*HEADER    IMMUNOGLOBULIN-BINDING PROTEIN          02-AUG-01   1GJS
*TITLE     SOLUTION STRUCTURE OF THE ALBUMIN BINDING DOMAIN OF
*TITLE    2 STREPTOCOCCAL PROTEIN G
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: IMMUNOGLOBULIN G BINDING PROTEIN G;
*COMPND   3 SYNONYM: ABD, ALBUMIN-BINDING DOMAIN OF PROTEIN G,
*COMPND   4  IGG BINDING PROTEIN G;
*COMPND   5 CHAIN: A;
*COMPND   6 FRAGMENT: ALBUMIN-BINDING DOMAIN RESIDUES 254-299;
*COMPND   7 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: GROUP G STREPTOCOCCI;
*SOURCE   3 ORGANISM_COMMON: STREPTOCOCCUS SP. 'GROUP G';
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI
*KEYWDS    BACTERIAL SURFACE PROTEIN, ALBUMIN BINDING, PROTEIN G
*EXPDTA    NMR, 30 STRUCTURES
*AUTHOR    M.U.JOHANSSON,I.M.FRICK,H.NILSSON,P.J.KRAULIS,S.HOBER,
*AUTHOR   2 P.JONASSON,P.A.NYGREN,M.UHLEN,L.BJORCK,S.DRAKENBERGFORSEN,
*AUTHOR   3 M.WIKSTROM
*REVDAT   1   09-AUG-01 1GJS    0
*REVDAT   1   09-AUG-01 1GJS    0




! NMR constraints ABD from protein G 
! Mats Wikstrom, Biovitrum, SE-11012 Stockholm, Sweden

! NOE distance constraints

! residue 1    Met , intraresidue NOEs
assi (resi 1    and name HA  ) (resi 1    and name HG# )  4.00  4.00  2.00

! residue 1    Met , NOEs forward in sequence
assi (resi 2    and name HA  ) (resi 2    and name HG# )  4.00  2.20  1.00
assi (resi 2    and name HG# ) (resi 2    and name HD# )  2.50  0.70  0.20
assi (resi 2    and name HG# ) (resi 2    and name HE# )  4.00  2.20  1.00

! residue 4    Ile , intraresidue NOEs
assi (resi 4    and name HN  ) (resi 4    and name HB  )  4.00  2.20  1.00
assi (resi 4    and name HA  ) (resi 4    and name HG1#)  4.00  2.20  1.00
assi (resi 4    and name HG1#) (resi 4    and name HG2#)  4.00  2.20  1.50

! residue 4    Ile , NOEs forward in sequence
assi (resi 4    and name HA  ) (resi 5    and name HN  )  4.00  2.20  1.00

! residue 5    Phe , intraresidue NOEs
assi (resi 5    and name HN  ) (resi 5    and name HB# )  4.00  2.20  1.00

! residue 5    Phe , NOEs forward in sequence
assi (resi 5    and name HA  ) (resi 6    and name HN  )  4.00  2.20  1.00

! residue 6    Val , intraresidue NOEs
assi (resi 6    and name HN  ) (resi 6    and name HB  )  4.00  2.20  1.00
assi (resi 6    and name HN  ) (resi 6    and name HG*)  4.00  2.20  1.50
assi (resi 6    and name HA  ) (resi 6    and name HG# )  3.00  1.20  0.80

! residue 6    Val , NOEs forward in sequence
assi (resi 6    and name HA  ) (resi 7    and name HN  )  4.00  2.20  1.00

! residue 7    Leu , intraresidue NOEs
assi (resi 7    and name HN  ) (resi 7    and name HB# )  4.00  2.20  1.00
assi (resi 7    and name HA  ) (resi 7    and name HG  )  4.00  2.20  1.00
assi (resi 7    and name HA  ) (resi 7    and name HD* )  4.00  2.20  1.50
assi (resi 7    and name HB# ) (resi 7    and name HD* )  4.00  2.20  1.50

! residue 10   Gln , intraresidue NOEs
assi (resi 10   and name HA  ) (resi 10   and name HG# )  4.00  2.20  1.00
assi (resi 10   and name HB# ) (resi 10   and name HG# )  2.50  0.70  0.20

! residue 12   Asp , intraresidue NOEs
assi (resi 12   and name HA  ) (resi 12   and name HB# )  3.00  1.20  0.30

! residue 12   Asp , NOEs forward in sequence
assi (resi 12   and name HA  ) (resi 13   and name HN  )  4.00  2.20  1.00

! residue 13   Glu , intraresidue NOEs
assi (resi 13   and name HN  ) (resi 13   and name HB# )  4.00  2.20  1.00
assi (resi 13   and name HN  ) (resi 13   and name HG# )  4.00  2.20  1.00
assi (resi 13   and name HA  ) (resi 13   and name HG# )  4.00  2.20  1.00
assi (resi 13   and name HB# ) (resi 13   and name HG# )  2.50  0.70  0.20

! residue 13   Glu , NOEs forward in sequence
assi (resi 13   and name HA  ) (resi 14   and name HN  )  4.00  2.20  1.00

! residue 14   Ala , intraresidue NOEs
assi (resi 14   and name HN  ) (resi 14   and name HB# )  3.00  1.20  0.80

! residue 14   Ala , NOEs forward in sequence
assi (resi 14   and name HA  ) (resi 15   and name HN  )  3.00  1.20  0.30

! residue 15   Val , intraresidue NOEs
assi (resi 15   and name HN  ) (resi 15   and name HB  )  4.00  2.20  1.00
assi (resi 15   and name HN  ) (resi 15   and name HG# )  4.00  2.20  1.50
assi (resi 15   and name HA  ) (resi 15   and name HG# )  3.00  1.20  0.80

! residue 15   Val , NOEs forward in sequence
assi (resi 15   and name HA  ) (resi 16   and name HN  )  4.00  2.20  1.00
assi (resi 15   and name HB  ) (resi 16   and name HN  )  4.00  2.20  1.00
assi (resi 15   and name HG# ) (resi 16   and name HN  )  4.00  2.20  1.50

! residue 16   Asp , intraresidue NOEs
assi (resi 16   and name HN  ) (resi 16   and name HB# )  4.00  2.20  1.00

! residue 16   Asp , NOEs forward in sequence
assi (resi 16   and name HB# ) (resi 19   and name HB# )  4.00  2.20  1.00

! residue 17   Ala , intraresidue NOEs
assi (resi 17   and name HN  ) (resi 17   and name HB# )  4.00  2.20  1.50

! residue 17   Ala , NOEs forward in sequence
assi (resi 17   and name HA  ) (resi 20   and name HB# )  4.00  2.20  1.00

! residue 18   Asn , intraresidue NOEs
assi (resi 18   and name HN  ) (resi 18   and name HB# )  4.00  2.20  1.00
assi (resi 18   and name HA  ) (resi 18   and name HB# )  3.00  1.20  0.30
assi (resi 18   and name HD2#) (resi 18   and name HB# )  4.00  2.20  1.00

! residue 18   Asn , NOEs forward in sequence
assi (resi 18   and name HB# ) (resi 19   and name HN  )  4.00  2.20  1.00
assi (resi 18   and name HB# ) (resi 19   and name HA  )  4.00  2.20  1.00
assi (resi 18   and name HA  ) (resi 21   and name HB# )  3.00  1.20  0.30
assi (resi 18   and name HB# ) (resi 21   and name HB# )  4.00  2.20  1.50
assi (resi 18   and name HD2#) (resi 22   and name HN  )  4.00  2.20  1.00

! residue 19   Ser , intraresidue NOEs
assi (resi 19   and name HN  ) (resi 19   and name HB# )  4.00  2.20  1.00
assi (resi 19   and name HA  ) (resi 19   and name HB# )  2.50  0.70  0.20

! residue 19   Ser , NOEs forward in sequence
assi (resi 19   and name HA  ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 19   and name HA  ) (resi 22   and name HG# )  4.00  2.20  1.00
assi (resi 19   and name HA  ) (resi 22   and name HB# )  4.00  2.20  1.00
assi (resi 19   and name HB# ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 19   and name HB# ) (resi 22   and name HB# )  4.00  2.20  1.00
assi (resi 19   and name HB# ) (resi 50   and name HG# )  4.00  2.20  1.50

! residue 20   Leu , intraresidue NOEs
assi (resi 20   and name HN  ) (resi 20   and name HB# )  4.00  2.20  1.00
assi (resi 20   and name HA  ) (resi 20   and name HB# )  3.00  1.20  0.30
assi (resi 20   and name HA  ) (resi 20   and name HG  )  4.00  2.20  1.00
assi (resi 20   and name HA  ) (resi 20   and name HD* )  4.00  2.20  1.00
assi (resi 20   and name HB# ) (resi 20   and name HD* )  2.50  0.70  0.20

! residue 20   Leu , NOEs forward in sequence
assi (resi 20   and name HA  ) (resi 21   and name HN  )  4.00  2.20  1.00
assi (resi 20   and name HB# ) (resi 21   and name HN  )  3.00  1.20  0.30
assi (resi 20   and name HG  ) (resi 21   and name HN  )  4.00  2.20  1.00
assi (resi 20   and name HD*) (resi 21   and name HN  )  4.00  2.20  1.50
assi (resi 20   and name HB# ) (resi 21   and name HA  )  4.00  2.20  1.00
assi (resi 20   and name HB# ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 20   and name HA  ) (resi 23   and name HB# )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 23   and name HB# )  4.00  2.20  2.00
assi (resi 20   and name HG  ) (resi 24   and name HE# )  4.00  2.20  1.00
assi (resi 20   and name HD*) (resi 24   and name HG# )  4.00  2.20  1.50
assi (resi 20   and name HD*) (resi 24   and name HE# )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 24   and name HN  )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 24   and name HD# )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 24   and name HG# )  3.00  1.20  0.80
assi (resi 20   and name HD* ) (resi 24   and name HE# )  4.00  2.20  1.50
assi (resi 20   and name HD*) (resi 48   and name HA  )  4.00  2.20  1.50
assi (resi 20   and name HD*) (resi 49   and name HN  )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 49   and name HA  )  4.00  2.20  1.50
assi (resi 20   and name HA  ) (resi 50   and name HA  )  4.00  2.20  1.00
assi (resi 20   and name HA  ) (resi 50   and name HG*)  3.00  1.20  0.80
assi (resi 20   and name HD*) (resi 50   and name HA  )  4.00  2.20  1.50
assi (resi 20   and name HD*) (resi 50   and name HG* )  2.50  0.70  1.20
assi (resi 20   and name HB# ) (resi 50   and name HG* )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 50   and name HN  )  4.00  2.20  1.50
assi (resi 20   and name HD* ) (resi 50   and name HB  )  4.00  2.00  1.50
assi (resi 20   and name HD* ) (resi 53   and name HN  )  4.00  2.00  1.50
assi (resi 20   and name HD* ) (resi 53   and name HB  )  4.00  2.00  1.50
assi (resi 20   and name HD* ) (resi 53   and name HG*)  2.50  0.70  1.20

! residue 21   Ala , intraresidue NOEs
assi (resi 21   and name HN  ) (resi 21   and name HA  )  2.50  0.70  0.20
assi (resi 21   and name HN  ) (resi 21   and name HB# )  2.50  0.70  0.70

! residue 21   Ala , NOEs forward in sequence
assi (resi 21   and name HA  ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 21   and name HB# ) (resi 22   and name HN  )  2.50  0.70  0.90
assi (resi 21   and name HA  ) (resi 24   and name HN  )  3.00  1.20  0.50
assi (resi 21   and name HA  ) (resi 24   and name HG# )  4.00  2.20  1.00
assi (resi 21   and name HA  ) (resi 24   and name HD# )  4.00  2.20  1.00
assi (resi 21   and name HA  ) (resi 24   and name HB# )  3.00  1.20  0.30

! residue 22   Glu , intraresidue NOEs
assi (resi 22   and name HN  ) (resi 22   and name HA  )  2.50  0.70  0.40
assi (resi 22   and name HN  ) (resi 22   and name HB# )  2.50  0.70  0.40
assi (resi 22   and name HN  ) (resi 22   and name HG# )  4.00  4.00  1.00
assi (resi 22   and name HA  ) (resi 22   and name HB# )  2.50  0.70  0.20
assi (resi 22   and name HA  ) (resi 22   and name HG# )  3.00  1.20  0.30
assi (resi 22   and name HG# ) (resi 22   and name HB# )  2.50  0.70  0.20

! residue 22   Glu , NOEs forward in sequence
assi (resi 22   and name HG# ) (resi 23   and name HN  )  4.00  4.00  1.00
assi (resi 22   and name HB# ) (resi 23   and name HN  )  3.00  1.20  0.50
assi (resi 22   and name HB# ) (resi 23   and name HA  )  4.00  2.20  1.00
assi (resi 22   and name HG# ) (resi 23   and name HA  )  4.00  2.20  1.00
assi (resi 22   and name HA  ) (resi 25   and name HN  )  4.00  2.20  1.00
assi (resi 22   and name HA  ) (resi 25   and name HA  )  4.00  2.20  1.00
assi (resi 22   and name HA  ) (resi 25   and name HB  )  3.00  1.20  0.30
assi (resi 22   and name HA  ) (resi 25   and name HG*)  4.00  2.20  1.50
assi (resi 22   and name HA  ) (resi 26   and name HB# )  6.00  4.20  2.00  
assi (resi 22   and name HG# ) (resi 26   and name HG  )  4.00  2.20  1.00
assi (resi 22   and name HG# ) (resi 26   and name HD*)  4.00  2.20  1.50
assi (resi 22   and name HB# ) (resi 26   and name HB# )  4.00  2.20  1.00
assi (resi 22   and name HB# ) (resi 26   and name HD* )  4.00  2.20  1.50

! residue 23   Ala , intraresidue NOEs
assi (resi 23   and name HN  ) (resi 23   and name HA  )  2.50  0.70  0.40
assi (resi 23   and name HN  ) (resi 23   and name HB# )  2.50  0.70  0.90

! residue 23   Ala , NOEs forward in sequence
assi (resi 23   and name HA  ) (resi 24   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HB# ) (resi 24   and name HN  )  2.50  0.70  0.90
assi (resi 23   and name HB# ) (resi 24   and name HA  )  4.00  2.20  1.50
assi (resi 23   and name HN  ) (resi 25   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HA  ) (resi 25   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HB# ) (resi 25   and name HN  )  4.00  2.20  1.50
assi (resi 23   and name HA  ) (resi 26   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HA  ) (resi 26   and name HB# )  4.00  2.20  1.00
assi (resi 23   and name HA  ) (resi 26   and name HG  )  4.00  2.20  1.00
assi (resi 23   and name HA  ) (resi 26   and name HD*)  4.00  2.20  1.50
assi (resi 23   and name HA  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HN  ) (resi 50   and name HG*)  4.00  2.20  1.50
assi (resi 23   and name HB# ) (resi 50   and name HA  )  4.00  2.20  1.50
assi (resi 23   and name HB# ) (resi 50   and name HG*)  3.00  1.20  1.30
assi (resi 23   and name HA  ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 23   and name HB# ) (resi 53   and name HB  )  4.00  2.20  1.50
assi (resi 23   and name HB# ) (resi 53   and name HG*)  3.00  1.20  1.30

! residue 24   Lys , intraresidue NOEs
assi (resi 24   and name HN  ) (resi 24   and name HA  )  3.00  1.20  0.50
assi (resi 24   and name HN  ) (resi 24   and name HE# )  4.00  2.20  1.00
assi (resi 24   and name HN  ) (resi 24   and name HB# )  2.50  0.70  0.40
assi (resi 24   and name HN  ) (resi 24   and name HG# )  4.00  2.20  1.00
assi (resi 24   and name HN  ) (resi 24   and name HD# )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 24   and name HG# )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 24   and name HB# )  3.00  1.20  0.30
assi (resi 24   and name HA  ) (resi 24   and name HD# )  4.00  2.20  1.00
assi (resi 24   and name HG# ) (resi 24   and name HE# )  4.00  2.20  1.00
assi (resi 24   and name HG# ) (resi 24   and name HB# )  3.00  1.20  0.30
assi (resi 24   and name HE# ) (resi 24   and name HB# )  4.00  2.20  1.00
assi (resi 24   and name HB# ) (resi 24   and name HD# )  3.00  1.20  0.30

! residue 24   Lys , NOEs forward in sequence
assi (resi 24   and name HN  ) (resi 25   and name HN  )  3.00  1.20  0.70
assi (resi 24   and name HN  ) (resi 25   and name HB  )  4.00  2.20  1.00
assi (resi 24   and name HN  ) (resi 25   and name HG*)  4.00  2.20  1.50
assi (resi 24   and name HA  ) (resi 25   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HB# ) (resi 25   and name HN  )  3.00  1.20  0.50
assi (resi 24   and name HB# ) (resi 25   and name HG*)  4.00  2.20  1.50
assi (resi 24   and name HA  ) (resi 26   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 27   and name HB# )  3.00  1.20  0.80
assi (resi 24   and name HB# ) (resi 28   and name HD2#)  4.00  2.20  1.00
assi (resi 24   and name HN  ) (resi 44   and name HG2#)  4.00  2.20  1.50
assi (resi 24   and name HA  ) (resi 44   and name HB  )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 44   and name HG2#)  3.00  1.20  0.80
assi (resi 24   and name HA  ) (resi 44   and name HD1#)  4.00  2.20  1.50
assi (resi 24   and name HG# ) (resi 44   and name HA  )  4.00  2.20  1.00
assi (resi 24   and name HB# ) (resi 44   and name HG2#)  4.00  2.20  1.50
assi (resi 24   and name HD# ) (resi 45   and name HA  )  3.00  1.20  0.30
assi (resi 24   and name HE# ) (resi 45   and name HA  )  4.00  2.20  1.00
assi (resi 24   and name HB# ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HB# ) (resi 45   and name HA  )  4.00  2.20  1.00
assi (resi 24   and name HG# ) (resi 45   and name HA  )  4.00  2.20  1.00
assi (resi 24   and name HD# ) (resi 45   and name HB# )  4.00  2.20  1.00
assi (resi 24   and name HD# ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HE# ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HE# ) (resi 47   and name HB# )  3.00  1.20  0.80
assi (resi 24   and name HE# ) (resi 47   and name HB# )  4.00  2.20  1.50
assi (resi 24   and name HN  ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 24   and name HA  ) (resi 53   and name HG*)  3.00  1.20  0.80
assi (resi 24   and name HE# ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 24   and name HB# ) (resi 53   and name HG*)  3.00  1.20  0.80
assi (resi 24   and name HG# ) (resi 53   and name HA  )  4.00  2.20  1.00
assi (resi 24   and name HG# ) (resi 53   and name HG*)  3.00  1.20  0.80
assi (resi 24   and name HD# ) (resi 53   and name HG*)  4.00  2.20  1.50

! residue 25   Val , intraresidue NOEs
assi (resi 25   and name HN  ) (resi 25   and name HA  )  3.00  1.20  0.50
assi (resi 25   and name HN  ) (resi 25   and name HB  )  2.50  0.70  0.40
assi (resi 25   and name HN  ) (resi 25   and name HG*)  2.50  0.70  0.70
assi (resi 25   and name HA  ) (resi 25   and name HG*)  2.50  0.70  0.70

! residue 25   Val , NOEs forward in sequence
assi (resi 25   and name HN  ) (resi 26   and name HN  )  3.00  1.20  0.70
assi (resi 25   and name HA  ) (resi 26   and name HN  )  4.00  2.20  1.00
assi (resi 25   and name HB  ) (resi 26   and name HN  )  3.00  1.20  0.50
assi (resi 25   and name HG*) (resi 26   and name HN  )  4.00  2.20  1.50
assi (resi 25   and name HA  ) (resi 28   and name HN  )  4.00  2.20  1.00
assi (resi 25   and name HA  ) (resi 28   and name HB# )  4.00  2.20  1.00
assi (resi 25   and name HA  ) (resi 28   and name HD2#)  4.00  2.20  1.00
assi (resi 25   and name HA  ) (resi 29   and name HG# )  4.00  2.20  1.00
assi (resi 25   and name HG*) (resi 29   and name HG# )  4.00  2.20  1.50
assi (resi 25   and name HG*) (resi 29   and name HD# )  4.00  2.20  1.50

! residue 26   Leu , intraresidue NOEs
assi (resi 26   and name HN  ) (resi 26   and name HA  )  3.00  1.20  0.50
assi (resi 26   and name HN  ) (resi 26   and name HB# )  2.50  0.70  0.40
assi (resi 26   and name HN  ) (resi 26   and name HG  )  3.00  1.20  0.50
assi (resi 26   and name HN  ) (resi 26   and name HD* )  4.00  1.20  1.50
assi (resi 26   and name HA  ) (resi 26   and name HB# )  3.00  1.20  0.30
assi (resi 26   and name HA  ) (resi 26   and name HG  )  3.00  1.20  0.30
assi (resi 26   and name HA  ) (resi 26   and name HD*)  2.50  0.70  0.70
assi (resi 26   and name HB# ) (resi 26   and name HD* )  3.00  1.20  0.80
assi (resi 26   and name HB# ) (resi 26   and name HG  )  2.50  0.70  0.20

! residue 26   Leu , NOEs forward in sequence
assi (resi 26   and name HN  ) (resi 27   and name HN  )  3.00  1.20  0.70
assi (resi 26   and name HA  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HB# ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HG  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HD* ) (resi 27   and name HN  )  4.00  2.20  1.50
assi (resi 26   and name HA  ) (resi 29   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HA  ) (resi 29   and name HB# )  4.00  2.20  1.00
assi (resi 26   and name HA  ) (resi 29   and name HD# )  4.00  2.20  1.00
assi (resi 26   and name HD* ) (resi 29   and name HB# )  4.00  2.20  1.50
assi (resi 26   and name HD* ) (resi 29   and name HG# )  4.00  2.20  1.50
assi (resi 26   and name HD* ) (resi 29   and name HD# )  4.00  2.20  1.50
assi (resi 26   and name HA  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HD* ) (resi 30   and name HN  )  4.00  2.20  1.50

! residue 27   Ala , intraresidue NOEs
assi (resi 27   and name HN  ) (resi 27   and name HA  )  3.00  1.20  0.50
assi (resi 27   and name HN  ) (resi 27   and name HB# )  2.50  1.20  0.70

! residue 27   Ala , NOEs forward in sequence
assi (resi 27   and name HA  ) (resi 28   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HB# ) (resi 28   and name HN  )  3.00  1.20  1.00
assi (resi 27   and name HA  ) (resi 29   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HA  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HA  ) (resi 30   and name HG# )  4.00  2.20  1.00
assi (resi 27   and name HA  ) (resi 30   and name HB# )  4.00  2.20  1.00
assi (resi 27   and name HA  ) (resi 31   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HA  ) (resi 31   and name HD* )  4.00  2.20  1.50
assi (resi 27   and name HB# ) (resi 53   and name HB  )  4.00  2.20  1.50
assi (resi 27   and name HB# ) (resi 53   and name HG*)  3.00  1.20  1.30  
assi (resi 27   and name HA  ) (resi 57   and name HD1#)  4.00  2.20  1.50
assi (resi 27   and name HA  ) (resi 57   and name HG1#)  4.00  2.20  1.00
assi (resi 27   and name HB# ) (resi 57   and name HB  )  4.00  4.00  1.80
assi (resi 27   and name HB# ) (resi 57   and name HD1#)  2.50  0.70  1.20

! residue 28   Asn , intraresidue NOEs
assi (resi 28   and name HN  ) (resi 28   and name HA  )  3.00  1.20  0.50
assi (resi 28   and name HN  ) (resi 28   and name HB# )  2.50  0.70  0.40
assi (resi 28   and name HN  ) (resi 28   and name HD2#)  4.00  4.00  1.00
assi (resi 28   and name HA  ) (resi 28   and name HB# )  3.00  1.20  0.30
assi (resi 28   and name HA  ) (resi 28   and name HD2#)  4.00  2.20  1.00
assi (resi 28   and name HB# ) (resi 28   and name HD2#)  4.00  2.20  1.00

! residue 28   Asn , NOEs forward in sequence
assi (resi 28   and name HN  ) (resi 29   and name HN  )  2.50  1.20  0.60
assi (resi 28   and name HA  ) (resi 29   and name HN  )  4.00  2.20  1.00
assi (resi 28   and name HB# ) (resi 29   and name HN  )  3.00  1.20  0.50
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  )  4.00  2.20  1.00
assi (resi 28   and name HA  ) (resi 31   and name HN  )  4.00  2.20  1.00
assi (resi 28   and name HA  ) (resi 31   and name HB# )  4.00  2.20  1.00
assi (resi 28   and name HA  ) (resi 31   and name HG  )  4.00  2.20  1.00
assi (resi 28   and name HA  ) (resi 31   and name HD* )  4.00  2.20  1.50
assi (resi 28   and name HA  ) (resi 41   and name HE# )  4.00  2.20  1.00
assi (resi 28   and name HD2#) (resi 41   and name HA  )  4.00  2.20  1.00
assi (resi 28   and name HD2#) (resi 41   and name HB# )  4.00  2.20  1.00
assi (resi 28   and name HN  ) (resi 44   and name HG2#)  4.00  2.20  1.50
assi (resi 28   and name HN  ) (resi 44   and name HD1#)  4.00  2.20  1.50
assi (resi 28   and name HB2 ) (resi 44   and name HG2#)  4.00  2.20  1.50
assi (resi 28   and name HD2#) (resi 44   and name HG2#)  4.00  4.00  1.50
assi (resi 28   and name HD2#) (resi 44   and name HB  )  4.00  2.20  1.00
assi (resi 28   and name HD2#) (resi 45   and name HN  )  4.00  2.20  1.00

! residue 29   Arg , intraresidue NOEs
assi (resi 29   and name HN  ) (resi 29   and name HA  )  2.50  0.70  0.40
assi (resi 29   and name HN  ) (resi 29   and name HG# )  4.00  2.20  1.00
assi (resi 29   and name HN  ) (resi 29   and name HB# )  2.50  0.70  0.40
assi (resi 29   and name HN  ) (resi 29   and name HD# )  4.00  2.20  1.00
assi (resi 29   and name HA  ) (resi 29   and name HG# )  4.00  2.20  1.00
assi (resi 29   and name HA  ) (resi 29   and name HB# )  2.50  0.70  0.20
assi (resi 29   and name HA  ) (resi 29   and name HD# )  4.00  2.20  1.00
assi (resi 29   and name HG# ) (resi 29   and name HB# )  2.50  0.70  0.20
assi (resi 29   and name HG# ) (resi 29   and name HD# )  3.00  1.20  0.30
assi (resi 29   and name HB# ) (resi 29   and name HD# )  4.00  2.20  1.00

