   GLU 106           HA       GLU 106 -12.030  17.802   3.564
  760   1HB   GLU 106          HB2       GLU 106 -13.998  18.384   2.217
  761   2HB   GLU 106          HB1       GLU 106 -12.760  17.670   1.183
  762   1HG   GLU 106          HG2       GLU 106 -14.104  15.433   1.944
  763   2HG   GLU 106          HG1       GLU 106 -15.417  16.611   1.954
  764    H    SER 107           HN       SER 107 -13.550  18.399   5.192
  765    HA   SER 107           HA       SER 107 -14.576  16.268   6.851
  766   1HB   SER 107          HB2       SER 107 -13.922  18.931   7.100
  767   2HB   SER 107          HB1       SER 107 -15.681  18.983   7.181
  768    HG   SER 107           HG       SER 107 -13.982  17.302   8.721
  769    H    SER 108           HN       SER 108 -17.077  16.882   7.639
  770    HA   SER 108           HA       SER 108 -18.743  16.012   5.409
  771   1HB   SER 108          HB2       SER 108 -18.778  16.106   8.267
  772   2HB   SER 108          HB1       SER 108 -20.243  16.890   7.685
  773    HG   SER 108           HG       SER 108 -19.837  14.345   7.877
  774    H    VAL 109           HN       VAL 109 -17.526  18.999   6.119
  775    HA   VAL 109           HA       VAL 109 -19.619  20.856   6.126
  776    HB   VAL 109           HB       VAL 109 -17.127  21.241   6.229
  777   1HG1  VAL 109          HG11      VAL 109 -17.143  19.876   3.820
  778   2HG1  VAL 109          HG12      VAL 109 -15.785  20.803   4.457
  779   3HG1  VAL 109          HG13      VAL 109 -16.907  21.551   3.320
  780   1HG2  VAL 109          HG21      VAL 109 -17.269  23.318   4.627
  781   2HG2  VAL 109          HG22      VAL 109 -18.334  23.239   6.030
  782   3HG2  VAL 109          HG23      VAL 109 -18.950  22.823   4.431
  783    H    LEU 110           HN       LEU 110 -20.771  21.935   4.403
  784    HA   LEU 110           HA       LEU 110 -21.163  20.219   1.994
  785   1HB   LEU 110          HB2       LEU 110 -22.752  22.280   3.513
  786   2HB   LEU 110          HB1       LEU 110 -23.213  21.839   1.868
  787    HG   LEU 110           HG       LEU 110 -22.817  19.373   2.985
  788   1HD1  LEU 110          HD11      LEU 110 -23.620  19.302   5.203
  789   2HD1  LEU 110          HD12      LEU 110 -24.273  20.938   5.114
  790   3HD1  LEU 110          HD13      LEU 110 -22.529  20.688   5.205
  791   1HD2  LEU 110          HD21      LEU 110 -25.033  19.123   2.484
  792   2HD2  LEU 110          HD22      LEU 110 -24.864  20.746   1.815
  793   3HD2  LEU 110          HD23      LEU 110 -25.508  20.526   3.442
  794    H    ALA 111           HN       ALA 111 -18.964  21.268   1.291
  795    HA   ALA 111           HA       ALA 111 -19.112  24.065   0.397
  796   1HB   ALA 111          HB1       ALA 111 -16.885  23.755   0.604
  797   2HB   ALA 111          HB2       ALA 111 -16.928  22.597  -0.726
  798   3HB   ALA 111          HB3       ALA 111 -17.157  22.044   0.933
  799    H    THR 112           HN       THR 112 -19.065  24.694  -1.849
  800    HA   THR 112           HA       THR 112 -20.200  22.625  -3.698
  801    HB   THR 112           HB       THR 112 -20.452  25.375  -4.572
  802    HG1  THR 112           HG1      THR 112 -20.360  26.000  -2.468
  803   1HG2  THR 112          HG21      THR 112 -21.917  22.997  -4.568
  804   2HG2  THR 112          HG22      THR 112 -22.443  24.548  -5.223