! residue 29   Arg , NOEs forward in sequence
assi (resi 29   and name HN  ) (resi 30   and name HN  )  2.50  0.70  0.60
assi (resi 29   and name HA  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 29   and name HG# ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 29   and name HB# ) (resi 30   and name HN  )  3.00  1.20  0.50
assi (resi 29   and name HN  ) (resi 31   and name HN  )  4.00  2.20  1.00
assi (resi 29   and name HA  ) (resi 32   and name HN  )  3.00  1.20  0.50
assi (resi 29   and name HA  ) (resi 32   and name HB# )  3.00  1.20  0.30

! residue 30   Glu , intraresidue NOEs
assi (resi 30   and name HN  ) (resi 30   and name HA  )  2.50  0.70  0.40
assi (resi 30   and name HN  ) (resi 30   and name HG# )  4.00  2.20  1.00
assi (resi 30   and name HN  ) (resi 30   and name HB# )  2.50  0.70  0.40
assi (resi 30   and name HA  ) (resi 30   and name HG# )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 30   and name HB# )  2.50  0.70  0.20
assi (resi 30   and name HG# ) (resi 30   and name HB# )  2.50  0.70  0.20

! residue 30   Glu , NOEs forward in sequence
assi (resi 30   and name HN  ) (resi 31   and name HN  )  2.50  0.70  0.60
assi (resi 30   and name HA  ) (resi 31   and name HN  )  3.00  1.20  0.50
assi (resi 30   and name HB# ) (resi 31   and name HN  )  4.00  2.20  1.00
assi (resi 30   and name HB# ) (resi 31   and name HB# )  4.00  2.20  1.00
assi (resi 30   and name HB# ) (resi 31   and name HG  )  4.00  2.20  1.00
assi (resi 30   and name HG# ) (resi 31   and name HN  )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 33   and name HN  )  3.00  1.20  0.50
assi (resi 30   and name HA  ) (resi 33   and name HB# )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 33   and name HG# )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 33   and name HE# )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 33   and name HD# )  4.00  2.20  1.00
assi (resi 30   and name HG# ) (resi 34   and name HE# )  4.00  2.20  1.00
assi (resi 30   and name HB# ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 30   and name HB# ) (resi 34   and name HE# )  4.00  2.20  1.00
assi (resi 30   and name HG# ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 30   and name HG# ) (resi 57   and name HD1#)  4.00  2.20  1.50
assi (resi 30   and name HB# ) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 30   and name HB# ) (resi 57   and name HD1#)  4.00  2.20  1.50
assi (resi 30   and name HG# ) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 30   and name HG# ) (resi 61   and name HD* )  4.00  2.20  1.50
assi (resi 30   and name HB# ) (resi 61   and name HD* )  4.00  2.20  1.50

! residue 31   Leu , intraresidue NOEs
assi (resi 31   and name HN  ) (resi 31   and name HA  )  3.00  1.20  0.50
assi (resi 31   and name HN  ) (resi 31   and name HB# )  2.50  0.70  0.40
assi (resi 31   and name HN  ) (resi 31   and name HG  )  4.00  2.20  1.00
assi (resi 31   and name HN  ) (resi 31   and name HD*)  4.00  2.20  1.50
assi (resi 31   and name HA  ) (resi 31   and name HB# )  3.00  1.20  0.30
assi (resi 31   and name HA  ) (resi 31   and name HG  )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 31   and name HD* )  4.00  2.20  1.50
assi (resi 31   and name HB# ) (resi 31   and name HD* )  3.00  1.20  0.80

! residue 31   Leu , NOEs forward in sequence
assi (resi 31   and name HB# ) (resi 32   and name HN  )  3.00  1.20  0.50
assi (resi 31   and name HB# ) (resi 32   and name HB# )  4.00  2.20  1.00
assi (resi 31   and name HG  ) (resi 32   and name HB# )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 34   and name HN  )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 34   and name HB# )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 34   and name HE# )  4.00  2.20  1.00
assi (resi 31   and name HD* ) (resi 34   and name HB# )  4.00  2.20  1.50
assi (resi 31   and name HD* ) (resi 34   and name HD# )  4.00  2.20  1.50
assi (resi 31   and name HA  ) (resi 35   and name HN  )  4.00  2.20  1.00
assi (resi 31   and name HB# ) (resi 36   and name HG* )  4.00  2.20  1.50
assi (resi 31   and name HB# ) (resi 36   and name HB  )  4.00  2.20  1.00
assi (resi 31   and name HD* ) (resi 36   and name HA  )  4.00  2.20  1.50
assi (resi 31   and name HD* ) (resi 36   and name HB  )  4.00  2.20  1.50
assi (resi 31   and name HB# ) (resi 40   and name HB# )  4.00  2.20  1.00
assi (resi 31   and name HD*) (resi 40   and name HB# )  4.00  2.20  1.50
assi (resi 31   and name HD*) (resi 40   and name HD# )  4.00  2.20  1.50
assi (resi 31   and name HD* ) (resi 40   and name HN  )  4.00  2.20  1.50
assi (resi 31   and name HD* ) (resi 41   and name HN  )  4.00  2.20  1.50
assi (resi 31   and name HD* ) (resi 57   and name HA  )  4.00  2.20  1.50
assi (resi 31   and name HA  ) (resi 60   and name HG2#)  4.00  2.20  1.50
assi (resi 31   and name HD* ) (resi 60   and name HG1#)  4.00  2.20  1.50
assi (resi 31   and name HA  ) (resi 61   and name HD*)  4.00  4.00  1.50
assi (resi 31   and name HD* ) (resi 61   and name HD* )  2.50  0.70  1.20

! residue 32   Asp , intraresidue NOEs
assi (resi 32   and name HN  ) (resi 32   and name HA  )  3.00  1.20  0.50
assi (resi 32   and name HN  ) (resi 32   and name HB# )  2.50  0.70  0.40
assi (resi 32   and name HA  ) (resi 32   and name HB# )  3.00  1.20  0.30

! residue 32   Asp , NOEs forward in sequence
assi (resi 32   and name HN  ) (resi 33   and name HN  )  3.00  1.20  0.70
assi (resi 32   and name HA  ) (resi 33   and name HN  )  4.00  2.20  1.00
assi (resi 32   and name HB# ) (resi 33   and name HN  )  4.00  2.20  1.00
assi (resi 32   and name HB# ) (resi 33   and name HA  )  4.00  2.20  1.00
assi (resi 32   and name HN  ) (resi 34   and name HN  )  4.00  2.20  1.00
assi (resi 32   and name HA  ) (resi 35   and name HN  )  4.00  2.20  1.00
assi (resi 32   and name HA  ) (resi 35   and name HA# )  4.00  2.20  1.00

! residue 33   Lys , intraresidue NOEs
assi (resi 33   and name HN  ) (resi 33   and name HA  )  3.00  1.20  0.50
assi (resi 33   and name HN  ) (resi 33   and name HB# )  3.00  1.20  0.50
assi (resi 33   and name HN  ) (resi 33   and name HG# )  4.00  2.20  1.00
assi (resi 33   and name HN  ) (resi 33   and name HD# )  4.00  2.20  1.00
assi (resi 33   and name HA  ) (resi 33   and name HG# )  4.00  2.20  1.00
assi (resi 33   and name HA  ) (resi 33   and name HE# )  4.00  2.20  1.00
assi (resi 33   and name HA  ) (resi 33   and name HD# )  4.00  2.20  1.00
assi (resi 33   and name HB# ) (resi 33   and name HE# )  4.00  2.20  1.00
assi (resi 33   and name HG# ) (resi 33   and name HE# )  4.00  2.20  1.00
assi (resi 33   and name HG# ) (resi 33   and name HD# )  2.50  0.70  0.20

! residue 33   Lys , NOEs forward in sequence
assi (resi 33   and name HN  ) (resi 34   and name HN  )  3.00  1.20  0.70
assi (resi 33   and name HA  ) (resi 34   and name HN  )  4.00  2.20  1.00
assi (resi 33   and name HB# ) (resi 34   and name HN  )  4.00  2.20  1.00
assi (resi 33   and name HB# ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 33   and name HB# ) (resi 34   and name HE# )  4.00  2.20  1.00
assi (resi 33   and name HE# ) (resi 34   and name HE# )  4.00  2.20  1.00
assi (resi 33   and name HG# ) (resi 34   and name HN  )  4.00  2.20  1.00
assi (resi 33   and name HD# ) (resi 34   and name HE# )  4.00  2.20  1.00

! residue 34   Tyr , intraresidue NOEs
assi (resi 34   and name HN  ) (resi 34   and name HA  )  3.00  1.20  0.50
assi (resi 34   and name HN  ) (resi 34   and name HB# )  3.00  1.20  0.50
assi (resi 34   and name HN  ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 34   and name HA  ) (resi 34   and name HB# )  3.00  1.20  0.30
assi (resi 34   and name HA  ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 34   and name HB# ) (resi 34   and name HD# )  4.00  2.20  1.00
assi (resi 34   and name HB# ) (resi 34   and name HE# )  4.00  2.20  1.00

! residue 34   Tyr , NOEs forward in sequence
assi (resi 34   and name HN  ) (resi 35   and name HN  )  2.50  0.70  0.60
assi (resi 34   and name HB# ) (resi 35   and name HN  )  4.00  2.20  1.00
assi (resi 34   and name HD# ) (resi 35   and name HN  )  4.00  2.20  1.00
assi (resi 34   and name HN  ) (resi 36   and name HG* )  4.00  2.20  1.50
assi (resi 34   and name HA  ) (resi 36   and name HN  )  4.00  2.20  1.00
assi (resi 34   and name HB# ) (resi 36   and name HG# )  4.00  2.20  1.50
assi (resi 34   and name HB# ) (resi 36   and name HN  )  4.00  2.20  1.00
assi (resi 34   and name HD# ) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 34   and name HD# ) (resi 61   and name HD*)  4.00  2.20  1.50
assi (resi 34   and name HE# ) (resi 61   and name HD*)  4.00  2.20  1.50
assi (resi 34   and name HB# ) (resi 64   and name HD*)  4.00  2.20  1.50

! residue 35   Gly , intraresidue NOEs
assi (resi 35   and name HN  ) (resi 35   and name HA# )  2.50  0.70  0.40

! residue 35   Gly , NOEs forward in sequence
assi (resi 35   and name HN  ) (resi 36   and name HN  )  4.00  2.20  1.00
assi (resi 35   and name HN  ) (resi 36   and name HG* )  4.00  2.20  1.50
assi (resi 35   and name HA# ) (resi 36   and name HN  )  4.00  2.20  1.00
assi (resi 35   and name HA# ) (resi 36   and name HG* )  4.00  2.20  1.50

! residue 36   Val , intraresidue NOEs
assi (resi 36   and name HN  ) (resi 36   and name HB  )  3.00  1.20  0.50
assi (resi 36   and name HN  ) (resi 36   and name HG*)  3.00  1.20  1.00
assi (resi 36   and name HA  ) (resi 36   and name HB  )  3.00  1.20  0.30
assi (resi 36   and name HA  ) (resi 36   and name HG*)  3.00  1.20  0.80

! residue 36   Val , NOEs forward in sequence
assi (resi 36   and name HN  ) (resi 37   and name HN  )  4.00  2.20  1.00
assi (resi 36   and name HA  ) (resi 37   and name HN  )  2.50  0.70  0.40
assi (resi 36   and name HB  ) (resi 37   and name HN  )  4.00  2.20  1.00
assi (resi 36   and name HG*) (resi 37   and name HN  )  4.00  4.00  1.50
assi (resi 36   and name HA  ) (resi 40   and name HD# )  4.00  2.20  1.00
assi (resi 36   and name HB  ) (resi 40   and name HB# )  4.00  2.20  1.00
assi (resi 36   and name HB  ) (resi 40   and name HD# )  4.00  2.20  1.00
assi (resi 36   and name HB  ) (resi 40   and name HE# )  4.00  2.20  1.00
assi (resi 36   and name HG*) (resi 40   and name HB# )  4.00  2.20  1.50
assi (resi 36   and name HG*) (resi 40   and name HD# )  4.00  2.20  1.50
assi (resi 36   and name HG*) (resi 40   and name HE# )  4.00  2.20  1.50
assi (resi 36   and name HG* ) (resi 40   and name HN  )  4.00  2.20  1.50
assi (resi 36   and name HG*) (resi 60   and name HG2#)  4.00  2.20  1.50
assi (resi 36   and name HG* ) (resi 61   and name HD* )  4.00  2.20  2.00
assi (resi 36   and name HG*) (resi 64   and name HG  )  4.00  2.20  1.50
assi (resi 36   and name HG* ) (resi 64   and name HD* )  4.00  2.20  2.00

! residue 37   Ser , intraresidue NOEs
assi (resi 37   and name HN  ) (resi 37   and name HB# )  4.00  2.20  1.00
assi (resi 37   and name HA  ) (resi 37   and name HB# )  3.00  1.20  0.30

! residue 37   Ser , NOEs forward in sequence
assi (resi 37   and name HA  ) (resi 38   and name HN  )  4.00  2.20  1.00
assi (resi 37   and name HB# ) (resi 38   and name HN  )  4.00  2.20  1.00
assi (resi 37   and name HN  ) (resi 40   and name HD# )  4.00  2.20  1.00

! residue 38   Asp , intraresidue NOEs
assi (resi 38   and name HN  ) (resi 38   and name HB# )  4.00  2.20  1.00
assi (resi 38   and name HA  ) (resi 38   and name HB# )  2.50  0.70  0.20

! residue 38   Asp , NOEs forward in sequence
assi (resi 38   and name HA  ) (resi 40   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HA  ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HA  ) (resi 41   and name HB# )  3.00  1.20  0.30
assi (resi 38   and name HA  ) (resi 41   and name HG# )  4.00  2.20  1.00
assi (resi 38   and name HA  ) (resi 41   and name HD# )  4.00  2.20  1.00
assi (resi 38   and name HA  ) (resi 41   and name HE# )  4.00  2.20  1.00
assi (resi 38   and name HB# ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HB# ) (resi 41   and name HB# )  4.00  2.20  1.00
assi (resi 38   and name HB# ) (resi 41   and name HD# )  4.00  2.20  1.00

! residue 39   Tyr , intraresidue NOEs
assi (resi 39   and name HA  ) (resi 39   and name HB# )  2.50  0.70  0.20
assi (resi 39   and name HA  ) (resi 39   and name HD# )  4.00  2.20  1.00
assi (resi 39   and name HA  ) (resi 39   and name HE# )  4.00  2.20  1.00
assi (resi 39   and name HB# ) (resi 39   and name HD# )  4.00  2.20  1.00
assi (resi 39   and name HB# ) (resi 39   and name HE# )  4.00  2.20  1.00

! residue 39   Tyr , NOEs forward in sequence
assi (resi 39   and name HB# ) (resi 40   and name HN  )  4.00  2.20  1.00
assi (resi 39   and name HD# ) (resi 40   and name HN  )  4.00  2.20  1.00
assi (resi 39   and name HD# ) (resi 40   and name HE# )  4.00  2.20  1.00
assi (resi 39   and name HE# ) (resi 40   and name HN  )  4.00  2.20  1.00
assi (resi 39   and name HE# ) (resi 40   and name HD# )  4.00  2.20  1.00
assi (resi 39   and name HE# ) (resi 40   and name HE# )  4.00  2.20  1.00
assi (resi 39   and name HA  ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 39   and name HA  ) (resi 42   and name HB# )  4.00  2.20  1.00
assi (resi 39   and name HD# ) (resi 43   and name HD* )  4.00  2.20  1.50
assi (resi 39   and name HE# ) (resi 43   and name HD*)  4.00  2.20  1.50

! residue 40   Tyr , intraresidue NOEs
assi (resi 40   and name HN  ) (resi 40   and name HA  )  3.00  1.20  0.50
assi (resi 40   and name HN  ) (resi 40   and name HB# )  3.00  1.20  0.50
assi (resi 40   and name HA  ) (resi 40   and name HB# )  3.00  1.20  0.30
assi (resi 40   and name HA  ) (resi 40   and name HD# )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 40   and name HE# )  4.00  2.20  1.00
assi (resi 40   and name HB# ) (resi 40   and name HD# )  4.00  2.20  1.00
assi (resi 40   and name HB# ) (resi 40   and name HE# )  4.00  2.20  1.00

! residue 40   Tyr , NOEs forward in sequence
assi (resi 40   and name HN  ) (resi 41   and name HN  )  3.00  1.20  0.70
assi (resi 40   and name HN  ) (resi 41   and name HB# )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HB# ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 43   and name HB# )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 43   and name HB# )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 43   and name HG  )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 43   and name HD*)  4.00  2.20  1.50
assi (resi 40   and name HE# ) (resi 43   and name HD*)  4.00  2.20  1.50
assi (resi 40   and name HD# ) (resi 56   and name HD* )  4.00  2.20  1.50
assi (resi 40   and name HE# ) (resi 56   and name HD* )  4.00  2.20  1.50
assi (resi 40   and name HA  ) (resi 60   and name HD1#)  4.00  2.20  1.50
assi (resi 40   and name HB# ) (resi 60   and name HG2#)  4.00  2.20  1.50
assi (resi 40   and name HB# ) (resi 60   and name HD1#)  4.00  2.20  1.50
assi (resi 40   and name HD# ) (resi 60   and name HG1#)  4.00  2.20  1.00
assi (resi 40   and name HD# ) (resi 60   and name HG2#)  4.00  2.20  1.50
assi (resi 40   and name HD# ) (resi 60   and name HD1#)  4.00  2.20  1.50
assi (resi 40   and name HE# ) (resi 60   and name HG2#)  4.00  2.20  1.50
assi (resi 40   and name HE# ) (resi 60   and name HD1#)  4.00  2.20  1.50

! residue 41   Lys , intraresidue NOEs
assi (resi 41   and name HN  ) (resi 41   and name HA  )  3.00  1.20  0.50
assi (resi 41   and name HN  ) (resi 41   and name HB# )  3.00  1.20  0.50
assi (resi 41   and name HN  ) (resi 41   and name HG# )  2.50  0.70  0.40
assi (resi 41   and name HN  ) (resi 41   and name HD# )  4.00  2.20  1.00
assi (resi 41   and name HN  ) (resi 41   and name HE# )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 41   and name HG# )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 41   and name HB# )  3.00  1.20  0.30
assi (resi 41   and name HA  ) (resi 41   and name HD# )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 41   and name HE# )  4.00  2.20  1.00
assi (resi 41   and name HG# ) (resi 41   and name HE# )  4.00  2.20  1.00
assi (resi 41   and name HB# ) (resi 41   and name HG# )  2.50  0.70  0.20
assi (resi 41   and name HB# ) (resi 41   and name HD# )  3.00  1.20  0.30
assi (resi 41   and name HB# ) (resi 41   and name HE# )  4.00  2.20  1.00
assi (resi 41   and name HG# ) (resi 41   and name HD# )  2.50  0.70  0.20

! residue 41   Lys , NOEs forward in sequence
assi (resi 41   and name HN  ) (resi 42   and name HN  )  3.00  1.20  0.70
assi (resi 41   and name HN  ) (resi 42   and name HA  )  4.00  2.20  1.00
assi (resi 41   and name HN  ) (resi 42   and name HB# )  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 HB# ) (resi 42   and name HA  )  4.00  2.20  1.00
assi (resi 41   and name HG# ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HD# ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HE# ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 44   and name HN  )  3.00  1.20  0.50
assi (resi 41   and name HA  ) (resi 44   and name HB  )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 44   and name HG1#)  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 44   and name HG2#)  4.00  2.20  1.50
assi (resi 41   and name HA  ) (resi 44   and name HD1#)  4.00  2.20  1.50
assi (resi 41   and name HB# ) (resi 44   and name HG2#)  4.00  2.20  1.50
assi (resi 41   and name HA  ) (resi 57   and name HD1#)  4.00  2.20  1.50

! residue 42   Asn , intraresidue NOEs
assi (resi 42   and name HN  ) (resi 42   and name HA  )  3.00  1.20  0.50
assi (resi 42   and name HN  ) (resi 42   and name HB# )  4.00  2.20  1.00
assi (resi 42   and name HA  ) (resi 42   and name HB# )  3.00  1.20  0.30
assi (resi 42   and name HB# ) (resi 42   and name HD2#)  4.00  2.20  1.00

! residue 42   Asn , NOEs forward in sequence
assi (resi 42   and name HN  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 42   and name HA  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 42   and name HB# ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 42   and name HB# ) (resi 43   and name HB# )  4.00  2.20  1.00
assi (resi 42   and name HA  ) (resi 44   and name HB  )  4.00  2.20  1.00
assi (resi 42   and name HA  ) (resi 45   and name HD2#)  4.00  2.20  1.00
assi (resi 42   and name HA  ) (resi 45   and name HB# )  2.50  0.70  0.20

! residue 43   Leu , intraresidue NOEs
assi (resi 43   and name HN  ) (resi 43   and name HA  )  3.00  1.20  0.50
assi (resi 43   and name HN  ) (resi 43   and name HB# )  2.50  0.70  0.40
assi (resi 43   and name HN  ) (resi 43   and name HG  )  4.00  2.20  1.00
assi (resi 43   and name HN  ) (resi 43   and name HD* )  4.00  2.20  1.50
assi (resi 43   and name HA  ) (resi 43   and name HB# )  3.00  1.20  0.30
assi (resi 43   and name HA  ) (resi 43   and name HG  )  3.00  1.20  0.30
assi (resi 43   and name HA  ) (resi 43   and name HD*)  2.50  0.70  0.20
assi (resi 43   and name HB# ) (resi 43   and name HD* )  2.50  0.70  0.70
assi (resi 43   and name HB# ) (resi 43   and name HG  )  2.50  0.70  0.20

! residue 43   Leu , NOEs forward in sequence
assi (resi 43   and name HN  ) (resi 44   and name HN  )  2.50  0.70  0.60
assi (resi 43   and name HN  ) (resi 44   and name HB  )  4.00  2.20  1.00
assi (resi 43   and name HA  ) (resi 44   and name HN  )  4.00  2.20  1.00
assi (resi 43   and name HB# ) (resi 44   and name HN  )  3.00  1.20  0.50
assi (resi 43   and name HB# ) (resi 44   and name HA  )  4.00  2.20  1.00
assi (resi 43   and name HD* ) (resi 44   and name HN  )  4.00  2.20  1.50
assi (resi 43   and name HB# ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 43   and name HA  ) (resi 46   and name HN  )  4.00  2.20  1.00
assi (resi 43   and name HA  ) (resi 46   and name HB# )  4.00  2.20  1.00

! residue 44   Ile , intraresidue NOEs
assi (resi 44   and name HN  ) (resi 44   and name HA  )  3.00  1.20  0.50
assi (resi 44   and name HN  ) (resi 44   and name HB  )  2.50  0.70  0.40
assi (resi 44   and name HN  ) (resi 44   and name HG1#)  4.00  2.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HG2#)  3.00  1.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HD1#)  4.00  2.20  1.50
assi (resi 44   and name HA  ) (resi 44   and name HG1#)  4.00  2.20  1.00
assi (resi 44   and name HA  ) (resi 44   and name HG2#)  3.00  1.20  0.80
assi (resi 44   and name HA  ) (resi 44   and name HD1#)  3.00  1.20  0.80
assi (resi 44   and name HB  ) (resi 44   and name HD1#)  4.00  2.20  1.50
assi (resi 44   and name HG1#) (resi 44   and name HG2#)  3.00  1.20  0.80
assi (resi 44   and name HG1#) (resi 44   and name HG2#)  3.00  1.20  0.80
assi (resi 44   and name HG2#) (resi 44   and name HD1#)  2.50  0.70  1.20

! residue 44   Ile , NOEs forward in sequence
assi (resi 44   and name HN  ) (resi 45   and name HN  )  2.50  0.70  0.60
assi (resi 44   and name HA  ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 44   and name HB  ) (resi 45   and name HN  )  3.00  1.20  0.50
assi (resi 44   and name HG2#) (resi 45   and name HN  )  4.00  2.20  1.50
assi (resi 44   and name HG2#) (resi 45   and name HA  )  4.00  2.20  1.50
assi (resi 44   and name HG2#) (resi 45   and name HB# )  4.00  2.20  1.50
assi (resi 44   and name HA  ) (resi 46   and name HN  )  4.00  2.20  1.00
assi (resi 44   and name HA  ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 44   and name HA  ) (resi 53   and name HG2#)  4.00  2.20  1.50
assi (resi 44   and name HG2#) (resi 53   and name HG2#)  2.50  0.70  1.20
assi (resi 44   and name HD1#) (resi 53   and name HA  )  4.00  2.20  1.50
assi (resi 44   and name HA  ) (resi 56   and name HD* )  3.00  1.20  0.80
assi (resi 44   and name HD1#) (resi 56   and name HB# )  3.00  1.20  0.80
assi (resi 44   and name HB  ) (resi 57   and name HD1#)  4.00  2.20  1.50
assi (resi 44   and name HG2#) (resi 57   and name HG1#)  4.00  2.20  1.50
assi (resi 44   and name HD1#) (resi 57   and name HN  )  4.00  2.20  1.50
assi (resi 44   and name HD1#) (resi 57   and name HG1#)  4.00  2.20  1.50
assi (resi 44   and name HD1#) (resi 60   and name HG1#)  4.00  2.20  1.50

! residue 45   Asn , intraresidue NOEs
assi (resi 45   and name HN  ) (resi 45   and name HA  )  3.00  1.20  0.50
assi (resi 45   and name HN  ) (resi 45   and name HB# )  2.50  0.70  0.40
assi (resi 45   and name HN  ) (resi 45   and name HD2#)  4.00  2.20  1.00
assi (resi 45   and name HA  ) (resi 45   and name HB# )  2.50  0.70  0.20
assi (resi 45   and name HD2#) (resi 45   and name HB# )  3.00  1.20  0.30

! residue 45   Asn , NOEs forward in sequence
assi (resi 45   and name HN  ) (resi 46   and name HN  )  3.00  1.20  0.70
assi (resi 45   and name HA  ) (resi 46   and name HN  )  4.00  2.20  1.00
assi (resi 45   and name HB# ) (resi 46   and name HN  )  3.00  1.20  0.50
assi (resi 45   and name HA  ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 45   and name HB# ) (resi 47   and name HN  )  4.00  2.20  1.00

! residue 46   Asn , intraresidue NOEs
assi (resi 46   and name HN  ) (resi 46   and name HB# )  2.50  0.70  0.40
assi (resi 46   and name HB# ) (resi 46   and name HD2#)  4.00  2.20  1.00

! residue 46   Asn , NOEs forward in sequence
assi (resi 46   and name HN  ) (resi 47   and name HN  )  2.50  0.70  0.60
assi (resi 46   and name HN  ) (resi 47   and name HB# )  4.00  2.20  1.50
assi (resi 46   and name HA  ) (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  1.00
assi (resi 46   and name HN  ) (resi 56   and name HD* )  4.00  2.20  1.50

! residue 47   Ala , intraresidue NOEs
assi (resi 47   and name HN  ) (resi 47   and name HA  )  3.00  1.20  0.50
assi (resi 47   and name HN  ) (resi 47   and name HB# )  2.50  0.70  0.70

! residue 47   Ala , NOEs forward in sequence
assi (resi 47   and name HA  ) (resi 49   and name HN  )  4.00  2.20  1.00
assi (resi 47   and name HB# ) (resi 49   and name HN  )  3.00  1.20  1.00
assi (resi 47   and name HA  ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 47   and name HB# ) (resi 53   and name HN  )  4.00  2.20  1.50
assi (resi 47   and name HB# ) (resi 53   and name HA  )  3.00  1.20  0.80
assi (resi 47   and name HB# ) (resi 53   and name HG*)  2.50  0.70  1.20

! residue 48   Lys , intraresidue NOEs
assi (resi 48   and name HA  ) (resi 48   and name HB# )  3.00  1.20  0.30
assi (resi 48   and name HA  ) (resi 48   and name HG# )  4.00  2.20  1.00
assi (resi 48   and name HA  ) (resi 48   and name HD# )  4.00  2.20  1.00
assi (resi 48   and name HG# ) (resi 48   and name HE# )  4.00  2.20  1.00
assi (resi 48   and name HB# ) (resi 48   and name HD# )  3.00  1.20  0.30

! residue 48   Lys , NOEs forward in sequence
assi (resi 48   and name HA  ) (resi 49   and name HN  )  4.00  2.20  1.00
assi (resi 48   and name HA  ) (resi 49   and name HG2#)  4.00  2.20  1.50
assi (resi 48   and name HB# ) (resi 49   and name HN  )  4.00  2.20  1.00
assi (resi 48   and name HB# ) (resi 49   and name HG2#)  4.00  2.20  1.50

! residue 49   Thr , intraresidue NOEs
assi (resi 49   and name HN  ) (resi 49   and name HG2#)  4.00  2.20  1.50
assi (resi 49   and name HA  ) (resi 49   and name HG2#)  3.00  1.20  0.80

! residue 49   Thr , NOEs forward in sequence
assi (resi 49   and name HA  ) (resi 50   and name HN  )  3.00  1.20  0.50
assi (resi 49   and name HB  ) (resi 50   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HG2#) (resi 50   and name HN  )  4.00  2.20  1.50
assi (resi 49   and name HB  ) (resi 51   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HG2#) (resi 51   and name HN  )  4.00  2.20  1.50
assi (resi 49   and name HN  ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HN  ) (resi 52   and name HA# )  4.00  2.20  1.00
assi (resi 49   and name HB  ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HG2#) (resi 52   and name HN  )  4.00  2.20  1.50
assi (resi 49   and name HG2#) (resi 52   and name HA# )  4.00  2.20  1.50
assi (resi 49   and name HN  ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 49   and name HG2#) (resi 53   and name HG*)  4.00  2.20  1.50

! residue 50   Val , intraresidue NOEs
assi (resi 50   and name HN  ) (resi 50   and name HB  )  4.00  2.20  1.00
assi (resi 50   and name HN  ) (resi 50   and name HG*)  4.00  2.20  1.50
assi (resi 50   and name HA  ) (resi 50   and name HG* )  2.50  0.70  0.70

! residue 50   Val , NOEs forward in sequence
assi (resi 50   and name HN  ) (resi 51   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HA  ) (resi 51   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HB  ) (resi 51   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HG*) (resi 51   and name HN  )  4.00  2.20  1.50
assi (resi 50   and name HG* ) (resi 51   and name HA  )  4.00  2.20  1.50
assi (resi 50   and name HA  ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HA  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HA  ) (resi 53   and name HB  )  4.00  2.20  1.00
assi (resi 50   and name HA  ) (resi 53   and name HG*)  2.50  0.70  0.70
assi (resi 50   and name HB  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HG* ) (resi 54   and name HN  )  4.00  2.20  1.50
assi (resi 50   and name HG* ) (resi 54   and name HG# )  4.00  2.20  1.50
assi (resi 50   and name HG* ) (resi 54   and name HE# )  4.00  2.20  1.50

! residue 51   Glu , intraresidue NOEs
assi (resi 51   and name HN  ) (resi 51   and name HB# )  3.00  1.20  0.50
assi (resi 51   and name HN  ) (resi 51   and name HG# )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 51   and name HB# )  3.00  1.20  0.30
assi (resi 51   and name HA  ) (resi 51   and name HG# )  4.00  2.20  1.00
assi (resi 51   and name HB# ) (resi 51   and name HG# )  3.00  1.20  0.30
assi (resi 51   and name HB# ) (resi 51   and name HG# )  2.50  0.70  1.20

! residue 51   Glu , 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 HA# )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 52   and name HN  )  3.00  1.20  0.50
assi (resi 51   and name HB# ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HB# ) (resi 52   and name HA# )  4.00  2.20  1.00
assi (resi 51   and name HG# ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HN  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 54   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 54   and name HB# )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 54   and name HD# )  4.00  2.20  2.00
assi (resi 51   and name HA  ) (resi 55   and name HN  )  4.00  2.20  1.00

! residue 52   Gly , intraresidue NOEs
assi (resi 52   and name HN  ) (resi 52   and name HA# )  2.50  0.70  0.20

! residue 52   Gly , NOEs forward in sequence
assi (resi 52   and name HN  ) (resi 53   and name HN  )  3.00  1.20  0.70
assi (resi 52   and name HN  ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 52   and name HA# ) (resi 53   and name HN  )  3.00  1.20  0.50
assi (resi 52   and name HA# ) (resi 53   and name HB  )  4.00  2.20  1.00
assi (resi 52   and name HA# ) (resi 53   and name HG*)  4.00  2.20  1.50
assi (resi 52   and name HN  ) (resi 55   and name HB# )  4.00  2.20  1.50
assi (resi 52   and name HA# ) (resi 55   and name HN  )  4.00  2.20  1.00
assi (resi 52   and name HA# ) (resi 55   and name HB# )  3.00  1.20  0.80
assi (resi 52   and name HA# ) (resi 56   and name HN  )  4.00  2.20  1.00

! residue 53   Val , intraresidue NOEs
assi (resi 53   and name HN  ) (resi 53   and name HA  )  3.00  1.20  0.50
assi (resi 53   and name HN  ) (resi 53   and name HB  )  2.50  0.70  0.40
assi (resi 53   and name HN  ) (resi 53   and name HG*)  2.50  0.70  0.70
assi (resi 53   and name HA  ) (resi 53   and name HB  )  3.00  1.20  0.30
assi (resi 53   and name HA  ) (resi 53   and name HG*)  2.50  0.70  0.70

! residue 53   Val , NOEs forward in sequence
assi (resi 53   and name HN  ) (resi 54   and name HN  )  3.00  1.20  0.70
assi (resi 53   and name HA  ) (resi 54   and name HN  )  4.00  2.20  1.00
assi (resi 53   and name HB  ) (resi 54   and name HN  )  3.00  1.20  0.50
assi (resi 53   and name HG*) (resi 54   and name HN  )  4.00  2.20  1.50
assi (resi 53   and name HG*) (resi 54   and name HA  )  4.00  2.20  1.50
assi (resi 53   and name HA  ) (resi 56   and name HN  )  4.00  2.20  1.00
assi (resi 53   and name HA  ) (resi 56   and name HB# )  4.00  2.20  1.00
assi (resi 53   and name HA  ) (resi 56   and name HD*)  4.00  2.20  1.50
assi (resi 53   and name HA  ) (resi 57   and name HN  )  4.00  2.20  1.00

! residue 54   Lys , intraresidue NOEs
assi (resi 54   and name HN  ) (resi 54   and name HA  )  3.00  1.20  0.50
assi (resi 54   and name HN  ) (resi 54   and name HB# )  3.00  1.20  0.50
assi (resi 54   and name HN  ) (resi 54   and name HG# )  4.00  2.20  1.00
assi (resi 54   and name HA  ) (resi 54   and name HB# )  3.00  1.20  0.30
assi (resi 54   and name HA  ) (resi 54   and name HG# )  4.00  2.20  1.00
assi (resi 54   and name HG# ) (resi 54   and name HB# )  3.00  1.20  0.30
assi (resi 54   and name HG# ) (resi 54   and name HE# )  4.00  2.20  1.00
assi (resi 54   and name HB# ) (resi 54   and name HE# )  4.00  2.20  1.00

! residue 54   Lys , NOEs forward in sequence
assi (resi 54   and name HN  ) (resi 55   and name HN  )  2.50  0.70  0.60
assi (resi 54   and name HA  ) (resi 55   and name HN  )  4.00  2.20  1.00
assi (resi 54   and name HB# ) (resi 55   and name HN  )  3.00  1.20  0.50
assi (resi 54   and name HA  ) (resi 57   and name HN  )  4.00  2.20  1.00
assi (resi 54   and name HA  ) (resi 57   and name HB  )  4.00  2.20  1.00
assi (resi 54   and name HA  ) (resi 57   and name HG1#)  4.00  2.20  1.00
assi (resi 54   and name HA  ) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 54   and name HA  ) (resi 57   and name HD1#)  4.00  2.20  1.50

! residue 55   Ala , intraresidue NOEs
assi (resi 55   and name HN  ) (resi 55   and name HA  )  2.50  0.70  0.40
assi (resi 55   and name HN  ) (resi 55   and name HB# )  2.50  0.70  0.20

! residue 55   Ala , NOEs forward in sequence
assi (resi 55   and name HN  ) (resi 56   and name HN  )  2.50  0.70  0.60
assi (resi 55   and name HA  ) (resi 56   and name HN  )  4.00  2.20  1.00
assi (resi 55   and name HB# ) (resi 56   and name HN  )  2.50  0.70  0.70
assi (resi 55   and name HB# ) (resi 56   and name HA  )  4.00  2.20  1.50
assi (resi 55   and name HB# ) (resi 56   and name HB# )  4.00  2.20  1.50
assi (resi 55   and name HA  ) (resi 58   and name HN  )  4.00  2.20  1.00
assi (resi 55   and name HA  ) (resi 58   and name HB# )  4.00  2.20  1.00
assi (resi 55   and name HA  ) (resi 59   and name HG# )  4.00  2.20  1.00

! residue 56   Leu , intraresidue NOEs
assi (resi 56   and name HN  ) (resi 56   and name HA  )  2.50  0.70  0.40
assi (resi 56   and name HN  ) (resi 56   and name HB# )  2.50  0.70  0.40
assi (resi 56   and name HN  ) (resi 56   and name HG  )  4.00  2.20  1.00
assi (resi 56   and name HN  ) (resi 56   and name HD*)  3.00  1.20  0.80
assi (resi 56   and name HA  ) (resi 56   and name HB# )  3.00  1.20  0.30
assi (resi 56   and name HA  ) (resi 56   and name HG  )  4.00  2.20  1.00
assi (resi 56   and name HA  ) (resi 56   and name HD* )  4.00  2.20  1.50
assi (resi 56   and name HB# ) (resi 56   and name HG  )  3.00  1.20  0.30
assi (resi 56   and name HB# ) (resi 56   and name HD*)  3.00  1.20  0.80
assi (resi 56   and name HB# ) (resi 56   and name HG  )  3.00  1.20  0.30
assi (resi 56   and name HB# ) (resi 56   and name HD* )  4.00  2.20  1.50

! residue 56   Leu , NOEs forward in sequence
assi (resi 56   and name HN  ) (resi 57   and name HN  )  3.00  1.20  0.70
assi (resi 56   and name HA  ) (resi 57   and name HN  )  4.00  2.20  1.00
assi (resi 56   and name HB# ) (resi 57   and name HN  )  4.00  2.20  1.00
assi (resi 56   and name HN  ) (resi 58   and name HN  )  3.00  1.20  0.70
assi (resi 56   and name HA  ) (resi 59   and name HB# )  4.00  2.20  1.00
assi (resi 56   and name HA  ) (resi 59   and name HG# )  4.00  2.20  1.00
assi (resi 56   and name HB# ) (resi 59   and name HB# )  4.00  2.20  1.00
assi (resi 56   and name HD* ) (resi 59   and name HB# )  4.00  2.20  1.50
assi (resi 56   and name HN  ) (resi 60   and name HD1#)  4.00  2.20  1.50
assi (resi 56   and name HA  ) (resi 60   and name HN  )  4.00  2.20  1.00
assi (resi 56   and name HB# ) (resi 60   and name HD1#)  4.00  2.20  1.50

! residue 57   Ile , intraresidue NOEs
assi (resi 57   and name HN  ) (resi 57   and name HA  )  3.00  1.20  0.50
assi (resi 57   and name HN  ) (resi 57   and name HB  )  2.50  0.70  0.40
assi (resi 57   and name HN  ) (resi 57   and name HG1#)  4.00  2.20  1.00
assi (resi 57   and name HN  ) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 57   and name HN  ) (resi 57   and name HD1#)  4.00  2.20  1.50
assi (resi 57   and name HA  ) (resi 57   and name HG1#)  4.00  2.20  1.00
assi (resi 57   and name HA  ) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 57   and name HA  ) (resi 57   and name HD1#)  3.00  1.20  0.80
assi (resi 57   and name HB  ) (resi 57   and name HD1#)  4.00  2.20  1.50
assi (resi 57   and name HG1#) (resi 57   and name HG2#)  4.00  2.20  1.50
assi (resi 57   and name HG2#) (resi 57   and name HD1#)  2.50  0.70  1.20

! residue 57   Ile , NOEs forward in sequence
assi (resi 57   and name HN  ) (resi 58   and name HN  )  2.50  0.70  0.60
assi (resi 57   and name HA  ) (resi 58   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HB  ) (resi 58   and name HN  )  2.50  0.70  0.40
assi (resi 57   and name HG2#) (resi 58   and name HN  )  4.00  2.20  1.50
assi (resi 57   and name HG2#) (resi 58   and name HA  )  4.00  2.20  1.50
assi (resi 57   and name HA  ) (resi 59   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HB  ) (resi 59   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HN  ) (resi 60   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HA  ) (resi 60   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HA  ) (resi 60   and name HB  )  3.00  1.20  0.30
assi (resi 57   and name HA  ) (resi 60   and name HG2#)  4.00  2.20  1.50
assi (resi 57   and name HA  ) (resi 60   and name HD1#)  3.00  1.20  0.80
assi (resi 57   and name HD1#) (resi 60   and name HB  )  4.00  2.20  1.50
assi (resi 57   and name HD1#) (resi 60   and name HG2#)  4.00  2.20  2.00
assi (resi 57   and name HA  ) (resi 61   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HB  ) (resi 61   and name HB# )  4.00  2.20  1.00
assi (resi 57   and name HG2#) (resi 61   and name HN  )  4.00  2.20  1.50
assi (resi 57   and name HG2#) (resi 61   and name HD* )  3.00  1.20  1.30

! residue 58   Asp , intraresidue NOEs
assi (resi 58   and name HN  ) (resi 58   and name HA  )  3.00  1.20  0.50
assi (resi 58   and name HN  ) (resi 58   and name HB# )  3.00  1.20  0.50
assi (resi 58   and name HA  ) (resi 58   and name HB# )  2.50  0.70  0.20

! residue 58   Asp , NOEs forward in sequence
assi (resi 58   and name HN  ) (resi 59   and name HN  )  3.00  1.20  0.70
assi (resi 58   and name HN  ) (resi 59   and name HB# )  4.00  2.20  1.00
assi (resi 58   and name HA  ) (resi 59   and name HN  )  4.00  2.20  1.00
assi (resi 58   and name HB# ) (resi 59   and name HN  )  4.00  2.20  1.00
assi (resi 58   and name HB# ) (resi 59   and name HA  )  4.00  2.20  1.00
assi (resi 58   and name HB# ) (resi 59   and name HG# )  4.00  2.20  1.00
assi (resi 58   and name HN  ) (resi 60   and name HN  )  4.00  2.20  1.00
assi (resi 58   and name HA  ) (resi 61   and name HN  )  4.00  2.20  1.00
assi (resi 58   and name HA  ) (resi 61   and name HB# )  4.00  2.20  1.00
assi (resi 58   and name HA  ) (resi 61   and name HD* )  4.00  2.20  1.50
assi (resi 58   and name HA  ) (resi 62   and name HN  )  4.00  2.20  1.00

! residue 59   Glu , intraresidue NOEs
assi (resi 59   and name HN  ) (resi 59   and name HA  )  2.50  0.70  0.40
assi (resi 59   and name HN  ) (resi 59   and name HG# )  4.00  2.20  1.00
assi (resi 59   and name HN  ) (resi 59   and name HB# )  2.50  0.70  0.40
assi (resi 59   and name HA  ) (resi 59   and name HB# )  2.50  0.70  0.20
assi (resi 59   and name HA  ) (resi 59   and name HG# )  4.00  2.20  1.00
assi (resi 59   and name HB# ) (resi 59   and name HG# )  2.50  0.70  0.20

! residue 59   Glu , NOEs forward in sequence
assi (resi 59   and name HN  ) (resi 60   and name HN  )  3.00  1.20  0.70
assi (resi 59   and name HN  ) (resi 60   and name HA  )  4.00  2.20  1.00
assi (resi 59   and name HA  ) (resi 60   and name HN  )  4.00  2.20  1.00
assi (resi 59   and name HA  ) (resi 60   and name HG1#)  4.00  2.20  1.00
assi (resi 59   and name HB# ) (resi 60   and name HN  )  3.00  1.20  0.50
assi (resi 59   and name HB# ) (resi 60   and name HA  )  4.00  2.20  1.00
assi (resi 59   and name HB# ) (resi 60   and name HD1#)  4.00  2.20  1.50
assi (resi 59   and name HB# ) (resi 60   and name HG1#)  4.00  2.20  1.00
assi (resi 59   and name HG# ) (resi 60   and name HN  )  4.00  2.20  1.00
assi (resi 59   and name HN  ) (resi 61   and name HN  )  4.00  2.20  1.00
assi (resi 59   and name HA  ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 59   and name HA  ) (resi 62   and name HB# )  3.00  1.20  0.80
assi (resi 59   and name HB# ) (resi 62   and name HB# )  4.00  2.20  1.50
assi (resi 59   and name HG# ) (resi 62   and name HB# )  4.00  2.20  1.50

! residue 60   Ile , intraresidue NOEs
assi (resi 60   and name HN  ) (resi 60   and name HA  )  3.00  1.20  0.50
assi (resi 60   and name HN  ) (resi 60   and name HB  )  2.50  0.70  0.40
assi (resi 60   and name HN  ) (resi 60   and name HG2#)  3.00  1.20  0.80
assi (resi 60   and name HN  ) (resi 60   and name HD1#)  4.00  4.00  1.80
assi (resi 60   and name HN  ) (resi 60   and name HG1#)  2.50  0.70  0.40
assi (resi 60   and name HA  ) (resi 60   and name HB  )  3.00  1.20  0.30
assi (resi 60   and name HA  ) (resi 60   and name HG2#)  2.50  0.70  0.70
assi (resi 60   and name HA  ) (resi 60   and name HD1#)  4.00  2.20  1.50
assi (resi 60   and name HA  ) (resi 60   and name HG1#)  3.00  1.20  0.30
assi (resi 60   and name HB  ) (resi 60   and name HD1#)  2.50  0.70  0.70
assi (resi 60   and name HG2#) (resi 60   and name HG1#)  2.50  0.70  0.70

! residue 60   Ile , NOEs forward in sequence
assi (resi 60   and name HA  ) (resi 61   and name HN  )  4.00  2.20  1.00
assi (resi 60   and name HB  ) (resi 61   and name HN  )  2.50  0.70  0.40
assi (resi 60   and name HG2#) (resi 61   and name HN  )  4.00  2.20  1.50
assi (resi 60   and name HG2#) (resi 61   and name HA  )  4.00  2.20  1.50
assi (resi 60   and name HA  ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 60   and name HA  ) (resi 63   and name HN  )  4.00  2.20  1.00
assi (resi 60   and name HA  ) (resi 63   and name HB# )  4.00  2.20  1.50

! residue 61   Leu , intraresidue NOEs
assi (resi 61   and name HN  ) (resi 61   and name HA  )  3.00  1.20  0.50
assi (resi 61   and name HN  ) (resi 61   and name HB# )  2.50  0.70  0.40
assi (resi 61   and name HN  ) (resi 61   and name HG  )  4.00  2.20  1.00
assi (resi 61   and name HN  ) (resi 61   and name HD*)  4.00  2.20  1.50
assi (resi 61   and name HA  ) (resi 61   and name HB# )  3.00  1.20  0.30
assi (resi 61   and name HA  ) (resi 61   and name HG  )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 61   and name HD* )  4.00  2.20  1.50
assi (resi 61   and name HB# ) (resi 61   and name HD*)  3.00  1.20  0.80

! residue 61   Leu , NOEs forward in sequence
assi (resi 61   and name HN  ) (resi 62   and name HN  )  3.00  1.20  0.70
assi (resi 61   and name HN  ) (resi 62   and name HB# )  4.00  2.20  1.50
assi (resi 61   and name HA  ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 61   and name HB# ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 61   and name HB# ) (resi 62   and name HA  )  4.00  2.20  1.00
assi (resi 61   and name HD*) (resi 62   and name HN  )  4.00  2.20  1.50
assi (resi 61   and name HN  ) (resi 63   and name HN  )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 63   and name HN  )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 64   and name HN  )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 64   and name HB# )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 64   and name HG  )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 64   and name HD* )  4.00  2.20  1.50
assi (resi 61   and name HD* ) (resi 64   and name HN  )  4.00  2.20  1.50
assi (resi 61   and name HD* ) (resi 64   and name HG  )  4.00  2.20  1.50

! residue 62   Ala , intraresidue NOEs
assi (resi 62   and name HN  ) (resi 62   and name HA  )  3.00  1.20  0.50
assi (resi 62   and name HN  ) (resi 62   and name HB# )  2.50  0.70  0.90

! residue 62   Ala , NOEs forward in sequence
assi (resi 62   and name HN  ) (resi 63   and name HN  )  3.00  1.20  0.70
assi (resi 62   and name HA  ) (resi 63   and name HN  )  4.00  2.20  1.00
assi (resi 62   and name HB# ) (resi 63   and name HN  )  3.00  1.20  0.80
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  )  4.00  2.20  1.00

! residue 63   Ala , intraresidue NOEs
assi (resi 63   and name HN  ) (resi 63   and name HA  )  3.00  1.20  0.50
assi (resi 63   and name HN  ) (resi 63   and name HB# )  2.50  0.70  0.90

! residue 63   Ala , NOEs forward in sequence
assi (resi 63   and name HN  ) (resi 64   and name HG  )  4.00  2.20  1.00
assi (resi 63   and name HN  ) (resi 64   and name HB# )  4.00  2.20  1.00
assi (resi 63   and name HB# ) (resi 64   and name HN  )  3.00  1.20  0.80

! residue 64   Leu , intraresidue NOEs
assi (resi 64   and name HN  ) (resi 64   and name HB# )  3.00  1.20  0.50
assi (resi 64   and name HN  ) (resi 64   and name HG  )  3.00  1.20  0.50
assi (resi 64   and name HN  ) (resi 64   and name HD* )  4.00  2.20  1.50
assi (resi 64   and name HA  ) (resi 64   and name HG  )  4.00  2.20  1.00
assi (resi 64   and name HA  ) (resi 64   and name HD*)  4.00  2.20  1.50
assi (resi 64   and name HB# ) (resi 64   and name HD*)  4.00  2.20  1.50
assi (resi 64   and name HG  ) (resi 64   and name HB# )  3.00  1.20  0.80

! residue 64   Leu , NOEs forward in sequence
assi (resi 64   and name HN  ) (resi 65   and name HD# )  4.00  2.20  1.00
assi (resi 64   and name HA  ) (resi 65   and name HD# )  2.50  0.70  0.20
assi (resi 64   and name HA  ) (resi 65   and name HG# )  4.00  2.20  1.00
assi (resi 64   and name HB# ) (resi 65   and name HD# )  4.00  2.20  1.00
assi (resi 64   and name HD*) (resi 65   and name HD# )  4.00  2.20  1.50
assi (resi 64   and name HB# ) (resi 65   and name HD# )  4.00  2.20  1.00
assi (resi 64   and name HD* ) (resi 65   and name HD# )  4.00  2.20  1.50

! residue 65   Pro , intraresidue NOEs
assi (resi 65   and name HA  ) (resi 65   and name HB# )  3.00  1.20  0.30
assi (resi 65   and name HA  ) (resi 65   and name HG# )  4.00  2.20  1.00
assi (resi 65   and name HA  ) (resi 65   and name HD# )  4.00  2.20  1.00
assi (resi 65   and name HB# ) (resi 65   and name HD# )  4.00  2.20  2.00
assi (resi 65   and name HD# ) (resi 65   and name HG# )  3.00  1.20  0.30
assi (resi 65   and name HB# ) (resi 65   and name HG# )  2.50  0.70  0.20
assi (resi 65   and name HB# ) (resi 65   and name HD# )  4.00  2.20  2.00