  805   3HG2  THR 112          HG23      THR 112 -22.865  24.099  -3.570
  806    H    SER 113           HN       SER 113 -19.582  23.034  -6.056
  807    HA   SER 113           HA       SER 113 -16.681  23.202  -6.293
  808   1HB   SER 113          HB2       SER 113 -17.144  22.578  -8.583
  809   2HB   SER 113          HB1       SER 113 -18.280  21.699  -7.563
  810    HG   SER 113           HG       SER 113 -19.780  23.427  -7.995
  811    H    THR 114           HN       THR 114 -15.807  25.255  -6.098
  812    HA   THR 114           HA       THR 114 -17.065  27.444  -7.721
  813    HB   THR 114           HB       THR 114 -15.492  27.542  -5.125
  814    HG1  THR 114           HG1      THR 114 -17.489  28.043  -4.240
  815   1HG2  THR 114          HG21      THR 114 -15.115  29.558  -6.419
  816   2HG2  THR 114          HG22      THR 114 -16.245  29.932  -5.117
  817   3HG2  THR 114          HG23      THR 114 -16.839  29.705  -6.763
  818    H    ALA 115           HN       ALA 115 -15.675  28.605  -9.073
  819    HA   ALA 115           HA       ALA 115 -13.179  27.412  -9.868
  820   1HB   ALA 115          HB1       ALA 115 -14.990  29.518 -10.641
  821   2HB   ALA 115          HB2       ALA 115 -13.792  28.683 -11.630
  822   3HB   ALA 115          HB3       ALA 115 -13.333  30.117 -10.712
  823    H    VAL 116           HN       VAL 116 -11.435  27.442  -8.477
  824    HA   VAL 116           HA       VAL 116 -10.995  29.519  -6.500
  825    HB   VAL 116           HB       VAL 116  -9.364  27.242  -7.651
  826   1HG1  VAL 116          HG11      VAL 116  -8.444  29.510  -6.149
  827   2HG1  VAL 116          HG12      VAL 116  -7.524  28.104  -6.685
  828   3HG1  VAL 116          HG13      VAL 116  -8.349  28.076  -5.127
  829   1HG2  VAL 116          HG21      VAL 116  -9.817  26.805  -4.962
  830   2HG2  VAL 116          HG22      VAL 116 -10.783  26.127  -6.273
  831   3HG2  VAL 116          HG23      VAL 116 -11.303  27.609  -5.470
  832    H    SER 117           HN       SER 117 -10.125  29.110  -9.851
  833    HA   SER 117           HA       SER 117  -8.258  31.452  -9.654
  834   1HB   SER 117          HB2       SER 117  -8.201  28.849 -10.990
  835   2HB   SER 117          HB1       SER 117  -7.864  30.176 -12.099
  836    HG   SER 117           HG       SER 117  -5.933  29.905 -11.234
  837    H    GLU 118           HN       GLU 118  -8.778  33.256 -10.872
  838    HA   GLU 118           HA       GLU 118 -10.998  33.002 -12.874
  839   1HB   GLU 118          HB2       GLU 118 -11.685  35.294 -11.950
  840   2HB   GLU 118          HB1       GLU 118 -11.950  33.919 -10.876
  841   1HG   GLU 118          HG2       GLU 118  -9.277  35.161 -10.664
  842   2HG   GLU 118          HG1       GLU 118 -10.616  36.185 -10.142
  843    H    GLN 119           HN       GLN 119 -11.002  34.915 -14.404
  844    HA   GLN 119           HA       GLN 119  -8.506  36.470 -14.610
  845   1HB   GLN 119          HB2       GLN 119  -8.807  33.915 -15.821
  846   2HB   GLN 119          HB1       GLN 119  -8.892  35.108 -17.119
  847   1HG   GLN 119          HG2       GLN 119  -6.809  35.819 -15.241
  848   2HG   GLN 119          HG1       GLN 119  -6.568  34.173 -15.828
  849   1HE2  GLN 119          HE21      GLN 119  -7.743  37.241 -17.345
  850   2HE2  GLN 119          HE22      GLN 119  -6.717  37.133 -18.693