!Dihedral angle constraints

!Phi-angle constraints

! 21 Ala: 3.5
    assi (resid 20 and name C ) (resid 21 and name N)
         (resid 21 and name CA) (resid 21 and name C) 1.0 -60.0 20.0 2

! 22 Glu: 4.0
    assi (resid 21 and name C ) (resid 22 and name N)
         (resid 22 and name CA) (resid 22 and name C) 1.0 -60.0 20.0 2

! 23 Ala: 3.5
    assi (resid 22 and name C ) (resid 23 and name N)
         (resid 23 and name CA) (resid 23 and name C) 1.0 -60.0 20.0 2

! 24 Ala: 3.0
    assi (resid 23 and name C ) (resid 24 and name N)
         (resid 24 and name CA) (resid 24 and name C) 1.0 -60.0 20.0 2

! 25 Val: 3.0
    assi (resid 24 and name C ) (resid 25 and name N)
         (resid 25 and name CA) (resid 25 and name C) 1.0 -60.0 20.0 2

! 26 Leu: 3.0
    assi (resid 25 and name C ) (resid 26 and name N)
         (resid 26 and name CA) (resid 26 and name C) 1.0 -60.0 20.0 2

! 27 Ala: 4.5
    assi (resid 26 and name C ) (resid 27 and name N)
         (resid 27 and name CA) (resid 27 and name C) 1.0 -60.0 20.0 2
! 28 Asn: 4.0
    assi (resid 27 and name C ) (resid 28 and name N)
         (resid 28 and name CA) (resid 28 and name C) 1.0 -60.0 20.0 2

! 29 Arg: 3.0
    assi (resid 28 and name C ) (resid 29 and name N)
         (resid 29 and name CA) (resid 29 and name C) 1.0 -60.0 20.0 2

! 30 Glu: 
  assign (resid  29 and name c ) (resid  30 and name n )
         (resid  30 and name ca) (resid  30 and name c )        1        -90.00   88.00 2

! 31 Leu: 
  assign (resid  30 and name c ) (resid  31 and name n )
         (resid  31 and name ca) (resid  31 and name c )        1        -90.00   88.00 2

! 32 Asp: 2.5
    assi (resid 31 and name C ) (resid 32 and name N)
         (resid 32 and name CA) (resid 32 and name C) 1.0 -60.0 20.0 2

! 33 Lys: 
  assign (resid  32 and name c ) (resid  33 and name n )
         (resid  33 and name ca) (resid  33 and name c )        1        -90.00   88.00 2

! 34 Tyr: 7.0
  assign (resid  33 and name c ) (resid  33 and name n )
         (resid  34 and name ca) (resid  34 and name c )        1        -90.00   88.00 2

! 35 Gly: -
! 36 Val: 5.5
  assign (resid  35 and name c ) (resid  36 and name n )
         (resid  36 and name ca) (resid  36 and name c )        1        -90.00   88.00 2

! 37 Ser: 4.0
    assi (resid 36 and name C ) (resid 37 and name N)
         (resid 37 and name CA) (resid 37 and name C) 1.0 -60.0 20.0 2
! 38 Asp: -
  assign (resid  37 and name c ) (resid  38 and name n )
         (resid  38 and name ca) (resid  38 and name c )        1        -90.00   88.00 2

! 39 Tyr: -
  assign (resid  38 and name c ) (resid  39 and name n )
         (resid  39 and name ca) (resid  39 and name c )        1        -90.00   88.00 2

! 40 Tyr: 4.0
    assi (resid 39 and name C ) (resid 40 and name N)
         (resid 40 and name CA) (resid 40 and name C) 1.0 -60.0 20.0 2

! 41 Lys: 4.0
    assi (resid 40 and name C ) (resid 41 and name N)
         (resid 41 and name CA) (resid 41 and name C) 1.0 -60.0 20.0 2

! 42 Asn: 3.0 
    assi (resid 41 and name C ) (resid 42 and name N)
         (resid 42 and name CA) (resid 42 and name C) 1.0 -60.0 20.0 2

! 43 Leu: 4.0
    assi (resid 42 and name C ) (resid 43 and name N)
         (resid 43 and name CA) (resid 43 and name C) 1.0 -60.0 20.0 2

! 44 Ile: 3.5
    assi (resid 43 and name C ) (resid 44 and name N)
         (resid 44 and name CA) (resid 44 and name C) 1.0 -60.0 20.0 2

! 45 Asn: 3.5
    assi (resid 44 and name C ) (resid 45 and name N)
         (resid 45 and name CA) (resid 45 and name C) 1.0 -60.0 20.0 2

! 46 Asn: 7.0
  assign (resid  45 and name c ) (resid  46 and name n )
         (resid  46 and name ca) (resid  46 and name c )        1        -90.00   88.00 2

! 47 Ala: 3.0
    assi (resid 46 and name C ) (resid 47 and name N)
         (resid 47 and name CA) (resid 47 and name C) 1.0 -60.0 20.0 2

! 48 Lys: -
  assign (resid  47 and name c ) (resid  48 and name n )
         (resid  48 and name ca) (resid  48 and name c )        1        -90.00   88.00 2

! 49 Thr: 7.0
  assign (resid  48 and name c ) (resid  49 and name n )
         (resid  49 and name ca) (resid  49 and name c )        1        -90.00   88.00 2
! 50 Val: -
  assign (resid  49 and name c ) (resid  50 and name n )
         (resid  50 and name ca) (resid  50 and name c )        1        -90.00   88.00 2

! 51 Glu: 3.0
    assi (resid 50 and name C ) (resid 51 and name N)
         (resid 51 and name CA) (resid 51 and name C) 1.0 -60.0 20.0 2

! 53 Val: 3.5
    assi (resid 52 and name C ) (resid 53 and name N)
         (resid 53 and name CA) (resid 53 and name C) 1.0 -60.0 20.0 2

! 54 Lys: 4.0
    assi (resid 53 and name C ) (resid 54 and name N)
         (resid 54 and name CA) (resid 54 and name C) 1.0 -60.0 20.0 2

! 55 Ala: 3.5
    assi (resid 54 and name C ) (resid 55 and name N)
         (resid 55 and name CA) (resid 55 and name C) 1.0 -60.0 20.0 2

! 56 Leu: 4.0
    assi (resid 55 and name C ) (resid 56 and name N)
         (resid 56 and name CA) (resid 56 and name C) 1.0 -60.0 20.0 2

! 57 Ile: 3.0
    assi (resid 56 and name C ) (resid 57 and name N)
         (resid 57 and name CA) (resid 57 and name C) 1.0 -60.0 20.0 2

! 58 Asp: 3.5 
    assi (resid 57 and name C ) (resid 58 and name N)
         (resid 58 and name CA) (resid 58 and name C) 1.0 -60.0 20.0 2

! 59 Glu: 4.0 
    assi (resid 58 and name C ) (resid 59 and name N)
         (resid 59 and name CA) (resid 59 and name C) 1.0 -60.0 20.0 2

! 60 Ile: 3.0
    assi (resid 59 and name C ) (resid 60 and name N)
         (resid 60 and name CA) (resid 60 and name C) 1.0 -60.0 20.0 2

! 61 Leu: 4.0
    assi (resid 60 and name C ) (resid 61 and name N)
         (resid 61 and name CA) (resid 61 and name C) 1.0 -60.0 20.0 2

! 62 Ala: 3.5
    assi (resid 61 and name C ) (resid 62 and name N)
         (resid 62 and name CA) (resid 62 and name C) 1.0 -60.0 20.0 2

! 63 Ala: 7.0
  assign (resid  62 and name c ) (resid  63 and name n )
         (resid  63 and name ca) (resid  63 and name c )        1        -90.00   88.00 2

! 64 Leu: 5.5
  assign (resid  63 and name c ) (resid  64 and name n )
         (resid  64 and name ca) (resid  64 and name c )        1        -90.00   88.00 2


!chi-1 constraints 

    assi (resid 25 and name N ) (resid 25 and name CA)
         (resid 25 and name CB) (resid 25 and name CG1) 1.0 180.0 20.0 2

    assi (resid 26 and name N ) (resid 26 and name CA)
         (resid 26 and name CB) (resid 26 and name CG) 1.0 -60.0 20.0 2

    assi (resid 28 and name N ) (resid 28 and name CA)
         (resid 28 and name CB) (resid 28 and name CG) 1.0 180.0 20.0 2 
    
    assi (resid 31 and name N ) (resid 31 and name CA)
         (resid 31 and name CB) (resid 31 and name CG) 1.0 -60.0 20.0 2

    assi (resid 43 and name N ) (resid 43 and name CA)
         (resid 43 and name CB) (resid 43 and name CG) 1.0 180.0 20.0 2
    
    assi (resid 44 and name N ) (resid 44 and name CA)
         (resid 44 and name CB) (resid 44 and name CG1) 1.0 -60.0 20.0 2
    assi (resid 53 and name N ) (resid 53 and name CA)
         (resid 53 and name CB) (resid 53 and name CG1) 1.0 180.0 20.0 2

    assi (resid 56 and name N ) (resid 56 and name CA)
         (resid 56 and name CB) (resid 56 and name CG) 1.0 180.0 20.0 2

    assi (resid 60 and name N ) (resid 60 and name CA)
         (resid 60 and name CB) (resid 60 and name CG1) 1.0 -60.0 20.0 2

    assi (resid 61 and name N ) (resid 61 and name CA)
         (resid 61 and name CB) (resid 61 and name CG) 1.0 -60.0 20.0 2

!chi-2 constraints

    assi (resid 26 and name ca) (resid 26 and name cb)
       (resid 26 and name cg) (resid 26 and name cd1) 1.0 180.0 20.0 2

    assi (resid 31 and name ca) (resid 31 and name cb)
       (resid 31 and name cg) (resid 31 and name cd1) 1.0 180.0 20.0 2

    assi (resid 43 and name ca) (resid 43 and name cb)
       (resid 43 and name cg) (resid 43 and name cd1) 1.0 60.0 20.0 2

    assi (resid 56 and name ca) (resid 56 and name cb)
       (resid 56 and name cg) (resid 56 and name cd1) 1.0 60.0 20.0 2

    assi (resid 61 and name ca) (resid 61 and name cb)
       (resid 61 and name cg) (resid 61 and name cd1) 1.0 180.0 20.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  35.504  -5.801   2.151
    2    H2   MET   1           H2       MET   1  36.047  -5.418   3.715
    3    H3   MET   1           H3       MET   1  35.936  -7.040   3.225
    4    HA   MET   1           HA       MET   1  34.031  -6.892   4.435
    5   1HB   MET   1          1HB       MET   1  32.691  -4.827   4.576
    6   2HB   MET   1          2HB       MET   1  34.375  -4.507   4.999
    7   1HG   MET   1          1HG       MET   1  34.756  -3.803   2.606
    8   2HG   MET   1          2HG       MET   1  33.015  -3.929   2.355
    9   1HE   MET   1          1HE       MET   1  35.802  -2.655   4.442
   10   2HE   MET   1          2HE       MET   1  35.789  -1.365   3.230
   11   3HE   MET   1          3HE       MET   1  35.393  -1.010   4.910
   12    H    LYS   2           H        LYS   2  34.629  -6.482   1.164
   13    HA   LYS   2           HA       LYS   2  31.954  -6.338   0.117
   14   1HB   LYS   2          1HB       LYS   2  34.521  -7.451  -1.048
   15   2HB   LYS   2          2HB       LYS   2  33.015  -7.325  -1.958
   16   1HG   LYS   2          1HG       LYS   2  32.962  -4.893  -1.537
   17   2HG   LYS   2          2HG       LYS   2  34.474  -5.017  -0.637
   18   1HD   LYS   2          1HD       LYS   2  34.130  -5.801  -3.548
   19   2HD   LYS   2          2HD       LYS   2  34.818  -4.274  -2.996
   20   1HE   LYS   2          1HE       LYS   2  36.765  -5.508  -3.276
   21   2HE   LYS   2          2HE       LYS   2  36.410  -5.909  -1.595
   22   1HZ   LYS   2          1HZ       LYS   2  34.976  -7.636  -3.291
   23   2HZ   LYS   2          2HZ       LYS   2  36.609  -7.639  -3.763
   24   3HZ   LYS   2          3HZ       LYS   2  36.184  -8.020  -2.163
   25    H    ALA   3           H        ALA   3  30.487  -7.972  -0.328
   26    HA   ALA   3           HA       ALA   3  31.241 -10.790  -0.158
   27   1HB   ALA   3          1HB       ALA   3  29.464  -9.554   1.968
   28   2HB   ALA   3          2HB       ALA   3  31.050 -10.283   2.227
   29   3HB   ALA   3          3HB       ALA   3  29.689 -11.287   1.729
   30    H    ILE   4           H        ILE   4  28.685  -8.350  -0.271
   31    HA   ILE   4           HA       ILE   4  26.809 -10.222  -1.570
   32    HB   ILE   4           HB       ILE   4  26.578  -7.260  -0.959
   33   1HG1  ILE   4          1HG1      ILE   4  25.313  -9.626   0.452
   34   2HG1  ILE   4          2HG1      ILE   4  26.793  -8.845   1.010
   35   1HG2  ILE   4          1HG2      ILE   4  24.578  -9.316  -1.936
   36   2HG2  ILE   4          2HG2      ILE   4  24.118  -7.746  -1.282
   37   3HG2  ILE   4          3HG2      ILE   4  25.078  -7.838  -2.759
   38   1HD1  ILE   4          1HD1      ILE   4  25.559  -6.678   1.119
   39   2HD1  ILE   4          2HD1      ILE   4  24.080  -7.531   0.676
   40   3HD1  ILE   4          3HD1      ILE   4  24.887  -7.896   2.201
   41    H    PHE   5           H        PHE   5  26.361 -10.233  -3.753
   42    HA   PHE   5           HA       PHE   5  28.258  -9.110  -5.585
   43   1HB   PHE   5          1HB       PHE   5  26.824 -11.137  -6.017
   44   2HB   PHE   5          2HB       PHE   5  25.445 -10.056  -6.212
   45    HD1  PHE   5           HD1      PHE   5  25.135  -8.784  -8.214
   46    HD2  PHE   5           HD2      PHE   5  28.786 -10.950  -7.575
   47    HE1  PHE   5           HE1      PHE   5  25.795  -8.360 -10.567
   48    HE2  PHE   5           HE2      PHE   5  29.446 -10.532  -9.929
   49    HZ   PHE   5           HZ       PHE   5  27.950  -9.237 -11.425
   50    H    VAL   6           H        VAL   6  27.980  -7.339  -7.062
   51    HA   VAL   6           HA       VAL   6  26.927  -4.969  -6.010
   52    HB   VAL   6           HB       VAL   6  27.215  -5.709  -8.938
   53   1HG1  VAL   6          1HG1      VAL   6  26.916  -3.062  -7.500
   54   2HG1  VAL   6          2HG1      VAL   6  27.532  -3.194  -9.148
   55   3HG1  VAL   6          3HG1      VAL   6  25.888  -3.717  -8.775
   56   1HG2  VAL   6          1HG2      VAL   6  29.124  -4.387  -6.982
   57   2HG2  VAL   6          2HG2      VAL   6  29.296  -6.006  -7.663
   58   3HG2  VAL   6          3HG2      VAL   6  29.421  -4.591  -8.708
   59    H    LEU   7           H        LEU   7  25.381  -6.992  -8.540
   60    HA   LEU   7           HA       LEU   7  22.870  -5.511  -8.241
   61   1HB   LEU   7          1HB       LEU   7  23.638  -6.459 -10.423
   62   2HB   LEU   7          2HB       LEU   7  23.434  -8.077  -9.763
   63    HG   LEU   7           HG       LEU   7  21.068  -6.240  -9.537
   64   1HD1  LEU   7          1HD1      LEU   7  21.964  -7.456 -12.165
   65   2HD1  LEU   7          2HD1      LEU   7  20.361  -6.787 -11.865
   66   3HD1  LEU   7          3HD1      LEU   7  21.778  -5.738 -11.811
   67   1HD2  LEU   7          1HD2      LEU   7  21.464  -9.174 -10.231
   68   2HD2  LEU   7          2HD2      LEU   7  20.821  -8.515  -8.728
   69   3HD2  LEU   7          3HD2      LEU   7  19.895  -8.377 -10.218
   70    H    ASN   8           H        ASN   8  21.331  -6.001  -6.766
   71    HA   ASN   8           HA       ASN   8  20.870  -8.771  -5.922
   72   1HB   ASN   8          1HB       ASN   8  21.253  -8.343  -3.536
   73   2HB   ASN   8          2HB       ASN   8  22.737  -8.053  -4.444
   74   2HD2  ASN   8          2HD2      ASN   8  22.753  -6.749  -2.087
   75   1HD2  ASN   8          1HD2      ASN   8  22.382  -5.102  -2.260
   76    H    ALA   9           H        ALA   9  18.933  -8.885  -4.486
   77    HA   ALA   9           HA       ALA   9  17.013  -6.725  -5.189
   78   1HB   ALA   9          1HB       ALA   9  16.589  -9.250  -5.557
   79   2HB   ALA   9          2HB       ALA   9  15.300  -8.311  -4.802
   80   3HB   ALA   9          3HB       ALA   9  16.345  -9.330  -3.810
   81    H    GLN  10           H        GLN  10  19.076  -7.344  -2.679
   82    HA   GLN  10           HA       GLN  10  17.456  -7.100  -0.356
   83   1HB   GLN  10          1HB       GLN  10  19.861  -7.677  -0.293
   84   2HB   GLN  10          2HB       GLN  10  20.264  -6.045  -0.822
   85   1HG   GLN  10          1HG       GLN  10  19.215  -5.120   1.218
   86   2HG   GLN  10          2HG       GLN  10  18.810  -6.754   1.747
   87   2HE2  GLN  10          2HE2      GLN  10  20.225  -7.005   3.533
   88   1HE2  GLN  10          1HE2      GLN  10  21.912  -6.851   3.426
   89    H    HIS  11           H        HIS  11  19.090  -4.522  -2.250
   90    HA   HIS  11           HA       HIS  11  16.892  -2.687  -1.710
   91   1HB   HIS  11          1HB       HIS  11  19.525  -2.395  -0.255
   92   2HB   HIS  11          2HB       HIS  11  18.522  -0.987  -0.608
   93    HD1  HIS  11           HD1      HIS  11  15.742  -1.896  -0.051
   94    HD2  HIS  11           HD2      HIS  11  18.933  -3.077   2.357
   95    HE1  HIS  11           HE1      HIS  11  14.747  -2.564   2.180
   96    H    ASP  12           H        ASP  12  17.195  -0.628  -2.829
   97    HA   ASP  12           HA       ASP  12  19.517  -0.292  -4.582
   98   1HB   ASP  12          1HB       ASP  12  18.216  -0.373  -6.679
   99   2HB   ASP  12          2HB       ASP  12  18.176  -1.934  -5.858
  100    H    GLU  13           H        GLU  13  18.737   1.652  -6.240
  101    HA   GLU  13           HA       GLU  13  18.265   3.903  -4.554
  102   1HB   GLU  13          1HB       GLU  13  17.942   3.551  -7.549
  103   2HB   GLU  13          2HB       GLU  13  17.787   5.108  -6.733
  104   1HG   GLU  13          1HG       GLU  13  20.076   4.872  -5.841
  105   2HG   GLU  13          2HG       GLU  13  20.234   3.317  -6.659
  106    H    ALA  14           H        ALA  14  16.078   1.956  -6.561
  107    HA   ALA  14           HA       ALA  14  13.740   3.527  -5.600
  108   1HB   ALA  14          1HB       ALA  14  13.849   1.167  -7.508
  109   2HB   ALA  14          2HB       ALA  14  13.885   2.858  -8.008
  110   3HB   ALA  14          3HB       ALA  14  12.456   2.205  -7.206
  111    H    VAL  15           H        VAL  15  12.597   2.808  -3.854
  112    HA   VAL  15           HA       VAL  15  12.754  -0.095  -3.122
  113    HB   VAL  15           HB       VAL  15  12.812   0.702  -0.702
  114   1HG1  VAL  15          1HG1      VAL  15  15.162   1.304  -2.526
  115   2HG1  VAL  15          2HG1      VAL  15  15.272   1.097  -0.778
  116   3HG1  VAL  15          3HG1      VAL  15  14.781  -0.257  -1.797
  117   1HG2  VAL  15          1HG2      VAL  15  12.175   3.080  -1.356
  118   2HG2  VAL  15          2HG2      VAL  15  13.548   2.948  -0.258
  119   3HG2  VAL  15          3HG2      VAL  15  13.816   3.264  -1.972
  120    H    ASP  16           H        ASP  16  11.110  -0.353  -1.136
  121    HA   ASP  16           HA       ASP  16   8.508  -0.041  -2.224
  122   1HB   ASP  16          1HB       ASP  16   9.443  -0.571   0.608
  123   2HB   ASP  16          2HB       ASP  16   7.747  -0.622   0.123
  124    H    ALA  17           H        ALA  17  10.485   2.307  -0.764
  125    HA   ALA  17           HA       ALA  17   8.779   3.885   0.780
  126   1HB   ALA  17          1HB       ALA  17  11.168   4.427   0.278
  127   2HB   ALA  17          2HB       ALA  17  10.680   4.941  -1.336
  128   3HB   ALA  17          3HB       ALA  17  10.099   5.815   0.081
  129    H    ASN  18           H        ASN  18   9.203   4.280  -2.771
  130    HA   ASN  18           HA       ASN  18   6.608   5.720  -2.876
  131   1HB   ASN  18          1HB       ASN  18   8.646   6.464  -4.205
  132   2HB   ASN  18          2HB       ASN  18   8.438   5.013  -5.188
  133   2HD2  ASN  18          2HD2      ASN  18   7.033   5.219  -6.944
  134   1HD2  ASN  18          1HD2      ASN  18   5.869   6.441  -7.117
  135    H    SER  19           H        SER  19   5.629   3.574  -2.127
  136    HA   SER  19           HA       SER  19   4.492   2.233  -4.471
  137   1HB   SER  19          1HB       SER  19   6.441   0.827  -4.200
  138   2HB   SER  19          2HB       SER  19   6.204   0.747  -2.458
  139    HG   SER  19           HG       SER  19   4.187  -0.304  -2.911
  140    H    LEU  20           H        LEU  20   4.888   2.092  -0.921
  141    HA   LEU  20           HA       LEU  20   2.311   0.987  -0.377
  142   1HB   LEU  20          1HB       LEU  20   3.973   2.907   1.293
  143   2HB   LEU  20          2HB       LEU  20   2.610   1.967   1.890
  144    HG   LEU  20           HG       LEU  20   5.083   0.733   0.644
  145   1HD1  LEU  20          1HD1      LEU  20   4.391   1.325   3.527
  146   2HD1  LEU  20          2HD1      LEU  20   5.580   0.104   3.072
  147   3HD1  LEU  20          3HD1      LEU  20   5.842   1.794   2.641
  148   1HD2  LEU  20          1HD2      LEU  20   2.621  -0.343   2.025
  149   2HD2  LEU  20          2HD2      LEU  20   3.367  -0.873   0.517
  150   3HD2  LEU  20          3HD2      LEU  20   4.127  -1.257   2.059
  151    H    ALA  21           H        ALA  21   3.464   4.312  -0.800
  152    HA   ALA  21           HA       ALA  21   1.056   5.645  -0.136
  153   1HB   ALA  21          1HB       ALA  21   2.966   6.556  -2.296
  154   2HB   ALA  21          2HB       ALA  21   3.373   6.658  -0.585
  155   3HB   ALA  21          3HB       ALA  21   1.991   7.554  -1.214
  156    H    GLU  22           H        GLU  22   2.262   4.714  -3.393
  157    HA   GLU  22           HA       GLU  22  -0.159   5.470  -4.730
  158   1HB   GLU  22          1HB       GLU  22   2.011   5.054  -5.895
  159   2HB   GLU  22          2HB       GLU  22   1.845   3.335  -5.535
  160   1HG   GLU  22          1HG       GLU  22  -0.248   3.249  -6.813
  161   2HG   GLU  22          2HG       GLU  22  -0.126   4.975  -7.152
  162    H    ALA  23           H        ALA  23   0.939   2.397  -3.327
  163    HA   ALA  23           HA       ALA  23  -1.278   0.818  -4.181
  164   1HB   ALA  23          1HB       ALA  23   0.148   0.452  -1.540
  165   2HB   ALA  23          2HB       ALA  23   0.913   0.041  -3.075
  166   3HB   ALA  23          3HB       ALA  23  -0.563  -0.784  -2.577
  167    H    LYS  24           H        LYS  24  -0.757   2.695  -1.186
  168    HA   LYS  24           HA       LYS  24  -3.353   2.067  -0.090
  169   1HB   LYS  24          1HB       LYS  24  -1.369   4.286   0.481
  170   2HB   LYS  24          2HB       LYS  24  -2.858   4.057   1.402
  171   1HG   LYS  24          1HG       LYS  24  -2.156   1.778   2.000
  172   2HG   LYS  24          2HG       LYS  24  -0.671   1.976   1.077
  173   1HD   LYS  24          1HD       LYS  24  -0.021   3.868   2.527
  174   2HD   LYS  24          2HD       LYS  24  -1.503   3.655   3.455
  175   1HE   LYS  24          1HE       LYS  24  -0.815   1.480   4.212
  176   2HE   LYS  24          2HE       LYS  24   0.554   1.463   3.098
  177   1HZ   LYS  24          1HZ       LYS  24   1.098   3.675   4.398
  178   2HZ   LYS  24          2HZ       LYS  24   0.224   2.892   5.622
  179   3HZ   LYS  24          3HZ       LYS  24   1.605   2.154   4.962
  180    H    VAL  25           H        VAL  25  -2.087   4.758  -2.043
  181    HA   VAL  25           HA       VAL  25  -4.476   6.329  -1.959
  182    HB   VAL  25           HB       VAL  25  -2.219   6.216  -3.961
  183   1HG1  VAL  25          1HG1      VAL  25  -4.686   7.959  -3.857
  184   2HG1  VAL  25          2HG1      VAL  25  -3.199   8.524  -4.620
  185   3HG1  VAL  25          3HG1      VAL  25  -4.015   7.089  -5.237
  186   1HG2  VAL  25          1HG2      VAL  25  -1.955   7.068  -1.503
  187   2HG2  VAL  25          2HG2      VAL  25  -1.353   8.090  -2.808
  188   3HG2  VAL  25          3HG2      VAL  25  -2.903   8.453  -2.046
  189    H    LEU  26           H        LEU  26  -3.344   3.889  -4.318
  190    HA   LEU  26           HA       LEU  26  -5.642   4.164  -6.031
  191   1HB   LEU  26          1HB       LEU  26  -3.667   1.895  -5.671
  192   2HB   LEU  26          2HB       LEU  26  -4.930   1.894  -6.899
  193    HG   LEU  26           HG       LEU  26  -2.760   3.997  -6.626
  194   1HD1  LEU  26          1HD1      LEU  26  -1.957   1.746  -7.353
  195   2HD1  LEU  26          2HD1      LEU  26  -3.106   1.800  -8.688
  196   3HD1  LEU  26          3HD1      LEU  26  -1.787   2.967  -8.615
  197   1HD2  LEU  26          1HD2      LEU  26  -5.153   3.683  -8.427
  198   2HD2  LEU  26          2HD2      LEU  26  -4.460   5.150  -7.731
  199   3HD2  LEU  26          3HD2      LEU  26  -3.681   4.377  -9.108
  200    H    ALA  27           H        ALA  27  -4.940   2.012  -3.294
  201    HA   ALA  27           HA       ALA  27  -7.399   0.510  -3.615
  202   1HB   ALA  27          1HB       ALA  27  -5.382  -0.341  -2.399
  203   2HB   ALA  27          2HB       ALA  27  -5.700   0.838  -1.127
  204   3HB   ALA  27          3HB       ALA  27  -6.863  -0.450  -1.446
  205    H    ASN  28           H        ASN  28  -6.418   3.279  -1.627
  206    HA   ASN  28           HA       ASN  28  -8.765   3.458  -0.032
  207   1HB   ASN  28          1HB       ASN  28  -6.680   4.668   0.468
  208   2HB   ASN  28          2HB       ASN  28  -6.929   5.683  -0.954
  209   2HD2  ASN  28          2HD2      ASN  28  -7.004   6.216   2.129
  210   1HD2  ASN  28          1HD2      ASN  28  -8.446   7.090   2.333
  211    H    ARG  29           H        ARG  29  -8.067   4.966  -3.215
  212    HA   ARG  29           HA       ARG  29 -10.415   6.577  -3.270
  213   1HB   ARG  29          1HB       ARG  29 -10.145   6.510  -5.779
  214   2HB   ARG  29          2HB       ARG  29  -8.705   7.013  -4.895
  215   1HG   ARG  29          1HG       ARG  29  -7.791   4.755  -5.062
  216   2HG   ARG  29          2HG       ARG  29  -9.237   4.207  -5.907
  217   1HD   ARG  29          1HD       ARG  29  -7.327   6.354  -6.882
  218   2HD   ARG  29          2HD       ARG  29  -7.420   4.705  -7.504
  219    HE   ARG  29           HE       ARG  29 -10.005   5.668  -7.780
  220   1HH1  ARG  29          1HH1      ARG  29 -10.718   6.705  -9.655
  221   2HH1  ARG  29          2HH1      ARG  29  -9.570   7.501 -10.679
  222   1HH2  ARG  29          1HH2      ARG  29  -6.843   6.696  -8.692
  223   2HH2  ARG  29          2HH2      ARG  29  -7.376   7.496 -10.133
  224    H    GLU  30           H        GLU  30  -9.948   3.173  -4.171
  225    HA   GLU  30           HA       GLU  30 -12.460   2.801  -5.469
  226   1HB   GLU  30          1HB       GLU  30 -10.761   0.900  -3.827
  227   2HB   GLU  30          2HB       GLU  30 -12.193   0.391  -4.722
  228   1HG   GLU  30          1HG       GLU  30  -9.838   1.824  -5.982
  229   2HG   GLU  30          2HG       GLU  30 -10.042   0.072  -5.986
  230    H    LEU  31           H        LEU  31 -11.561   2.664  -2.048
  231    HA   LEU  31           HA       LEU  31 -14.064   1.769  -1.003
  232   1HB   LEU  31          1HB       LEU  31 -12.296   3.811   0.366
  233   2HB   LEU  31          2HB       LEU  31 -13.257   2.529   1.101
  234    HG   LEU  31           HG       LEU  31 -10.751   2.220  -0.558
  235   1HD1  LEU  31          1HD1      LEU  31 -11.452   1.570   2.315
  236   2HD1  LEU  31          2HD1      LEU  31  -9.936   1.125   1.534
  237   3HD1  LEU  31          3HD1      LEU  31 -10.346   2.825   1.753
  238   1HD2  LEU  31          1HD2      LEU  31 -12.727   0.154   0.470
  239   2HD2  LEU  31          2HD2      LEU  31 -12.199   0.395  -1.196
  240   3HD2  LEU  31          3HD2      LEU  31 -11.075  -0.256  -0.003
  241    H    ASP  32           H        ASP  32 -12.752   5.013  -1.494
  242    HA   ASP  32           HA       ASP  32 -15.058   6.484  -0.725
  243   1HB   ASP  32          1HB       ASP  32 -12.695   6.983  -2.527
  244   2HB   ASP  32          2HB       ASP  32 -13.965   8.203  -2.371
  245    H    LYS  33           H        LYS  33 -14.043   5.098  -3.823
  246    HA   LYS  33           HA       LYS  33 -16.142   6.171  -5.426
  247   1HB   LYS  33          1HB       LYS  33 -14.133   5.060  -6.346
  248   2HB   LYS  33          2HB       LYS  33 -14.689   3.521  -5.692
  249   1HG   LYS  33          1HG       LYS  33 -16.721   3.660  -7.087
  250   2HG   LYS  33          2HG       LYS  33 -16.160   5.199  -7.744
  251   1HD   LYS  33          1HD       LYS  33 -14.143   4.093  -8.628
  252   2HD   LYS  33          2HD       LYS  33 -14.702   2.551  -7.975
  253   1HE   LYS  33          1HE       LYS  33 -15.243   2.803 -10.389
  254   2HE   LYS  33          2HE       LYS  33 -16.687   2.632  -9.392
  255   1HZ   LYS  33          1HZ       LYS  33 -15.666   5.327  -9.918
  256   2HZ   LYS  33          2HZ       LYS  33 -16.493   4.526 -11.167
  257   3HZ   LYS  33          3HZ       LYS  33 -17.264   4.802  -9.682
  258    H    TYR  34           H        TYR  34 -15.910   3.043  -3.692
  259    HA   TYR  34           HA       TYR  34 -18.620   2.261  -4.326
  260   1HB   TYR  34          1HB       TYR  34 -16.687   1.312  -2.196
  261   2HB   TYR  34          2HB       TYR  34 -18.276   0.595  -2.450
  262    HD1  TYR  34           HD1      TYR  34 -14.880   0.306  -3.306
  263    HD2  TYR  34           HD2      TYR  34 -18.808   0.048  -5.030
  264    HE1  TYR  34           HE1      TYR  34 -13.981  -1.081  -5.154
  265    HE2  TYR  34           HE2      TYR  34 -17.906  -1.338  -6.875
  266    HH   TYR  34           HH       TYR  34 -15.113  -1.482  -7.868
  267    H    GLY  35           H        GLY  35 -17.131   4.004  -1.635
  268   1HA   GLY  35          1HA       GLY  35 -19.824   4.906  -0.797
  269   2HA   GLY  35          2HA       GLY  35 -18.288   5.564  -0.232
  270    H    VAL  36           H        VAL  36 -17.217   2.833   0.319
  271    HA   VAL  36           HA       VAL  36 -18.952   1.575   2.252
  272    HB   VAL  36           HB       VAL  36 -16.892   0.324   2.895
  273   1HG1  VAL  36          1HG1      VAL  36 -17.481   0.625  -0.061
  274   2HG1  VAL  36          2HG1      VAL  36 -16.544  -0.699   0.633
  275   3HG1  VAL  36          3HG1      VAL  36 -18.243  -0.505   1.059
  276   1HG2  VAL  36          1HG2      VAL  36 -15.602   2.116   0.816
  277   2HG2  VAL  36          2HG2      VAL  36 -15.279   2.162   2.550
  278   3HG2  VAL  36          3HG2      VAL  36 -14.830   0.743   1.607
  279    H    SER  37           H        SER  37 -17.678   1.265   4.598
  280    HA   SER  37           HA       SER  37 -18.002   3.841   5.858
  281   1HB   SER  37          1HB       SER  37 -17.430   2.711   7.915
  282   2HB   SER  37          2HB       SER  37 -18.428   1.615   6.963
  283    HG   SER  37           HG       SER  37 -15.668   1.535   6.576
  284    H    ASP  38           H        ASP  38 -16.304   4.958   7.118
  285    HA   ASP  38           HA       ASP  38 -13.821   5.161   5.562
  286   1HB   ASP  38          1HB       ASP  38 -13.316   7.047   7.058
  287   2HB   ASP  38          2HB       ASP  38 -14.964   7.186   6.442
  288    H    TYR  39           H        TYR  39 -14.842   3.161   8.009
  289    HA   TYR  39           HA       TYR  39 -12.511   3.153   9.712
  290   1HB   TYR  39          1HB       TYR  39 -14.550   2.164  10.541
  291   2HB   TYR  39          2HB       TYR  39 -14.650   1.078   9.154
  292    HD1  TYR  39           HD1      TYR  39 -13.060  -0.776   8.888
  293    HD2  TYR  39           HD2      TYR  39 -13.057   1.699  12.396
  294    HE1  TYR  39           HE1      TYR  39 -11.686  -2.456  10.066
  295    HE2  TYR  39           HE2      TYR  39 -11.679   0.012  13.583
  296    HH   TYR  39           HH       TYR  39 -11.350  -2.637  13.277
  297    H    TYR  40           H        TYR  40 -13.468   1.351   6.822
  298    HA   TYR  40           HA       TYR  40 -11.237  -0.442   6.786
  299   1HB   TYR  40          1HB       TYR  40 -13.037   0.549   4.560
  300   2HB   TYR  40          2HB       TYR  40 -11.870  -0.760   4.381
  301    HD1  TYR  40           HD1      TYR  40 -15.231  -0.022   5.150
  302    HD2  TYR  40           HD2      TYR  40 -12.008  -2.626   6.293
  303    HE1  TYR  40           HE1      TYR  40 -16.863  -1.622   6.108
  304    HE2  TYR  40           HE2      TYR  40 -13.645  -4.225   7.252
  305    HH   TYR  40           HH       TYR  40 -16.578  -3.560   8.111
  306    H    LYS  41           H        LYS  41 -11.702   2.784   5.277
  307    HA   LYS  41           HA       LYS  41  -9.246   2.639   3.793
  308   1HB   LYS  41          1HB       LYS  41  -9.578   4.926   3.242
  309   2HB   LYS  41          2HB       LYS  41 -11.197   4.255   3.391
  310   1HG   LYS  41          1HG       LYS  41 -11.500   5.256   5.548
  311   2HG   LYS  41          2HG       LYS  41  -9.815   5.743   5.650
  312   1HD   LYS  41          1HD       LYS  41 -11.316   7.623   5.014
  313   2HD   LYS  41          2HD       LYS  41 -10.094   7.281   3.792
  314   1HE   LYS  41          1HE       LYS  41 -11.645   6.288   2.333
  315   2HE   LYS  41          2HE       LYS  41 -12.814   5.992   3.620
  316   1HZ   LYS  41          1HZ       LYS  41 -13.155   8.377   3.805
  317   2HZ   LYS  41          2HZ       LYS  41 -12.037   8.654   2.561
  318   3HZ   LYS  41          3HZ       LYS  41 -13.491   7.839   2.228
  319    H    ASN  42           H        ASN  42 -10.060   3.714   7.041
  320    HA   ASN  42           HA       ASN  42  -7.501   4.874   7.613
  321   1HB   ASN  42          1HB       ASN  42  -9.620   3.662   9.409
  322   2HB   ASN  42          2HB       ASN  42  -8.170   4.454  10.025
  323   2HD2  ASN  42          2HD2      ASN  42  -7.884   6.690   8.458
  324   1HD2  ASN  42          1HD2      ASN  42  -9.263   7.677   8.546
  325    H    LEU  43           H        LEU  43  -8.845   1.617   7.937
  326    HA   LEU  43           HA       LEU  43  -6.648   0.423   9.283
  327   1HB   LEU  43          1HB       LEU  43  -8.831  -0.691   9.019
  328   2HB   LEU  43          2HB       LEU  43  -8.568  -0.812   7.282
  329    HG   LEU  43           HG       LEU  43  -6.629  -2.263   7.647
  330   1HD1  LEU  43          1HD1      LEU  43  -7.148  -1.574  10.533
  331   2HD1  LEU  43          2HD1      LEU  43  -6.407  -3.123  10.132
  332   3HD1  LEU  43          3HD1      LEU  43  -5.618  -1.620   9.659
  333   1HD2  LEU  43          1HD2      LEU  43  -9.093  -3.113   7.693
  334   2HD2  LEU  43          2HD2      LEU  43  -7.830  -4.209   8.251
  335   3HD2  LEU  43          3HD2      LEU  43  -8.825  -3.341   9.421
  336    H    ILE  44           H        ILE  44  -7.250   0.965   5.816
  337    HA   ILE  44           HA       ILE  44  -4.988  -0.468   4.828
  338    HB   ILE  44           HB       ILE  44  -6.443   1.979   3.782
  339   1HG1  ILE  44          1HG1      ILE  44  -7.502  -0.430   3.935
  340   2HG1  ILE  44          2HG1      ILE  44  -7.698   0.511   2.461
  341   1HG2  ILE  44          1HG2      ILE  44  -4.116   0.456   2.624
  342   2HG2  ILE  44          2HG2      ILE  44  -5.279   1.258   1.568
  343   3HG2  ILE  44          3HG2      ILE  44  -4.356   2.200   2.737
  344   1HD1  ILE  44          1HD1      ILE  44  -5.362  -1.377   2.748
  345   2HD1  ILE  44          2HD1      ILE  44  -6.943  -1.977   2.253
  346   3HD1  ILE  44          3HD1      ILE  44  -6.117  -0.764   1.281
  347    H    ASN  45           H        ASN  45  -5.365   2.890   5.918
  348    HA   ASN  45           HA       ASN  45  -2.819   3.894   5.339
  349   1HB   ASN  45          1HB       ASN  45  -4.765   5.141   6.386
  350   2HB   ASN  45          2HB       ASN  45  -4.311   4.405   7.923
  351   2HD2  ASN  45          2HD2      ASN  45  -3.901   6.756   8.576
  352   1HD2  ASN  45          1HD2      ASN  45  -2.396   7.440   8.188
  353    H    ASN  46           H        ASN  46  -3.798   1.630   7.843
  354    HA   ASN  46           HA       ASN  46  -1.143   1.737   9.146
  355   1HB   ASN  46          1HB       ASN  46  -3.582   0.025   9.715
  356   2HB   ASN  46          2HB       ASN  46  -2.117   0.070  10.697
  357   2HD2  ASN  46          2HD2      ASN  46  -1.490   2.669  11.044
  358   1HD2  ASN  46          1HD2      ASN  46  -2.783   3.562  11.685
  359    H    ALA  47           H        ALA  47  -2.240   0.291   6.385
  360    HA   ALA  47           HA       ALA  47  -1.430  -2.426   6.660
  361   1HB   ALA  47          1HB       ALA  47  -2.640  -1.292   4.679
  362   2HB   ALA  47          2HB       ALA  47  -1.455  -2.540   4.296
  363   3HB   ALA  47          3HB       ALA  47  -1.031  -0.838   4.122
  364    H    LYS  48           H        LYS  48   0.578  -3.397   6.631
  365    HA   LYS  48           HA       LYS  48   2.944  -1.581   6.668
  366   1HB   LYS  48          1HB       LYS  48   2.508  -4.411   7.647
  367   2HB   LYS  48          2HB       LYS  48   4.082  -3.614   7.646
  368   1HG   LYS  48          1HG       LYS  48   3.298  -1.893   9.138
  369   2HG   LYS  48          2HG       LYS  48   1.631  -2.444   8.984
  370   1HD   LYS  48          1HD       LYS  48   2.499  -3.265  11.092
  371   2HD   LYS  48          2HD       LYS  48   2.326  -4.636   9.998
  372   1HE   LYS  48          1HE       LYS  48   4.658  -4.756   9.596
  373   2HE   LYS  48          2HE       LYS  48   4.938  -3.138  10.238
  374   1HZ   LYS  48          1HZ       LYS  48   3.682  -4.859  12.140
  375   2HZ   LYS  48          2HZ       LYS  48   5.172  -5.483  11.612
  376   3HZ   LYS  48          3HZ       LYS  48   5.093  -3.929  12.294
  377    H    THR  49           H        THR  49   1.391  -3.573   4.444
  378    HA   THR  49           HA       THR  49   3.795  -3.572   2.755
  379    HB   THR  49           HB       THR  49   2.495  -6.255   3.233
  380    HG1  THR  49           HG1      THR  49   3.358  -6.217   5.132
  381   1HG2  THR  49          1HG2      THR  49   3.987  -5.794   1.242
  382   2HG2  THR  49          2HG2      THR  49   5.300  -5.506   2.383
  383   3HG2  THR  49          3HG2      THR  49   4.544  -7.096   2.292
  384    H    VAL  50           H        VAL  50   3.313  -4.021   0.533
  385    HA   VAL  50           HA       VAL  50   0.769  -3.097  -0.364
  386    HB   VAL  50           HB       VAL  50   2.933  -4.665  -1.773
  387   1HG1  VAL  50          1HG1      VAL  50   0.406  -3.390  -2.823
  388   2HG1  VAL  50          2HG1      VAL  50   1.800  -3.693  -3.858
  389   3HG1  VAL  50          3HG1      VAL  50   0.979  -5.040  -3.070
  390   1HG2  VAL  50          1HG2      VAL  50   2.241  -1.728  -1.560
  391   2HG2  VAL  50          2HG2      VAL  50   3.753  -2.520  -1.117
  392   3HG2  VAL  50          3HG2      VAL  50   3.308  -2.357  -2.815
  393    H    GLU  51           H        GLU  51   2.087  -6.401  -0.048
  394    HA   GLU  51           HA       GLU  51  -0.119  -7.744  -1.254
  395   1HB   GLU  51          1HB       GLU  51   0.637  -9.729   0.008
  396   2HB   GLU  51          2HB       GLU  51   2.007  -8.889  -0.717
  397   1HG   GLU  51          1HG       GLU  51   2.451  -7.762   1.440
  398   2HG   GLU  51          2HG       GLU  51   1.094  -8.621   2.166
  399    H    GLY  52           H        GLY  52   0.410  -6.462   1.970
  400   1HA   GLY  52          1HA       GLY  52  -1.061  -6.244   3.788
  401   2HA   GLY  52          2HA       GLY  52  -1.974  -7.610   3.137
  402    H    VAL  53           H        VAL  53  -1.178  -4.617   1.419
  403    HA   VAL  53           HA       VAL  53  -3.716  -3.320   1.862
  404    HB   VAL  53           HB       VAL  53  -1.584  -2.985  -0.263
  405   1HG1  VAL  53          1HG1      VAL  53  -4.156  -1.468   0.208
  406   2HG1  VAL  53          2HG1      VAL  53  -2.780  -0.740  -0.620
  407   3HG1  VAL  53          3HG1      VAL  53  -3.565  -2.165  -1.301
  408   1HG2  VAL  53          1HG2      VAL  53  -2.362  -1.375   2.189
  409   2HG2  VAL  53          2HG2      VAL  53  -0.920  -2.373   2.017
  410   3HG2  VAL  53          3HG2      VAL  53  -1.106  -0.920   1.037
  411    H    LYS  54           H        LYS  54  -2.451  -5.179  -0.929
  412    HA   LYS  54           HA       LYS  54  -4.925  -5.047  -2.401
  413   1HB   LYS  54          1HB       LYS  54  -2.660  -5.526  -3.390
  414   2HB   LYS  54          2HB       LYS  54  -2.744  -7.131  -2.663
  415   1HG   LYS  54          1HG       LYS  54  -4.828  -7.587  -3.901
  416   2HG   LYS  54          2HG       LYS  54  -4.746  -5.985  -4.633
  417   1HD   LYS  54          1HD       LYS  54  -2.578  -6.564  -5.662
  418   2HD   LYS  54          2HD       LYS  54  -2.666  -8.171  -4.939
  419   1HE   LYS  54          1HE       LYS  54  -3.439  -8.199  -7.290
  420   2HE   LYS  54          2HE       LYS  54  -4.740  -8.630  -6.180
  421   1HZ   LYS  54          1HZ       LYS  54  -4.327  -5.840  -7.060
  422   2HZ   LYS  54          2HZ       LYS  54  -5.243  -6.930  -7.987
  423   3HZ   LYS  54          3HZ       LYS  54  -5.725  -6.550  -6.406
  424    H    ALA  55           H        ALA  55  -3.550  -7.496  -0.216
  425    HA   ALA  55           HA       ALA  55  -5.626  -9.437  -0.685
  426   1HB   ALA  55          1HB       ALA  55  -4.763 -10.486   1.413
  427   2HB   ALA  55          2HB       ALA  55  -3.727  -9.078   1.649
  428   3HB   ALA  55          3HB       ALA  55  -3.489 -10.123   0.247
  429    H    LEU  56           H        LEU  56  -5.378  -6.675   1.471
  430    HA   LEU  56           HA       LEU  56  -7.508  -7.481   3.239
  431   1HB   LEU  56          1HB       LEU  56  -5.789  -5.698   3.752
  432   2HB   LEU  56          2HB       LEU  56  -6.606  -4.657   2.588
  433    HG   LEU  56           HG       LEU  56  -8.749  -5.174   4.017
  434   1HD1  LEU  56          1HD1      LEU  56  -7.710  -6.933   5.421
  435   2HD1  LEU  56          2HD1      LEU  56  -6.549  -5.754   6.028
  436   3HD1  LEU  56          3HD1      LEU  56  -8.262  -5.582   6.400
  437   1HD2  LEU  56          1HD2      LEU  56  -6.477  -3.308   4.671
  438   2HD2  LEU  56          2HD2      LEU  56  -8.079  -2.941   4.030
  439   3HD2  LEU  56          3HD2      LEU  56  -7.885  -3.353   5.729
  440    H    ILE  57           H        ILE  57  -7.358  -5.501   0.302
  441    HA   ILE  57           HA       ILE  57 -10.145  -4.769   0.306
  442    HB   ILE  57           HB       ILE  57  -8.244  -5.068  -2.035
  443   1HG1  ILE  57          1HG1      ILE  57  -7.344  -3.463  -0.437
  444   2HG1  ILE  57          2HG1      ILE  57  -8.002  -2.578  -1.807
  445   1HG2  ILE  57          1HG2      ILE  57 -10.942  -3.760  -1.724
  446   2HG2  ILE  57          2HG2      ILE  57  -9.837  -3.340  -3.034
  447   3HG2  ILE  57          3HG2      ILE  57 -10.446  -4.988  -2.886
  448   1HD1  ILE  57          1HD1      ILE  57 -10.190  -2.491  -0.339
  449   2HD1  ILE  57          2HD1      ILE  57  -9.076  -2.812   0.989
  450   3HD1  ILE  57          3HD1      ILE  57  -8.868  -1.374  -0.006
  451    H    ASP  58           H        ASP  58  -8.312  -7.492  -1.012
  452    HA   ASP  58           HA       ASP  58 -10.409  -8.629  -2.575
  453   1HB   ASP  58          1HB       ASP  58  -8.108  -9.922  -1.085
  454   2HB   ASP  58          2HB       ASP  58  -9.176 -10.808  -2.175
  455    H    GLU  59           H        GLU  59  -9.621  -8.971   0.874
  456    HA   GLU  59           HA       GLU  59 -11.685 -10.925   1.395
  457   1HB   GLU  59          1HB       GLU  59 -10.173  -9.016   3.203
  458   2HB   GLU  59          2HB       GLU  59 -11.329 -10.208   3.800
  459   1HG   GLU  59          1HG       GLU  59  -8.934 -10.911   2.083
  460   2HG   GLU  59          2HG       GLU  59  -8.930 -10.990   3.845
  461    H    ILE  60           H        ILE  60 -11.467  -7.398   1.582
  462    HA   ILE  60           HA       ILE  60 -14.080  -7.031   2.711
  463    HB   ILE  60           HB       ILE  60 -12.308  -5.156   1.125
  464   1HG1  ILE  60          1HG1      ILE  60 -12.883  -5.260   4.098
  465   2HG1  ILE  60          2HG1      ILE  60 -11.496  -6.060   3.359
  466   1HG2  ILE  60          1HG2      ILE  60 -14.899  -4.711   2.621
  467   2HG2  ILE  60          2HG2      ILE  60 -13.772  -3.401   2.275
  468   3HG2  ILE  60          3HG2      ILE  60 -14.527  -4.286   0.951
  469   1HD1  ILE  60          1HD1      ILE  60 -12.067  -3.116   2.963
  470   2HD1  ILE  60          2HD1      ILE  60 -11.069  -3.716   4.288
  471   3HD1  ILE  60          3HD1      ILE  60 -10.572  -3.987   2.617
  472    H    LEU  61           H        LEU  61 -12.861  -6.955  -0.644
  473    HA   LEU  61           HA       LEU  61 -15.448  -6.325  -1.771
  474   1HB   LEU  61          1HB       LEU  61 -12.945  -7.530  -2.992
  475   2HB   LEU  61          2HB       LEU  61 -14.388  -7.153  -3.930
  476    HG   LEU  61           HG       LEU  61 -12.726  -5.174  -2.335
  477   1HD1  LEU  61          1HD1      LEU  61 -11.744  -6.086  -4.481
  478   2HD1  LEU  61          2HD1      LEU  61 -13.132  -5.408  -5.330
  479   3HD1  LEU  61          3HD1      LEU  61 -12.009  -4.340  -4.488
  480   1HD2  LEU  61          1HD2      LEU  61 -15.370  -4.954  -3.758
  481   2HD2  LEU  61          2HD2      LEU  61 -14.824  -4.161  -2.280
  482   3HD2  LEU  61          3HD2      LEU  61 -14.262  -3.583  -3.846
  483    H    ALA  62           H        ALA  62 -13.744  -9.327  -1.037
  484    HA   ALA  62           HA       ALA  62 -15.481 -11.118  -2.405
  485   1HB   ALA  62          1HB       ALA  62 -14.001 -11.553   0.209
  486   2HB   ALA  62          2HB       ALA  62 -14.653 -12.822  -0.827
  487   3HB   ALA  62          3HB       ALA  62 -13.328 -11.809  -1.400
  488    H    ALA  63           H        ALA  63 -15.706  -9.682   0.843
  489    HA   ALA  63           HA       ALA  63 -18.044 -11.178   1.624
  490   1HB   ALA  63          1HB       ALA  63 -18.219  -9.578   3.453
  491   2HB   ALA  63          2HB       ALA  63 -16.523 -10.006   3.226
  492   3HB   ALA  63          3HB       ALA  63 -17.131  -8.464   2.623
  493    H    LEU  64           H        LEU  64 -17.883  -9.351  -0.969
  494    HA   LEU  64           HA       LEU  64 -20.648  -8.227  -0.631
  495   1HB   LEU  64          1HB       LEU  64 -18.352  -6.985  -2.177
  496   2HB   LEU  64          2HB       LEU  64 -19.993  -6.351  -2.084
  497    HG   LEU  64           HG       LEU  64 -18.187  -6.769   0.318
  498   1HD1  LEU  64          1HD1      LEU  64 -17.306  -5.027  -1.193
  499   2HD1  LEU  64          2HD1      LEU  64 -18.878  -4.226  -1.187
  500   3HD1  LEU  64          3HD1      LEU  64 -17.926  -4.316   0.295
  501   1HD2  LEU  64          1HD2      LEU  64 -20.962  -5.644  -0.088
  502   2HD2  LEU  64          2HD2      LEU  64 -20.391  -6.769   1.144
  503   3HD2  LEU  64          3HD2      LEU  64 -19.964  -5.064   1.243
  504    HA   PRO  65           HA       PRO  65 -20.325 -11.049  -4.320
  505   1HB   PRO  65          1HB       PRO  65 -22.694 -12.429  -3.661
  506   2HB   PRO  65          2HB       PRO  65 -21.047 -12.972  -3.323
  507   1HG   PRO  65          1HG       PRO  65 -23.069 -11.984  -1.447
  508   2HG   PRO  65          2HG       PRO  65 -21.544 -12.808  -1.103
  509   1HD   PRO  65          1HD       PRO  65 -22.128  -9.999  -0.792
  510   2HD   PRO  65          2HD       PRO  65 -20.573 -10.817  -0.511

  No H/Q in entry =         510
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1  31.633 -13.584  -7.996
    2    H2   MET   1           H2       MET   1  33.195 -13.018  -7.641
    3    H3   MET   1           H3       MET   1  32.541 -12.793  -9.191
    4    HA   MET   1           HA       MET   1  32.662 -15.075  -9.703
    5   1HB   MET   1          1HB       MET   1  35.133 -14.093  -8.245
    6   2HB   MET   1          2HB       MET   1  35.105 -15.532  -9.268
    7   1HG   MET   1          1HG       MET   1  34.413 -14.202 -11.194
    8   2HG   MET   1          2HG       MET   1  34.303 -12.758 -10.191
    9   1HE   MET   1          1HE       MET   1  35.592 -11.673 -12.007
   10   2HE   MET   1          2HE       MET   1  37.306 -11.884 -12.365
   11   3HE   MET   1          3HE       MET   1  36.123 -13.062 -12.955
   12    H    LYS   2           H        LYS   2  34.160 -17.092  -8.566
   13    HA   LYS   2           HA       LYS   2  32.365 -17.960  -6.422
   14   1HB   LYS   2          1HB       LYS   2  34.105 -19.991  -6.501
   15   2HB   LYS   2          2HB       LYS   2  32.873 -19.796  -7.742
   16   1HG   LYS   2          1HG       LYS   2  35.103 -20.234  -8.718
   17   2HG   LYS   2          2HG       LYS   2  34.477 -18.664  -9.206
   18   1HD   LYS   2          1HD       LYS   2  35.947 -17.492  -7.787
   19   2HD   LYS   2          2HD       LYS   2  36.251 -18.904  -6.775
   20   1HE   LYS   2          1HE       LYS   2  38.207 -18.499  -8.162
   21   2HE   LYS   2          2HE       LYS   2  37.419 -19.975  -8.720
   22   1HZ   LYS   2          1HZ       LYS   2  36.487 -17.533  -9.963
   23   2HZ   LYS   2          2HZ       LYS   2  38.096 -17.938 -10.312
   24   3HZ   LYS   2          3HZ       LYS   2  36.850 -19.039 -10.659
   25    H    ALA   3           H        ALA   3  35.254 -16.206  -6.523
   26    HA   ALA   3           HA       ALA   3  36.571 -17.186  -4.166
   27   1HB   ALA   3          1HB       ALA   3  37.698 -14.982  -4.150
   28   2HB   ALA   3          2HB       ALA   3  37.678 -15.672  -5.774
   29   3HB   ALA   3          3HB       ALA   3  36.547 -14.389  -5.346
   30    H    ILE   4           H        ILE   4  34.296 -14.485  -4.657
   31    HA   ILE   4           HA       ILE   4  33.628 -14.579  -1.728
   32    HB   ILE   4           HB       ILE   4  33.582 -12.193  -3.603
   33   1HG1  ILE   4          1HG1      ILE   4  35.366 -12.719  -1.209
   34   2HG1  ILE   4          2HG1      ILE   4  35.861 -13.040  -2.870
   35   1HG2  ILE   4          1HG2      ILE   4  32.937 -12.513  -0.659
   36   2HG2  ILE   4          2HG2      ILE   4  33.158 -10.953  -1.452
   37   3HG2  ILE   4          3HG2      ILE   4  31.832 -12.010  -1.938
   38   1HD1  ILE   4          1HD1      ILE   4  34.805 -10.327  -2.070
   39   2HD1  ILE   4          2HD1      ILE   4  36.501 -10.746  -1.837
   40   3HD1  ILE   4          3HD1      ILE   4  35.807 -10.756  -3.457
   41    H    PHE   5           H        PHE   5  31.506 -15.006  -1.292
   42    HA   PHE   5           HA       PHE   5  29.492 -14.640  -3.497
   43   1HB   PHE   5          1HB       PHE   5  30.206 -17.046  -3.075
   44   2HB   PHE   5          2HB       PHE   5  29.492 -16.891  -1.472
   45    HD1  PHE   5           HD1      PHE   5  27.110 -16.916  -1.156
   46    HD2  PHE   5           HD2      PHE   5  28.782 -16.810  -5.112
   47    HE1  PHE   5           HE1      PHE   5  24.878 -17.416  -2.114
   48    HE2  PHE   5           HE2      PHE   5  26.550 -17.308  -6.069
   49    HZ   PHE   5           HZ       PHE   5  24.598 -17.613  -4.570
   50    H    VAL   6           H        VAL   6  28.576 -12.755  -2.659
   51    HA   VAL   6           HA       VAL   6  26.964 -13.094  -0.191
   52    HB   VAL   6           HB       VAL   6  28.873 -10.764  -0.594
   53   1HG1  VAL   6          1HG1      VAL   6  26.755 -11.389   1.474
   54   2HG1  VAL   6          2HG1      VAL   6  28.057 -10.240   1.777
   55   3HG1  VAL   6          3HG1      VAL   6  26.905  -9.943   0.477
   56   1HG2  VAL   6          1HG2      VAL   6  28.861 -13.092   1.349
   57   2HG2  VAL   6          2HG2      VAL   6  30.102 -12.707   0.155
   58   3HG2  VAL   6          3HG2      VAL   6  29.865 -11.656   1.552
   59    H    LEU   7           H        LEU   7  27.513 -11.825  -3.294
   60    HA   LEU   7           HA       LEU   7  25.627  -9.641  -3.258
   61   1HB   LEU   7          1HB       LEU   7  26.904 -11.293  -5.445
   62   2HB   LEU   7          2HB       LEU   7  25.684 -10.075  -5.815
   63    HG   LEU   7           HG       LEU   7  27.080  -8.386  -4.581
   64   1HD1  LEU   7          1HD1      LEU   7  28.919 -10.775  -4.387
   65   2HD1  LEU   7          2HD1      LEU   7  29.541  -9.126  -4.302
   66   3HD1  LEU   7          3HD1      LEU   7  28.387  -9.697  -3.097
   67   1HD2  LEU   7          1HD2      LEU   7  27.260  -9.029  -7.155
   68   2HD2  LEU   7          2HD2      LEU   7  28.420  -7.920  -6.435
   69   3HD2  LEU   7          3HD2      LEU   7  28.855  -9.610  -6.684
   70    H    ASN   8           H        ASN   8  25.289 -13.058  -3.332
   71    HA   ASN   8           HA       ASN   8  22.970 -13.517  -4.812
   72   1HB   ASN   8          1HB       ASN   8  24.322 -15.214  -3.506
   73   2HB   ASN   8          2HB       ASN   8  23.466 -14.679  -2.061
   74   2HD2  ASN   8          2HD2      ASN   8  21.723 -16.021  -1.603
   75   1HD2  ASN   8          1HD2      ASN   8  20.750 -16.792  -2.761
   76    H    ALA   9           H        ALA   9  20.843 -13.000  -4.593
   77    HA   ALA   9           HA       ALA   9  19.961 -11.603  -2.083
   78   1HB   ALA   9          1HB       ALA   9  18.533 -10.190  -3.488
   79   2HB   ALA   9          2HB       ALA   9  20.213 -10.046  -4.004
   80   3HB   ALA   9          3HB       ALA   9  19.088 -11.036  -4.934
   81    H    GLN  10           H        GLN  10  18.002 -12.257  -1.255
   82    HA   GLN  10           HA       GLN  10  16.920 -14.790  -2.142
   83   1HB   GLN  10          1HB       GLN  10  16.870 -14.087   0.228
   84   2HB   GLN  10          2HB       GLN  10  15.796 -12.753  -0.189
   85   1HG   GLN  10          1HG       GLN  10  14.085 -14.337  -0.953
   86   2HG   GLN  10          2HG       GLN  10  15.165 -15.691  -0.611
   87   2HE2  GLN  10          2HE2      GLN  10  12.747 -15.707   0.740
   88   1HE2  GLN  10          1HE2      GLN  10  12.972 -15.292   2.371
   89    H    HIS  11           H        HIS  11  14.889 -15.159  -3.172
   90    HA   HIS  11           HA       HIS  11  14.136 -13.246  -5.159
   91   1HB   HIS  11          1HB       HIS  11  13.701 -15.678  -5.373
   92   2HB   HIS  11          2HB       HIS  11  12.522 -15.573  -4.065
   93    HD1  HIS  11           HD1      HIS  11  10.272 -14.386  -4.564
   94    HD2  HIS  11           HD2      HIS  11  12.839 -14.549  -7.844
   95    HE1  HIS  11           HE1      HIS  11   8.898 -13.714  -6.583
   96    H    ASP  12           H        ASP  12  13.563 -11.256  -4.276
   97    HA   ASP  12           HA       ASP  12  10.905 -11.134  -2.998
   98   1HB   ASP  12          1HB       ASP  12  12.562 -11.337  -1.120
   99   2HB   ASP  12          2HB       ASP  12  13.327  -9.852  -1.690
  100    H    GLU  13           H        GLU  13   9.848  -9.236  -3.551
  101    HA   GLU  13           HA       GLU  13  11.081  -7.602  -5.634
  102   1HB   GLU  13          1HB       GLU  13   8.393  -7.478  -4.237
  103   2HB   GLU  13          2HB       GLU  13   8.868  -6.382  -5.535
  104   1HG   GLU  13          1HG       GLU  13   9.218  -8.309  -7.039
  105   2HG   GLU  13          2HG       GLU  13   8.741  -9.407  -5.743
  106    H    ALA  14           H        ALA  14  12.100  -5.670  -5.322
  107    HA   ALA  14           HA       ALA  14  12.551  -4.676  -2.634
  108   1HB   ALA  14          1HB       ALA  14  14.309  -4.337  -4.223
  109   2HB   ALA  14          2HB       ALA  14  13.632  -2.742  -3.916
  110   3HB   ALA  14          3HB       ALA  14  13.207  -3.610  -5.390
  111    H    VAL  15           H        VAL  15  11.520  -2.966  -1.595
  112    HA   VAL  15           HA       VAL  15   9.106  -1.842  -2.963
  113    HB   VAL  15           HB       VAL  15   8.295  -1.304  -0.746
  114   1HG1  VAL  15          1HG1      VAL  15   8.152  -3.687  -1.605
  115   2HG1  VAL  15          2HG1      VAL  15   9.551  -4.055  -0.595
  116   3HG1  VAL  15          3HG1      VAL  15   8.043  -3.520   0.148
  117   1HG2  VAL  15          1HG2      VAL  15  11.112  -2.033   0.072
  118   2HG2  VAL  15          2HG2      VAL  15  10.201  -0.571   0.449
  119   3HG2  VAL  15          3HG2      VAL  15   9.788  -2.094   1.234
  120    H    ASP  16           H        ASP  16   9.131   0.255  -3.590
  121    HA   ASP  16           HA       ASP  16  11.438   1.962  -2.756
  122   1HB   ASP  16          1HB       ASP  16  10.942   3.297  -4.714
  123   2HB   ASP  16          2HB       ASP  16  10.964   1.604  -5.203
  124    H    ALA  17           H        ALA  17  10.805   4.380  -2.565
  125    HA   ALA  17           HA       ALA  17   8.588   4.542  -0.623
  126   1HB   ALA  17          1HB       ALA  17  10.688   5.687  -0.093
  127   2HB   ALA  17          2HB       ALA  17  10.578   6.626  -1.583
  128   3HB   ALA  17          3HB       ALA  17   9.398   6.872  -0.294
  129    H    ASN  18           H        ASN  18   7.277   3.959  -2.797
  130    HA   ASN  18           HA       ASN  18   5.812   6.384  -3.455
  131   1HB   ASN  18          1HB       ASN  18   7.789   6.454  -5.027
  132   2HB   ASN  18          2HB       ASN  18   7.200   4.948  -5.733
  133   2HD2  ASN  18          2HD2      ASN  18   4.595   6.886  -4.653
  134   1HD2  ASN  18          1HD2      ASN  18   4.184   7.577  -6.147
  135    H    SER  19           H        SER  19   6.444   3.069  -4.656
  136    HA   SER  19           HA       SER  19   3.772   2.593  -5.542
  137   1HB   SER  19          1HB       SER  19   4.395   0.260  -5.639
  138   2HB   SER  19          2HB       SER  19   5.791   1.209  -6.138
  139    HG   SER  19           HG       SER  19   5.699  -0.564  -4.235
  140    H    LEU  20           H        LEU  20   5.352   2.047  -2.403
  141    HA   LEU  20           HA       LEU  20   3.232   0.608  -1.172
  142   1HB   LEU  20          1HB       LEU  20   5.391   0.744  -0.084
  143   2HB   LEU  20          2HB       LEU  20   5.290   2.500   0.003
  144    HG   LEU  20           HG       LEU  20   3.423   2.361   1.575
  145   1HD1  LEU  20          1HD1      LEU  20   3.598  -0.583   0.927
  146   2HD1  LEU  20          2HD1      LEU  20   2.884  -0.032   2.441
  147   3HD1  LEU  20          3HD1      LEU  20   2.181   0.465   0.904
  148   1HD2  LEU  20          1HD2      LEU  20   5.718   0.507   2.283
  149   2HD2  LEU  20          2HD2      LEU  20   5.657   2.250   2.546
  150   3HD2  LEU  20          3HD2      LEU  20   4.581   1.185   3.450
  151    H    ALA  21           H        ALA  21   3.880   4.135  -1.170
  152    HA   ALA  21           HA       ALA  21   1.457   4.757   0.242
  153   1HB   ALA  21          1HB       ALA  21   3.086   6.548  -1.580
  154   2HB   ALA  21          2HB       ALA  21   3.432   6.282   0.129
  155   3HB   ALA  21          3HB       ALA  21   1.933   7.076  -0.356
  156    H    GLU  22           H        GLU  22   2.332   4.717  -3.201
  157    HA   GLU  22           HA       GLU  22  -0.101   5.787  -4.204
  158   1HB   GLU  22          1HB       GLU  22   1.959   5.432  -5.568
  159   2HB   GLU  22          2HB       GLU  22   1.659   3.695  -5.514
  160   1HG   GLU  22          1HG       GLU  22  -0.519   4.026  -6.614
  161   2HG   GLU  22          2HG       GLU  22  -0.234   5.764  -6.667
  162    H    ALA  23           H        ALA  23   0.791   2.444  -3.384
  163    HA   ALA  23           HA       ALA  23  -1.526   1.174  -4.427
  164   1HB   ALA  23          1HB       ALA  23   0.003   0.405  -1.923
  165   2HB   ALA  23          2HB       ALA  23   0.496  -0.017  -3.563
  166   3HB   ALA  23          3HB       ALA  23  -1.008  -0.657  -2.903
  167    H    LYS  24           H        LYS  24  -0.942   2.577  -1.189
  168    HA   LYS  24           HA       LYS  24  -3.584   1.918  -0.217
  169   1HB   LYS  24          1HB       LYS  24  -1.530   3.956   0.680
  170   2HB   LYS  24          2HB       LYS  24  -3.044   3.663   1.539
  171   1HG   LYS  24          1HG       LYS  24  -2.416   1.243   1.704
  172   2HG   LYS  24          2HG       LYS  24  -0.851   1.638   1.003
  173   1HD   LYS  24          1HD       LYS  24  -1.954   2.891   3.537
  174   2HD   LYS  24          2HD       LYS  24  -0.830   1.536   3.513
  175   1HE   LYS  24          1HE       LYS  24  -0.351   4.381   2.625
  176   2HE   LYS  24          2HE       LYS  24   0.550   3.431   3.803
  177   1HZ   LYS  24          1HZ       LYS  24   1.177   1.936   1.928
  178   2HZ   LYS  24          2HZ       LYS  24   0.505   3.075   0.861
  179   3HZ   LYS  24          3HZ       LYS  24   1.828   3.502   1.832
  180    H    VAL  25           H        VAL  25  -2.156   4.787  -1.768
  181    HA   VAL  25           HA       VAL  25  -4.449   6.471  -1.512
  182    HB   VAL  25           HB       VAL  25  -2.237   6.410  -3.573
  183   1HG1  VAL  25          1HG1      VAL  25  -4.472   8.411  -3.158
  184   2HG1  VAL  25          2HG1      VAL  25  -3.003   8.770  -4.066
  185   3HG1  VAL  25          3HG1      VAL  25  -4.102   7.514  -4.633
  186   1HG2  VAL  25          1HG2      VAL  25  -1.662   6.945  -1.182
  187   2HG2  VAL  25          2HG2      VAL  25  -1.339   8.270  -2.299
  188   3HG2  VAL  25          3HG2      VAL  25  -2.773   8.311  -1.274
  189    H    LEU  26           H        LEU  26  -3.412   4.344  -4.206
  190    HA   LEU  26           HA       LEU  26  -5.730   4.817  -5.821
  191   1HB   LEU  26          1HB       LEU  26  -3.837   2.451  -5.683
  192   2HB   LEU  26          2HB       LEU  26  -5.111   2.600  -6.889
  193    HG   LEU  26           HG       LEU  26  -2.895   4.628  -6.469
  194   1HD1  LEU  26          1HD1      LEU  26  -2.127   2.392  -7.316
  195   2HD1  LEU  26          2HD1      LEU  26  -3.224   2.581  -8.683
  196   3HD1  LEU  26          3HD1      LEU  26  -1.878   3.700  -8.473
  197   1HD2  LEU  26          1HD2      LEU  26  -5.253   4.428  -8.336
  198   2HD2  LEU  26          2HD2      LEU  26  -4.587   5.846  -7.525
  199   3HD2  LEU  26          3HD2      LEU  26  -3.768   5.170  -8.929
  200    H    ALA  27           H        ALA  27  -5.022   2.413  -3.312
  201    HA   ALA  27           HA       ALA  27  -7.490   0.959  -3.646
  202   1HB   ALA  27          1HB       ALA  27  -5.412   0.113  -2.467
  203   2HB   ALA  27          2HB       ALA  27  -5.836   1.166  -1.118
  204   3HB   ALA  27          3HB       ALA  27  -6.917  -0.145  -1.589
  205    H    ASN  28           H        ASN  28  -6.529   3.733  -1.679
  206    HA   ASN  28           HA       ASN  28  -8.798   3.846   0.038
  207   1HB   ASN  28          1HB       ASN  28  -6.721   5.234   0.271
  208   2HB   ASN  28          2HB       ASN  28  -7.258   6.194  -1.109
  209   2HD2  ASN  28          2HD2      ASN  28  -7.938   5.432   2.282
  210   1HD2  ASN  28          1HD2      ASN  28  -9.043   6.694   2.527
  211    H    ARG  29           H        ARG  29  -8.294   5.144  -3.242
  212    HA   ARG  29           HA       ARG  29 -10.820   6.524  -3.361
  213   1HB   ARG  29          1HB       ARG  29  -8.957   5.522  -5.525
  214   2HB   ARG  29          2HB       ARG  29 -10.413   6.460  -5.860
  215   1HG   ARG  29          1HG       ARG  29  -9.526   8.233  -4.292
  216   2HG   ARG  29          2HG       ARG  29  -8.013   7.329  -4.229
  217   1HD   ARG  29          1HD       ARG  29  -9.306   8.544  -6.686
  218   2HD   ARG  29          2HD       ARG  29  -7.792   9.040  -5.929
  219    HE   ARG  29           HE       ARG  29  -7.356   6.384  -6.557
  220   1HH1  ARG  29          1HH1      ARG  29  -6.499   5.725  -8.545
  221   2HH1  ARG  29          2HH1      ARG  29  -6.695   6.740  -9.935
  222   1HH2  ARG  29          1HH2      ARG  29  -8.455   9.192  -8.228
  223   2HH2  ARG  29          2HH2      ARG  29  -7.804   8.701  -9.756
  224    H    GLU  30           H        GLU  30  -9.838   3.213  -4.199
  225    HA   GLU  30           HA       GLU  30 -12.177   2.503  -5.647
  226   1HB   GLU  30          1HB       GLU  30 -10.342   0.836  -3.913
  227   2HB   GLU  30          2HB       GLU  30 -11.639   0.146  -4.891
  228   1HG   GLU  30          1HG       GLU  30 -10.656   0.964  -6.918
  229   2HG   GLU  30          2HG       GLU  30  -9.475   1.927  -6.030
  230    H    LEU  31           H        LEU  31 -11.566   2.389  -2.139
  231    HA   LEU  31           HA       LEU  31 -14.135   1.195  -1.547
  232   1HB   LEU  31          1HB       LEU  31 -12.634   2.986   0.372
  233   2HB   LEU  31          2HB       LEU  31 -13.611   1.558   0.724
  234    HG   LEU  31           HG       LEU  31 -10.925   1.622  -0.655
  235   1HD1  LEU  31          1HD1      LEU  31 -10.900   1.869   1.819
  236   2HD1  LEU  31          2HD1      LEU  31 -11.818   0.369   1.959
  237   3HD1  LEU  31          3HD1      LEU  31 -10.183   0.344   1.301
  238   1HD2  LEU  31          1HD2      LEU  31 -12.914  -0.615  -0.201
  239   2HD2  LEU  31          2HD2      LEU  31 -12.181  -0.111  -1.724
  240   3HD2  LEU  31          3HD2      LEU  31 -11.203  -0.925  -0.502
  241    H    ASP  32           H        ASP  32 -12.972   4.405  -2.149
  242    HA   ASP  32           HA       ASP  32 -15.043   5.933  -0.968
  243   1HB   ASP  32          1HB       ASP  32 -12.846   6.725  -2.008
  244   2HB   ASP  32          2HB       ASP  32 -13.669   6.620  -3.565
  245    H    LYS  33           H        LYS  33 -14.863   4.466  -4.252
  246    HA   LYS  33           HA       LYS  33 -17.439   5.551  -5.018
  247   1HB   LYS  33          1HB       LYS  33 -17.338   3.681  -6.783
  248   2HB   LYS  33          2HB       LYS  33 -16.062   4.895  -6.834
  249   1HG   LYS  33          1HG       LYS  33 -14.522   3.419  -5.691
  250   2HG   LYS  33          2HG       LYS  33 -15.798   2.238  -5.405
  251   1HD   LYS  33          1HD       LYS  33 -14.628   1.382  -7.278
  252   2HD   LYS  33          2HD       LYS  33 -16.054   2.150  -7.971
  253   1HE   LYS  33          1HE       LYS  33 -14.790   4.097  -8.613
  254   2HE   LYS  33          2HE       LYS  33 -13.381   3.554  -7.703
  255   1HZ   LYS  33          1HZ       LYS  33 -14.412   1.708  -9.694
  256   2HZ   LYS  33          2HZ       LYS  33 -13.693   3.124 -10.298
  257   3HZ   LYS  33          3HZ       LYS  33 -12.806   2.088  -9.288
  258    H    TYR  34           H        TYR  34 -16.371   2.478  -3.591
  259    HA   TYR  34           HA       TYR  34 -19.013   1.302  -3.596
  260   1HB   TYR  34          1HB       TYR  34 -16.512   0.666  -2.008
  261   2HB   TYR  34          2HB       TYR  34 -17.999  -0.274  -1.883
  262    HD1  TYR  34           HD1      TYR  34 -19.060  -0.908  -4.288
  263    HD2  TYR  34           HD2      TYR  34 -14.902  -0.111  -3.536
  264    HE1  TYR  34           HE1      TYR  34 -18.446  -2.166  -6.330
  265    HE2  TYR  34           HE2      TYR  34 -14.295  -1.367  -5.580
  266    HH   TYR  34           HH       TYR  34 -16.106  -1.967  -7.978
  267    H    GLY  35           H        GLY  35 -17.254   3.418  -1.419
  268   1HA   GLY  35          1HA       GLY  35 -19.758   3.858   0.109
  269   2HA   GLY  35          2HA       GLY  35 -18.315   4.869   0.170
  270    H    VAL  36           H        VAL  36 -17.398   1.643   0.365
  271    HA   VAL  36           HA       VAL  36 -17.782   1.389   3.280
  272    HB   VAL  36           HB       VAL  36 -16.799  -0.817   2.992
  273   1HG1  VAL  36          1HG1      VAL  36 -18.697  -0.113   0.738
  274   2HG1  VAL  36          2HG1      VAL  36 -18.365  -1.747   1.308
  275   3HG1  VAL  36          3HG1      VAL  36 -19.156  -0.588   2.372
  276   1HG2  VAL  36          1HG2      VAL  36 -16.086   0.255   0.259
  277   2HG2  VAL  36          2HG2      VAL  36 -15.010  -0.443   1.467
  278   3HG2  VAL  36          3HG2      VAL  36 -16.140  -1.476   0.592
  279    H    SER  37           H        SER  37 -16.063   3.544   2.183
  280    HA   SER  37           HA       SER  37 -13.300   2.747   2.703
  281   1HB   SER  37          1HB       SER  37 -14.278   5.599   2.599
  282   2HB   SER  37          2HB       SER  37 -12.717   4.948   2.105
  283    HG   SER  37           HG       SER  37 -15.158   4.993   0.786
  284    H    ASP  38           H        ASP  38 -15.197   5.338   4.191
  285    HA   ASP  38           HA       ASP  38 -14.303   6.347   6.288
  286   1HB   ASP  38          1HB       ASP  38 -16.548   4.355   6.608
  287   2HB   ASP  38          2HB       ASP  38 -16.092   5.493   7.875
  288    H    TYR  39           H        TYR  39 -15.314   3.448   7.887
  289    HA   TYR  39           HA       TYR  39 -13.068   3.433   9.615
  290   1HB   TYR  39          1HB       TYR  39 -15.149   2.339  10.230
  291   2HB   TYR  39          2HB       TYR  39 -14.979   1.195   8.899
  292    HD1  TYR  39           HD1      TYR  39 -13.748   2.163  12.233
  293    HD2  TYR  39           HD2      TYR  39 -13.308  -0.572   8.953
  294    HE1  TYR  39           HE1      TYR  39 -12.370   0.674  13.660
  295    HE2  TYR  39           HE2      TYR  39 -11.934  -2.059  10.374
  296    HH   TYR  39           HH       TYR  39 -10.842  -1.077  13.551
  297    H    TYR  40           H        TYR  40 -13.707   1.355   6.777
  298    HA   TYR  40           HA       TYR  40 -11.306  -0.168   7.008
  299   1HB   TYR  40          1HB       TYR  40 -12.941   0.486   4.546
  300   2HB   TYR  40          2HB       TYR  40 -11.701  -0.762   4.632
  301    HD1  TYR  40           HD1      TYR  40 -15.075   0.233   5.718
  302    HD2  TYR  40           HD2      TYR  40 -12.047  -2.807   5.930
  303    HE1  TYR  40           HE1      TYR  40 -16.735  -1.356   6.651
  304    HE2  TYR  40           HE2      TYR  40 -13.707  -4.395   6.864
  305    HH   TYR  40           HH       TYR  40 -16.041  -4.006   8.261
  306    H    LYS  41           H        LYS  41 -11.795   3.088   5.834
  307    HA   LYS  41           HA       LYS  41  -9.494   3.138   4.098
  308   1HB   LYS  41          1HB       LYS  41 -10.092   5.322   3.698
  309   2HB   LYS  41          2HB       LYS  41 -11.581   4.849   4.505
  310   1HG   LYS  41          1HG       LYS  41 -10.550   5.643   6.681
  311   2HG   LYS  41          2HG       LYS  41  -9.215   6.297   5.740
  312   1HD   LYS  41          1HD       LYS  41 -12.075   7.026   5.097
  313   2HD   LYS  41          2HD       LYS  41 -11.174   7.885   6.342
  314   1HE   LYS  41          1HE       LYS  41 -10.296   7.570   3.455
  315   2HE   LYS  41          2HE       LYS  41 -10.995   9.025   4.158
  316   1HZ   LYS  41          1HZ       LYS  41  -8.880   8.162   5.784
  317   2HZ   LYS  41          2HZ       LYS  41  -8.326   8.225   4.180
  318   3HZ   LYS  41          3HZ       LYS  41  -9.011   9.604   4.900
  319    H    ASN  42           H        ASN  42 -10.019   3.889   7.509
  320    HA   ASN  42           HA       ASN  42  -7.361   4.841   8.005
  321   1HB   ASN  42          1HB       ASN  42  -9.357   5.196   9.516
  322   2HB   ASN  42          2HB       ASN  42  -9.204   3.507  10.003
  323   2HD2  ASN  42          2HD2      ASN  42  -8.663   4.240  12.227
  324   1HD2  ASN  42          1HD2      ASN  42  -7.115   4.843  12.571
  325    H    LEU  43           H        LEU  43  -8.870   1.647   8.153
  326    HA   LEU  43           HA       LEU  43  -6.715   0.255   9.369
  327   1HB   LEU  43          1HB       LEU  43  -8.955  -0.728   9.044
  328   2HB   LEU  43          2HB       LEU  43  -8.705  -0.733   7.301
  329    HG   LEU  43           HG       LEU  43  -6.798  -2.276   7.570
  330   1HD1  LEU  43          1HD1      LEU  43  -7.405  -1.836  10.489
  331   2HD1  LEU  43          2HD1      LEU  43  -6.712  -3.372   9.968
  332   3HD1  LEU  43          3HD1      LEU  43  -5.844  -1.869   9.670
  333   1HD2  LEU  43          1HD2      LEU  43  -9.222  -3.056   7.373
  334   2HD2  LEU  43          2HD2      LEU  43  -8.099  -4.230   8.061
  335   3HD2  LEU  43          3HD2      LEU  43  -9.183  -3.323   9.116
  336    H    ILE  44           H        ILE  44  -7.338   1.057   5.951
  337    HA   ILE  44           HA       ILE  44  -5.137  -0.405   4.867
  338    HB   ILE  44           HB       ILE  44  -6.455   2.165   3.932
  339   1HG1  ILE  44          1HG1      ILE  44  -7.743  -0.119   4.083
  340   2HG1  ILE  44          2HG1      ILE  44  -7.866   0.838   2.612
  341   1HG2  ILE  44          1HG2      ILE  44  -4.384   0.398   2.631
  342   2HG2  ILE  44          2HG2      ILE  44  -5.429   1.463   1.692
  343   3HG2  ILE  44          3HG2      ILE  44  -4.326   2.142   2.889
  344   1HD1  ILE  44          1HD1      ILE  44  -5.804  -1.360   2.925
  345   2HD1  ILE  44          2HD1      ILE  44  -7.420  -1.663   2.296
  346   3HD1  ILE  44          3HD1      ILE  44  -6.331  -0.568   1.446
  347    H    ASN  45           H        ASN  45  -5.390   2.891   6.148
  348    HA   ASN  45           HA       ASN  45  -2.755   3.762   5.563
  349   1HB   ASN  45          1HB       ASN  45  -4.654   5.172   6.472
  350   2HB   ASN  45          2HB       ASN  45  -4.333   4.460   8.054
  351   2HD2  ASN  45          2HD2      ASN  45  -3.805   6.832   8.617
  352   1HD2  ASN  45          1HD2      ASN  45  -2.229   7.379   8.302
  353    H    ASN  46           H        ASN  46  -3.980   1.657   8.098
  354    HA   ASN  46           HA       ASN  46  -1.426   1.683   9.567
  355   1HB   ASN  46          1HB       ASN  46  -4.000   0.123   9.909
  356   2HB   ASN  46          2HB       ASN  46  -2.592  -0.095  10.947
  357   2HD2  ASN  46          2HD2      ASN  46  -5.122   0.909  11.934
  358   1HD2  ASN  46          1HD2      ASN  46  -4.881   2.512  12.436
  359    H    ALA  47           H        ALA  47  -2.168   0.392   6.694
  360    HA   ALA  47           HA       ALA  47  -1.574  -2.384   6.891
  361   1HB   ALA  47          1HB       ALA  47  -2.435  -1.234   4.839
  362   2HB   ALA  47          2HB       ALA  47  -1.044  -2.271   4.517
  363   3HB   ALA  47          3HB       ALA  47  -0.838  -0.521   4.614
  364    H    LYS  48           H        LYS  48   0.325  -3.483   7.181
  365    HA   LYS  48           HA       LYS  48   2.864  -1.882   7.321
  366   1HB   LYS  48          1HB       LYS  48   1.997  -4.382   8.792
  367   2HB   LYS  48          2HB       LYS  48   3.649  -3.764   8.816
  368   1HG   LYS  48          1HG       LYS  48   2.823  -1.608   9.706
  369   2HG   LYS  48          2HG       LYS  48   1.179  -2.246   9.707
  370   1HD   LYS  48          1HD       LYS  48   3.498  -3.441  11.256
  371   2HD   LYS  48          2HD       LYS  48   2.263  -2.392  11.950
  372   1HE   LYS  48          1HE       LYS  48   1.348  -4.468  12.447
  373   2HE   LYS  48          2HE       LYS  48   0.617  -4.199  10.865
  374   1HZ   LYS  48          1HZ       LYS  48   3.179  -5.322  10.539
  375   2HZ   LYS  48          2HZ       LYS  48   2.297  -6.272  11.638
  376   3HZ   LYS  48          3HZ       LYS  48   1.675  -5.963  10.088
  377    H    THR  49           H        THR  49   1.225  -4.269   5.547
  378    HA   THR  49           HA       THR  49   3.797  -5.113   4.246
  379    HB   THR  49           HB       THR  49   2.753  -7.352   3.875
  380    HG1  THR  49           HG1      THR  49   0.858  -7.831   4.871
  381   1HG2  THR  49          1HG2      THR  49   4.203  -6.662   5.948
  382   2HG2  THR  49          2HG2      THR  49   2.684  -6.814   6.835
  383   3HG2  THR  49          3HG2      THR  49   3.348  -8.203   5.974
  384    H    VAL  50           H        VAL  50   3.725  -5.183   2.001
  385    HA   VAL  50           HA       VAL  50   1.678  -3.657   0.664
  386    HB   VAL  50           HB       VAL  50   3.794  -5.519  -0.423
  387   1HG1  VAL  50          1HG1      VAL  50   1.938  -3.564  -1.789
  388   2HG1  VAL  50          2HG1      VAL  50   3.428  -4.137  -2.537
  389   3HG1  VAL  50          3HG1      VAL  50   2.147  -5.281  -2.137
  390   1HG2  VAL  50          1HG2      VAL  50   4.488  -3.445   0.910
  391   2HG2  VAL  50          2HG2      VAL  50   5.139  -3.569  -0.724
  392   3HG2  VAL  50          3HG2      VAL  50   3.779  -2.498  -0.396
  393    H    GLU  51           H        GLU  51   2.379  -7.144   0.858
  394    HA   GLU  51           HA       GLU  51   0.353  -8.010  -0.947
  395   1HB   GLU  51          1HB       GLU  51   1.554  -9.342   1.499
  396   2HB   GLU  51          2HB       GLU  51   0.453 -10.161   0.391
  397   1HG   GLU  51          1HG       GLU  51   2.686 -10.702  -0.318
  398   2HG   GLU  51          2HG       GLU  51   2.042  -9.547  -1.484
  399    H    GLY  52           H        GLY  52   0.309  -7.289   2.506
  400   1HA   GLY  52          1HA       GLY  52  -1.482  -6.904   3.961
  401   2HA   GLY  52          2HA       GLY  52  -2.369  -8.110   3.028
  402    H    VAL  53           H        VAL  53  -1.019  -5.092   1.697
  403    HA   VAL  53           HA       VAL  53  -3.410  -3.537   1.905
  404    HB   VAL  53           HB       VAL  53  -1.130  -3.430  -0.086
  405   1HG1  VAL  53          1HG1      VAL  53  -3.565  -1.671   0.229
  406   2HG1  VAL  53          2HG1      VAL  53  -2.064  -1.049  -0.462
  407   3HG1  VAL  53          3HG1      VAL  53  -2.913  -2.382  -1.248
  408   1HG2  VAL  53          1HG2      VAL  53  -1.883  -1.739   2.318
  409   2HG2  VAL  53          2HG2      VAL  53  -0.561  -2.904   2.251
  410   3HG2  VAL  53          3HG2      VAL  53  -0.501  -1.444   1.263
  411    H    LYS  54           H        LYS  54  -2.232  -5.536  -0.832
  412    HA   LYS  54           HA       LYS  54  -4.684  -5.111  -2.333
  413   1HB   LYS  54          1HB       LYS  54  -3.737  -6.946  -3.804
  414   2HB   LYS  54          2HB       LYS  54  -2.700  -5.538  -3.592
  415   1HG   LYS  54          1HG       LYS  54  -1.339  -6.688  -1.969
  416   2HG   LYS  54          2HG       LYS  54  -2.463  -8.043  -1.908
  417   1HD   LYS  54          1HD       LYS  54  -0.519  -8.614  -3.296
  418   2HD   LYS  54          2HD       LYS  54  -1.979  -8.551  -4.280
  419   1HE   LYS  54          1HE       LYS  54  -0.234  -6.109  -3.995
  420   2HE   LYS  54          2HE       LYS  54   0.172  -7.368  -5.162
  421   1HZ   LYS  54          1HZ       LYS  54  -2.583  -6.746  -5.307
  422   2HZ   LYS  54          2HZ       LYS  54  -1.665  -5.327  -5.472
  423   3HZ   LYS  54          3HZ       LYS  54  -1.396  -6.634  -6.518
  424    H    ALA  55           H        ALA  55  -3.466  -7.681  -0.224
  425    HA   ALA  55           HA       ALA  55  -5.589  -9.542  -0.812
  426   1HB   ALA  55          1HB       ALA  55  -3.995  -9.367   1.755
  427   2HB   ALA  55          2HB       ALA  55  -4.771 -10.795   1.068
  428   3HB   ALA  55          3HB       ALA  55  -3.362 -10.089   0.275
  429    H    LEU  56           H        LEU  56  -5.170  -7.021   1.634
  430    HA   LEU  56           HA       LEU  56  -7.452  -7.630   3.212
  431   1HB   LEU  56          1HB       LEU  56  -5.708  -6.020   3.910
  432   2HB   LEU  56          2HB       LEU  56  -6.203  -4.926   2.621
  433    HG   LEU  56           HG       LEU  56  -8.462  -4.768   3.645
  434   1HD1  LEU  56          1HD1      LEU  56  -7.228  -6.740   5.561
  435   2HD1  LEU  56          2HD1      LEU  56  -8.459  -5.621   6.146
  436   3HD1  LEU  56          3HD1      LEU  56  -8.839  -6.743   4.843
  437   1HD2  LEU  56          1HD2      LEU  56  -6.674  -3.147   4.219
  438   2HD2  LEU  56          2HD2      LEU  56  -7.768  -3.410   5.576
  439   3HD2  LEU  56          3HD2      LEU  56  -6.183  -4.179   5.561
  440    H    ILE  57           H        ILE  57  -7.051  -5.464   0.415
  441    HA   ILE  57           HA       ILE  57  -9.770  -4.622   0.244
  442    HB   ILE  57           HB       ILE  57  -7.798  -5.035  -2.019
  443   1HG1  ILE  57          1HG1      ILE  57  -7.129  -3.508  -0.006
  444   2HG1  ILE  57          2HG1      ILE  57  -6.959  -2.865  -1.635
  445   1HG2  ILE  57          1HG2      ILE  57 -10.402  -3.537  -1.779
  446   2HG2  ILE  57          2HG2      ILE  57  -9.205  -3.114  -3.003
  447   3HG2  ILE  57          3HG2      ILE  57  -9.917  -4.725  -2.987
  448   1HD1  ILE  57          1HD1      ILE  57  -9.446  -2.393   0.033
  449   2HD1  ILE  57          2HD1      ILE  57  -8.062  -1.312   0.072
  450   3HD1  ILE  57          3HD1      ILE  57  -8.947  -1.552  -1.431
  451    H    ASP  58           H        ASP  58  -8.065  -7.452  -1.037
  452    HA   ASP  58           HA       ASP  58 -10.176  -8.406  -2.707
  453   1HB   ASP  58          1HB       ASP  58  -8.036  -9.901  -1.163
  454   2HB   ASP  58          2HB       ASP  58  -9.126 -10.678  -2.309
  455    H    GLU  59           H        GLU  59  -9.542  -8.844   0.757
  456    HA   GLU  59           HA       GLU  59 -11.764 -10.636   1.196
  457   1HB   GLU  59          1HB       GLU  59 -10.165  -8.857   3.060
  458   2HB   GLU  59          2HB       GLU  59 -11.426  -9.957   3.617
  459   1HG   GLU  59          1HG       GLU  59  -9.035 -10.834   1.974
  460   2HG   GLU  59          2HG       GLU  59  -9.103 -10.926   3.735
  461    H    ILE  60           H        ILE  60 -11.288  -7.131   1.420
  462    HA   ILE  60           HA       ILE  60 -13.903  -6.579   2.474
  463    HB   ILE  60           HB       ILE  60 -11.996  -4.809   0.925
  464   1HG1  ILE  60          1HG1      ILE  60 -12.539  -4.927   3.904
  465   2HG1  ILE  60          2HG1      ILE  60 -11.215  -5.803   3.134
  466   1HG2  ILE  60          1HG2      ILE  60 -14.542  -4.237   2.451
  467   2HG2  ILE  60          2HG2      ILE  60 -13.335  -2.991   2.139
  468   3HG2  ILE  60          3HG2      ILE  60 -14.146  -3.790   0.792
  469   1HD1  ILE  60          1HD1      ILE  60 -11.605  -2.821   2.804
  470   2HD1  ILE  60          2HD1      ILE  60 -10.612  -3.516   4.086
  471   3HD1  ILE  60          3HD1      ILE  60 -10.180  -3.777   2.396
  472    H    LEU  61           H        LEU  61 -12.569  -6.578  -0.833
  473    HA   LEU  61           HA       LEU  61 -15.061  -5.757  -2.051
  474   1HB   LEU  61          1HB       LEU  61 -12.613  -7.150  -3.182
  475   2HB   LEU  61          2HB       LEU  61 -13.987  -6.662  -4.172
  476    HG   LEU  61           HG       LEU  61 -12.239  -4.818  -2.510
  477   1HD1  LEU  61          1HD1      LEU  61 -11.224  -5.787  -4.599
  478   2HD1  LEU  61          2HD1      LEU  61 -12.539  -5.058  -5.519
  479   3HD1  LEU  61          3HD1      LEU  61 -11.399  -4.031  -4.649
  480   1HD2  LEU  61          1HD2      LEU  61 -14.804  -4.401  -4.028
  481   2HD2  LEU  61          2HD2      LEU  61 -14.250  -3.644  -2.535
  482   3HD2  LEU  61          3HD2      LEU  61 -13.593  -3.120  -4.083
  483    H    ALA  62           H        ALA  62 -13.682  -8.823  -1.086
  484    HA   ALA  62           HA       ALA  62 -15.429 -10.524  -2.583
  485   1HB   ALA  62          1HB       ALA  62 -14.012 -10.934   0.065
  486   2HB   ALA  62          2HB       ALA  62 -14.888 -12.210  -0.781
  487   3HB   ALA  62          3HB       ALA  62 -13.472 -11.468  -1.527
  488    H    ALA  63           H        ALA  63 -15.947  -8.553   0.230
  489    HA   ALA  63           HA       ALA  63 -18.708  -9.709   0.508
  490   1HB   ALA  63          1HB       ALA  63 -18.522  -9.146   2.950
  491   2HB   ALA  63          2HB       ALA  63 -16.812  -8.804   2.691
  492   3HB   ALA  63          3HB       ALA  63 -17.435 -10.434   2.433
  493    H    LEU  64           H        LEU  64 -18.160  -7.482  -1.158
  494    HA   LEU  64           HA       LEU  64 -18.516  -5.007   0.283
  495   1HB   LEU  64          1HB       LEU  64 -19.017  -4.042  -1.945
  496   2HB   LEU  64          2HB       LEU  64 -17.596  -5.073  -2.004
  497    HG   LEU  64           HG       LEU  64 -19.511  -6.925  -2.597
  498   1HD1  LEU  64          1HD1      LEU  64 -20.547  -4.272  -3.649
  499   2HD1  LEU  64          2HD1      LEU  64 -21.026  -5.833  -4.307
  500   3HD1  LEU  64          3HD1      LEU  64 -21.409  -5.428  -2.639
  501   1HD2  LEU  64          1HD2      LEU  64 -18.123  -5.014  -4.499
  502   2HD2  LEU  64          2HD2      LEU  64 -17.541  -6.589  -3.958
  503   3HD2  LEU  64          3HD2      LEU  64 -18.947  -6.485  -5.017
  504    HA   PRO  65           HA       PRO  65 -22.869  -5.373   1.200
  505   1HB   PRO  65          1HB       PRO  65 -23.634  -2.692   0.614
  506   2HB   PRO  65          2HB       PRO  65 -23.121  -3.329   2.180
  507   1HG   PRO  65          1HG       PRO  65 -21.620  -1.650   0.275
  508   2HG   PRO  65          2HG       PRO  65 -21.335  -1.912   2.000
  509   1HD   PRO  65          1HD       PRO  65 -19.776  -2.977  -0.078
  510   2HD   PRO  65          2HD       PRO  65 -19.794  -3.577   1.596

  No H/Q in entry =         510
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1  28.230  20.531  -0.815
    2    H2   MET   1           H2       MET   1  28.782  19.728  -2.207
    3    H3   MET   1           H3       MET   1  28.173  21.306  -2.326
    4    HA   MET   1           HA       MET   1  25.978  20.615  -1.842
    5   1HB   MET   1          1HB       MET   1  25.760  18.704  -3.623
    6   2HB   MET   1          2HB       MET   1  26.344  20.286  -4.136
    7   1HG   MET   1          1HG       MET   1  28.296  18.175  -3.230
    8   2HG   MET   1          2HG       MET   1  27.672  18.167  -4.879
    9   1HE   MET   1          1HE       MET   1  30.520  18.210  -4.342
   10   2HE   MET   1          2HE       MET   1  31.410  19.729  -4.424
   11   3HE   MET   1          3HE       MET   1  30.644  19.228  -2.909
   12    H    LYS   2           H        LYS   2  28.175  18.954  -0.166
   13    HA   LYS   2           HA       LYS   2  26.997  16.340   0.115
   14   1HB   LYS   2          1HB       LYS   2  28.906  18.006   1.747
   15   2HB   LYS   2          2HB       LYS   2  28.222  16.547   2.462
   16   1HG   LYS   2          1HG       LYS   2  30.342  15.996   1.395
   17   2HG   LYS   2          2HG       LYS   2  29.029  15.246   0.489
   18   1HD   LYS   2          1HD       LYS   2  29.102  16.980  -1.190
   19   2HD   LYS   2          2HD       LYS   2  30.244  17.925  -0.233
   20   1HE   LYS   2          1HE       LYS   2  31.980  16.298  -0.536
   21   2HE   LYS   2          2HE       LYS   2  30.850  15.129  -1.221
   22   1HZ   LYS   2          1HZ       LYS   2  31.572  17.745  -2.427
   23   2HZ   LYS   2          2HZ       LYS   2  32.142  16.233  -2.940
   24   3HZ   LYS   2          3HZ       LYS   2  30.492  16.611  -3.088
   25    H    ALA   3           H        ALA   3  25.384  15.632   1.508
   26    HA   ALA   3           HA       ALA   3  23.659  17.739   2.659
   27   1HB   ALA   3          1HB       ALA   3  22.194  15.672   3.180
   28   2HB   ALA   3          2HB       ALA   3  23.345  14.772   2.191
   29   3HB   ALA   3          3HB       ALA   3  22.422  16.098   1.483
   30    H    ILE   4           H        ILE   4  22.546  16.612   4.833
   31    HA   ILE   4           HA       ILE   4  24.842  16.313   6.742
   32    HB   ILE   4           HB       ILE   4  22.953  17.011   8.417
   33   1HG1  ILE   4          1HG1      ILE   4  21.269  16.757   6.348
   34   2HG1  ILE   4          2HG1      ILE   4  21.006  17.973   7.590
   35   1HG2  ILE   4          1HG2      ILE   4  24.322  18.822   6.429
   36   2HG2  ILE   4          2HG2      ILE   4  23.330  19.473   7.735
   37   3HG2  ILE   4          3HG2      ILE   4  24.754  18.503   8.110
   38   1HD1  ILE   4          1HD1      ILE   4  22.649  18.690   5.171
   39   2HD1  ILE   4          2HD1      ILE   4  20.891  18.659   5.056
   40   3HD1  ILE   4          3HD1      ILE   4  21.681  19.728   6.212
   41    H    PHE   5           H        PHE   5  21.586  15.656   7.739
   42    HA   PHE   5           HA       PHE   5  22.272  13.032   8.669
   43   1HB   PHE   5          1HB       PHE   5  19.610  14.423   8.311
   44   2HB   PHE   5          2HB       PHE   5  19.772  12.824   9.037
   45    HD1  PHE   5           HD1      PHE   5  20.911  12.516  11.179
   46    HD2  PHE   5           HD2      PHE   5  20.431  16.420   9.453
   47    HE1  PHE   5           HE1      PHE   5  21.514  13.549  13.349
   48    HE2  PHE   5           HE2      PHE   5  21.035  17.455  11.625
   49    HZ   PHE   5           HZ       PHE   5  21.575  16.018  13.574
   50    H    VAL   6           H        VAL   6  20.563  14.159   5.758
   51    HA   VAL   6           HA       VAL   6  19.923  11.431   4.922
   52    HB   VAL   6           HB       VAL   6  19.908  13.981   3.278
   53   1HG1  VAL   6          1HG1      VAL   6  19.741  11.732   2.096
   54   2HG1  VAL   6          2HG1      VAL   6  18.237  11.471   2.981
   55   3HG1  VAL   6          3HG1      VAL   6  18.372  12.812   1.845
   56   1HG2  VAL   6          1HG2      VAL   6  17.843  12.760   5.126
   57   2HG2  VAL   6          2HG2      VAL   6  18.528  14.383   5.203
   58   3HG2  VAL   6          3HG2      VAL   6  17.433  13.949   3.890
   59    H    LEU   7           H        LEU   7  21.642  10.133   4.397
   60    HA   LEU   7           HA       LEU   7  23.375  10.930   2.177
   61   1HB   LEU   7          1HB       LEU   7  24.434  11.928   4.248
   62   2HB   LEU   7          2HB       LEU   7  24.646  10.292   4.858
   63    HG   LEU   7           HG       LEU   7  25.698  11.126   2.143
   64   1HD1  LEU   7          1HD1      LEU   7  26.913  11.554   4.867
   65   2HD1  LEU   7          2HD1      LEU   7  27.940  11.323   3.451
   66   3HD1  LEU   7          3HD1      LEU   7  26.809  12.673   3.508
   67   1HD2  LEU   7          1HD2      LEU   7  25.957   8.721   3.898
   68   2HD2  LEU   7          2HD2      LEU   7  26.033   8.856   2.145
   69   3HD2  LEU   7          3HD2      LEU   7  27.442   9.254   3.118
   70    H    ASN   8           H        ASN   8  22.740   8.580   4.782
   71    HA   ASN   8           HA       ASN   8  24.084   6.357   3.643
   72   1HB   ASN   8          1HB       ASN   8  21.529   6.366   5.283
   73   2HB   ASN   8          2HB       ASN   8  22.575   4.971   5.018
   74   2HD2  ASN   8          2HD2      ASN   8  21.898   7.033   7.418
   75   1HD2  ASN   8          1HD2      ASN   8  23.432   7.232   8.119
   76    H    ALA   9           H        ALA   9  23.719   5.350   1.748
   77    HA   ALA   9           HA       ALA   9  21.395   5.902   0.119
   78   1HB   ALA   9          1HB       ALA   9  23.519   3.751  -0.133
   79   2HB   ALA   9          2HB       ALA   9  22.342   4.163  -1.380
   80   3HB   ALA   9          3HB       ALA   9  23.560   5.342  -0.893
   81    H    GLN  10           H        GLN  10  22.404   3.167   2.144
   82    HA   GLN  10           HA       GLN  10  20.222   1.437   1.429
   83   1HB   GLN  10          1HB       GLN  10  21.996   1.565   3.883
   84   2HB   GLN  10          2HB       GLN  10  20.808   0.290   3.614
   85   1HG   GLN  10          1HG       GLN  10  21.922  -0.424   1.596
   86   2HG   GLN  10          2HG       GLN  10  23.004   0.969   1.641
   87   2HE2  GLN  10          2HE2      GLN  10  23.998  -1.744   1.658
   88   1HE2  GLN  10          1HE2      GLN  10  24.742  -2.017   3.159
   89    H    HIS  11           H        HIS  11  18.168   1.248   2.333
   90    HA   HIS  11           HA       HIS  11  17.466   2.673   4.787
   91   1HB   HIS  11          1HB       HIS  11  17.416   4.346   2.752
   92   2HB   HIS  11          2HB       HIS  11  15.920   3.516   2.331
   93    HD1  HIS  11           HD1      HIS  11  17.274   6.109   4.526
   94    HD2  HIS  11           HD2      HIS  11  13.932   3.617   4.551
   95    HE1  HIS  11           HE1      HIS  11  15.659   7.095   6.208
   96    H    ASP  12           H        ASP  12  15.129   2.243   5.344
   97    HA   ASP  12           HA       ASP  12  14.460  -0.499   4.940
   98   1HB   ASP  12          1HB       ASP  12  12.791   1.844   5.884
   99   2HB   ASP  12          2HB       ASP  12  12.213   0.178   5.891
  100    H    GLU  13           H        GLU  13  13.281   2.444   3.339
  101    HA   GLU  13           HA       GLU  13  11.200   1.246   1.829
  102   1HB   GLU  13          1HB       GLU  13  12.988   3.618   1.246
  103   2HB   GLU  13          2HB       GLU  13  11.602   3.180   0.245
  104   1HG   GLU  13          1HG       GLU  13  10.112   3.382   2.190
  105   2HG   GLU  13          2HG       GLU  13  11.488   3.791   3.216
  106    H    ALA  14           H        ALA  14  11.181   0.150  -0.115
  107    HA   ALA  14           HA       ALA  14  13.583  -1.215  -0.941
  108   1HB   ALA  14          1HB       ALA  14  12.210  -2.223  -2.640
  109   2HB   ALA  14          2HB       ALA  14  11.219  -2.084  -1.189
  110   3HB   ALA  14          3HB       ALA  14  11.008  -0.938  -2.512
  111    H    VAL  15           H        VAL  15  13.096  -1.023  -3.836
  112    HA   VAL  15           HA       VAL  15  14.858   1.196  -4.387
  113    HB   VAL  15           HB       VAL  15  14.549   0.599  -6.750
  114   1HG1  VAL  15          1HG1      VAL  15  16.042  -0.761  -5.290
  115   2HG1  VAL  15          2HG1      VAL  15  14.697  -1.862  -4.985
  116   3HG1  VAL  15          3HG1      VAL  15  15.353  -1.700  -6.614
  117   1HG2  VAL  15          1HG2      VAL  15  12.305  -1.111  -5.642
  118   2HG2  VAL  15          2HG2      VAL  15  12.195   0.147  -6.874
  119   3HG2  VAL  15          3HG2      VAL  15  13.011  -1.372  -7.237
  120    H    ASP  16           H        ASP  16  11.354   0.691  -4.738
  121    HA   ASP  16           HA       ASP  16  11.071   3.651  -5.182
  122   1HB   ASP  16          1HB       ASP  16   9.607   1.396  -6.585
  123   2HB   ASP  16          2HB       ASP  16   9.090   3.082  -6.639
  124    H    ALA  17           H        ALA  17   9.920   4.506  -3.533
  125    HA   ALA  17           HA       ALA  17   8.227   2.738  -1.853
  126   1HB   ALA  17          1HB       ALA  17   8.144   4.646  -0.319
  127   2HB   ALA  17          2HB       ALA  17   8.931   5.671  -1.519
  128   3HB   ALA  17          3HB       ALA  17   9.815   4.331  -0.787
  129    H    ASN  18           H        ASN  18   7.864   4.819  -4.502
  130    HA   ASN  18           HA       ASN  18   5.389   6.103  -3.961
  131   1HB   ASN  18          1HB       ASN  18   6.796   6.639  -5.914
  132   2HB   ASN  18          2HB       ASN  18   6.444   5.054  -6.604
  133   2HD2  ASN  18          2HD2      ASN  18   5.142   5.635  -8.396
  134   1HD2  ASN  18          1HD2      ASN  18   3.695   6.512  -8.264
  135    H    SER  19           H        SER  19   6.070   2.872  -5.286
  136    HA   SER  19           HA       SER  19   3.398   2.151  -5.930
  137   1HB   SER  19          1HB       SER  19   5.381   0.843  -6.617
  138   2HB   SER  19          2HB       SER  19   5.645   0.372  -4.941
  139    HG   SER  19           HG       SER  19   4.450  -1.177  -6.200
  140    H    LEU  20           H        LEU  20   5.214   1.750  -2.888
  141    HA   LEU  20           HA       LEU  20   3.185   0.356  -1.457
  142   1HB   LEU  20          1HB       LEU  20   5.501   0.596  -0.629
  143   2HB   LEU  20          2HB       LEU  20   5.260   2.328  -0.430
  144    HG   LEU  20           HG       LEU  20   3.421   1.832   1.209
  145   1HD1  LEU  20          1HD1      LEU  20   4.285  -0.986   0.581
  146   2HD1  LEU  20          2HD1      LEU  20   3.599  -0.593   2.156
  147   3HD1  LEU  20          3HD1      LEU  20   2.652  -0.329   0.697
  148   1HD2  LEU  20          1HD2      LEU  20   5.788   2.282   1.891
  149   2HD2  LEU  20          2HD2      LEU  20   4.921   1.253   3.031
  150   3HD2  LEU  20          3HD2      LEU  20   6.076   0.543   1.903
  151    H    ALA  21           H        ALA  21   3.893   3.850  -1.620
  152    HA   ALA  21           HA       ALA  21   1.588   4.582  -0.072
  153   1HB   ALA  21          1HB       ALA  21   3.765   5.921  -0.520
  154   2HB   ALA  21          2HB       ALA  21   2.968   6.429  -2.009
  155   3HB   ALA  21          3HB       ALA  21   2.243   6.807  -0.445
  156    H    GLU  22           H        GLU  22   2.240   4.505  -3.579
  157    HA   GLU  22           HA       GLU  22  -0.223   5.690  -4.397
  158   1HB   GLU  22          1HB       GLU  22   1.740   5.290  -5.902
  159   2HB   GLU  22          2HB       GLU  22   1.362   3.567  -5.871
  160   1HG   GLU  22          1HG       GLU  22  -0.868   4.029  -6.814
  161   2HG   GLU  22          2HG       GLU  22  -0.501   5.754  -6.847
  162    H    ALA  23           H        ALA  23   0.621   2.308  -3.710
  163    HA   ALA  23           HA       ALA  23  -1.811   1.139  -4.603
  164   1HB   ALA  23          1HB       ALA  23  -1.269  -0.687  -2.974
  165   2HB   ALA  23          2HB       ALA  23   0.106  -0.243  -3.985
  166   3HB   ALA  23          3HB       ALA  23   0.017   0.327  -2.319
  167    H    LYS  24           H        LYS  24  -0.919   2.571  -1.472
  168    HA   LYS  24           HA       LYS  24  -3.442   2.000  -0.192
  169   1HB   LYS  24          1HB       LYS  24  -1.307   4.077   0.371
  170   2HB   LYS  24          2HB       LYS  24  -2.690   3.777   1.423
  171   1HG   LYS  24          1HG       LYS  24  -1.986   1.429   1.685
  172   2HG   LYS  24          2HG       LYS  24  -0.598   1.729   0.637
  173   1HD   LYS  24          1HD       LYS  24   0.234   3.433   2.218
  174   2HD   LYS  24          2HD       LYS  24  -1.149   3.130   3.268
  175   1HE   LYS  24          1HE       LYS  24  -0.439   0.803   3.576
  176   2HE   LYS  24          2HE       LYS  24   0.919   1.058   2.480
  177   1HZ   LYS  24          1HZ       LYS  24   1.624   2.880   4.032
  178   2HZ   LYS  24          2HZ       LYS  24   0.469   2.298   5.132
  179   3HZ   LYS  24          3HZ       LYS  24   1.758   1.305   4.653
  180    H    VAL  25           H        VAL  25  -2.164   4.791  -1.991
  181    HA   VAL  25           HA       VAL  25  -4.396   6.523  -1.522
  182    HB   VAL  25           HB       VAL  25  -2.357   6.404  -3.755
  183   1HG1  VAL  25          1HG1      VAL  25  -4.506   8.468  -3.193
  184   2HG1  VAL  25          2HG1      VAL  25  -3.111   8.769  -4.226
  185   3HG1  VAL  25          3HG1      VAL  25  -4.286   7.538  -4.678
  186   1HG2  VAL  25          1HG2      VAL  25  -1.575   6.934  -1.439
  187   2HG2  VAL  25          2HG2      VAL  25  -1.347   8.272  -2.566
  188   3HG2  VAL  25          3HG2      VAL  25  -2.683   8.306  -1.416
  189    H    LEU  26           H        LEU  26  -3.626   4.405  -4.290
  190    HA   LEU  26           HA       LEU  26  -6.084   4.931  -5.675
  191   1HB   LEU  26          1HB       LEU  26  -4.150   2.595  -5.820
  192   2HB   LEU  26          2HB       LEU  26  -5.510   2.802  -6.922
  193    HG   LEU  26           HG       LEU  26  -3.269   4.814  -6.532
  194   1HD1  LEU  26          1HD1      LEU  26  -2.624   2.629  -7.628
  195   2HD1  LEU  26          2HD1      LEU  26  -3.798   2.991  -8.893
  196   3HD1  LEU  26          3HD1      LEU  26  -2.408   4.050  -8.651
  197   1HD2  LEU  26          1HD2      LEU  26  -5.796   4.768  -8.169
  198   2HD2  LEU  26          2HD2      LEU  26  -5.028   6.119  -7.335
  199   3HD2  LEU  26          3HD2      LEU  26  -4.368   5.540  -8.860
  200    H    ALA  27           H        ALA  27  -5.125   2.440  -3.348
  201    HA   ALA  27           HA       ALA  27  -7.556   0.921  -3.542
  202   1HB   ALA  27          1HB       ALA  27  -5.524  -0.012  -2.543
  203   2HB   ALA  27          2HB       ALA  27  -5.575   1.199  -1.263
  204   3HB   ALA  27          3HB       ALA  27  -6.829  -0.030  -1.361
  205    H    ASN  28           H        ASN  28  -6.552   3.610  -1.440
  206    HA   ASN  28           HA       ASN  28  -8.798   3.595   0.303
  207   1HB   ASN  28          1HB       ASN  28  -6.758   4.928   0.707
  208   2HB   ASN  28          2HB       ASN  28  -7.169   5.964  -0.660
  209   2HD2  ASN  28          2HD2      ASN  28  -7.071   6.394   2.440
  210   1HD2  ASN  28          1HD2      ASN  28  -8.548   7.164   2.765
  211    H    ARG  29           H        ARG  29  -8.343   5.175  -2.853
  212    HA   ARG  29           HA       ARG  29 -10.809   6.631  -2.836
  213   1HB   ARG  29          1HB       ARG  29  -9.218   5.561  -5.182
  214   2HB   ARG  29          2HB       ARG  29 -10.501   6.758  -5.298
  215   1HG   ARG  29          1HG       ARG  29  -8.014   7.134  -3.607
  216   2HG   ARG  29          2HG       ARG  29  -8.153   7.715  -5.262
  217   1HD   ARG  29          1HD       ARG  29  -9.702   8.613  -2.827
  218   2HD   ARG  29          2HD       ARG  29  -8.718   9.577  -3.920
  219    HE   ARG  29           HE       ARG  29 -10.698   8.621  -5.574
  220   1HH1  ARG  29          1HH1      ARG  29 -12.671   9.680  -5.887
  221   2HH1  ARG  29          2HH1      ARG  29 -13.275  10.738  -4.656
  222   1HH2  ARG  29          1HH2      ARG  29 -10.588  10.232  -2.526
  223   2HH2  ARG  29          2HH2      ARG  29 -12.097  11.051  -2.754
  224    H    GLU  30           H        GLU  30 -10.039   3.321  -3.833
  225    HA   GLU  30           HA       GLU  30 -12.468   2.767  -5.203
  226   1HB   GLU  30          1HB       GLU  30 -10.639   0.971  -3.589
  227   2HB   GLU  30          2HB       GLU  30 -11.997   0.368  -4.540
  228   1HG   GLU  30          1HG       GLU  30 -11.034   1.385  -6.570
  229   2HG   GLU  30          2HG       GLU  30  -9.673   1.987  -5.624
  230    H    LEU  31           H        LEU  31 -11.690   2.577  -1.728
  231    HA   LEU  31           HA       LEU  31 -14.141   1.377  -0.879
  232   1HB   LEU  31          1HB       LEU  31 -12.751   3.532   0.731
  233   2HB   LEU  31          2HB       LEU  31 -13.577   2.083   1.307
  234    HG   LEU  31           HG       LEU  31 -10.941   2.221  -0.166
  235   1HD1  LEU  31          1HD1      LEU  31 -11.768   1.467   2.649
  236   2HD1  LEU  31          2HD1      LEU  31 -10.194   1.053   1.976
  237   3HD1  LEU  31          3HD1      LEU  31 -10.656   2.744   2.153
  238   1HD2  LEU  31          1HD2      LEU  31 -12.719  -0.115   0.581
  239   2HD2  LEU  31          2HD2      LEU  31 -12.000   0.249  -0.987
  240   3HD2  LEU  31          3HD2      LEU  31 -10.985  -0.316   0.339
  241    H    ASP  32           H        ASP  32 -13.172   4.764  -1.121
  242    HA   ASP  32           HA       ASP  32 -15.667   5.946  -0.452
  243   1HB   ASP  32          1HB       ASP  32 -13.275   6.823  -2.065
  244   2HB   ASP  32          2HB       ASP  32 -14.681   7.880  -1.882
  245    H    LYS  33           H        LYS  33 -14.319   4.861  -3.538
  246    HA   LYS  33           HA       LYS  33 -16.348   5.867  -5.253
  247   1HB   LYS  33          1HB       LYS  33 -14.200   4.920  -6.039
  248   2HB   LYS  33          2HB       LYS  33 -14.712   3.324  -5.497
  249   1HG   LYS  33          1HG       LYS  33 -16.606   3.387  -7.076
  250   2HG   LYS  33          2HG       LYS  33 -16.096   4.988  -7.619
  251   1HD   LYS  33          1HD       LYS  33 -13.929   4.055  -8.342
  252   2HD   LYS  33          2HD       LYS  33 -14.437   2.455  -7.801
  253   1HE   LYS  33          1HE       LYS  33 -16.159   2.339  -9.442
  254   2HE   LYS  33          2HE       LYS  33 -16.007   4.053  -9.826
  255   1HZ   LYS  33          1HZ       LYS  33 -13.498   2.945 -10.173
  256   2HZ   LYS  33          2HZ       LYS  33 -14.584   1.860 -10.900
  257   3HZ   LYS  33          3HZ       LYS  33 -14.556   3.489 -11.382
  258    H    TYR  34           H        TYR  34 -16.080   2.655  -3.673
  259    HA   TYR  34           HA       TYR  34 -18.669   1.781  -4.616
  260   1HB   TYR  34          1HB       TYR  34 -16.888   0.796  -2.376
  261   2HB   TYR  34          2HB       TYR  34 -18.404   0.014  -2.821
  262    HD1  TYR  34           HD1      TYR  34 -18.674  -0.400  -5.459
  263    HD2  TYR  34           HD2      TYR  34 -14.932  -0.008  -3.384
  264    HE1  TYR  34           HE1      TYR  34 -17.528  -1.607  -7.296
  265    HE2  TYR  34           HE2      TYR  34 -13.788  -1.212  -5.224
  266    HH   TYR  34           HH       TYR  34 -14.819  -1.543  -8.127
  267    H    GLY  35           H        GLY  35 -17.519   3.290  -1.615
  268   1HA   GLY  35          1HA       GLY  35 -20.377   3.852  -0.888
  269   2HA   GLY  35          2HA       GLY  35 -19.014   4.883  -0.459
  270    H    VAL  36           H        VAL  36 -17.359   2.463   0.203
  271    HA   VAL  36           HA       VAL  36 -18.704   1.091   2.381
  272    HB   VAL  36           HB       VAL  36 -15.702   1.315   2.137
  273   1HG1  VAL  36          1HG1      VAL  36 -16.701   0.016   4.001
  274   2HG1  VAL  36          2HG1      VAL  36 -17.573  -0.973   2.831
  275   3HG1  VAL  36          3HG1      VAL  36 -15.811  -1.022   2.889
  276   1HG2  VAL  36          1HG2      VAL  36 -17.614  -0.166   0.322
  277   2HG2  VAL  36          2HG2      VAL  36 -16.315   0.937  -0.129
  278   3HG2  VAL  36          3HG2      VAL  36 -15.931  -0.658   0.516
  279    H    SER  37           H        SER  37 -17.809   1.249   4.679
  280    HA   SER  37           HA       SER  37 -18.109   3.897   5.676
  281   1HB   SER  37          1HB       SER  37 -17.465   2.990   7.821
  282   2HB   SER  37          2HB       SER  37 -18.416   1.763   6.992
  283    HG   SER  37           HG       SER  37 -16.471   0.934   7.910
  284    H    ASP  38           H        ASP  38 -16.443   5.202   6.793
  285    HA   ASP  38           HA       ASP  38 -13.954   5.289   5.202
  286   1HB   ASP  38          1HB       ASP  38 -13.590   7.448   6.331
  287   2HB   ASP  38          2HB       ASP  38 -15.211   7.374   5.640
  288    H    TYR  39           H        TYR  39 -14.702   3.369   7.610
  289    HA   TYR  39           HA       TYR  39 -12.534   3.968   9.501
  290   1HB   TYR  39          1HB       TYR  39 -14.527   2.939  10.400
  291   2HB   TYR  39          2HB       TYR  39 -14.449   1.633   9.218
  292    HD1  TYR  39           HD1      TYR  39 -12.990   3.009  12.311
  293    HD2  TYR  39           HD2      TYR  39 -12.793  -0.144   9.402
  294    HE1  TYR  39           HE1      TYR  39 -11.530   1.698  13.829
  295    HE2  TYR  39           HE2      TYR  39 -11.338  -1.453  10.915
  296    HH   TYR  39           HH       TYR  39  -9.914  -1.196  12.774
  297    H    TYR  40           H        TYR  40 -13.208   1.493   7.028
  298    HA   TYR  40           HA       TYR  40 -10.835  -0.030   7.368
  299   1HB   TYR  40          1HB       TYR  40 -12.440   0.433   4.838
  300   2HB   TYR  40          2HB       TYR  40 -11.275  -0.867   5.090
  301    HD1  TYR  40           HD1      TYR  40 -14.691  -0.098   5.194
  302    HD2  TYR  40           HD2      TYR  40 -11.670  -2.206   7.410
  303    HE1  TYR  40           HE1      TYR  40 -16.442  -1.481   6.270
  304    HE2  TYR  40           HE2      TYR  40 -13.426  -3.586   8.486
  305    HH   TYR  40           HH       TYR  40 -15.638  -3.811   8.819
  306    H    LYS  41           H        LYS  41 -11.371   2.946   5.502
  307    HA   LYS  41           HA       LYS  41  -8.997   2.807   3.945
  308   1HB   LYS  41          1HB       LYS  41  -9.336   5.100   3.472
  309   2HB   LYS  41          2HB       LYS  41 -10.961   4.501   3.791
  310   1HG   LYS  41          1HG       LYS  41 -10.557   5.232   6.229
  311   2HG   LYS  41          2HG       LYS  41  -9.182   6.134   5.607
  312   1HD   LYS  41          1HD       LYS  41 -12.008   6.438   4.550
  313   2HD   LYS  41          2HD       LYS  41 -11.298   7.489   5.772
  314   1HE   LYS  41          1HE       LYS  41  -9.414   7.948   4.136
  315   2HE   LYS  41          2HE       LYS  41 -10.375   7.112   2.916
  316   1HZ   LYS  41          1HZ       LYS  41 -11.961   8.997   4.306
  317   2HZ   LYS  41          2HZ       LYS  41 -10.577   9.756   3.675
  318   3HZ   LYS  41          3HZ       LYS  41 -11.624   8.901   2.646
  319    H    ASN  42           H        ASN  42  -9.624   3.994   7.212
  320    HA   ASN  42           HA       ASN  42  -7.018   5.024   7.687
  321   1HB   ASN  42          1HB       ASN  42  -8.933   5.523   9.167
  322   2HB   ASN  42          2HB       ASN  42  -8.985   3.832   9.663
  323   2HD2  ASN  42          2HD2      ASN  42  -8.581   4.791  11.911
  324   1HD2  ASN  42          1HD2      ASN  42  -6.977   5.125  12.358
  325    H    LEU  43           H        LEU  43  -8.426   1.807   8.105
  326    HA   LEU  43           HA       LEU  43  -6.224   0.589   9.419
  327   1HB   LEU  43          1HB       LEU  43  -8.436  -0.484   9.212
  328   2HB   LEU  43          2HB       LEU  43  -8.205  -0.640   7.473
  329    HG   LEU  43           HG       LEU  43  -6.246  -2.091   7.859
  330   1HD1  LEU  43          1HD1      LEU  43  -6.841  -1.397  10.731
  331   2HD1  LEU  43          2HD1      LEU  43  -6.115  -2.959  10.354
  332   3HD1  LEU  43          3HD1      LEU  43  -5.286  -1.473   9.902
  333   1HD2  LEU  43          1HD2      LEU  43  -8.660  -2.956   7.776
  334   2HD2  LEU  43          2HD2      LEU  43  -7.473  -4.034   8.509
  335   3HD2  LEU  43          3HD2      LEU  43  -8.559  -3.094   9.532
  336    H    ILE  44           H        ILE  44  -6.921   0.980   5.940
  337    HA   ILE  44           HA       ILE  44  -4.656  -0.463   4.976
  338    HB   ILE  44           HB       ILE  44  -6.219   1.846   3.794
  339   1HG1  ILE  44          1HG1      ILE  44  -6.131  -1.090   3.055
  340   2HG1  ILE  44          2HG1      ILE  44  -7.312  -0.415   4.176
  341   1HG2  ILE  44          1HG2      ILE  44  -3.960   0.195   2.631
  342   2HG2  ILE  44          2HG2      ILE  44  -5.128   1.046   1.617
  343   3HG2  ILE  44          3HG2      ILE  44  -4.085   1.952   2.714
  344   1HD1  ILE  44          1HD1      ILE  44  -7.890   1.239   2.288
  345   2HD1  ILE  44          2HD1      ILE  44  -6.973   0.164   1.231
  346   3HD1  ILE  44          3HD1      ILE  44  -8.404  -0.436   2.070
  347    H    ASN  45           H        ASN  45  -5.035   2.934   5.943
  348    HA   ASN  45           HA       ASN  45  -2.391   3.741   5.151
  349   1HB   ASN  45          1HB       ASN  45  -4.330   4.844   7.203
  350   2HB   ASN  45          2HB       ASN  45  -2.803   5.628   6.792
  351   2HD2  ASN  45          2HD2      ASN  45  -2.605   5.514   4.089
  352   1HD2  ASN  45          1HD2      ASN  45  -3.955   6.203   3.326
  353    H    ASN  46           H        ASN  46  -3.619   1.910   7.809
  354    HA   ASN  46           HA       ASN  46  -1.106   2.264   9.377
  355   1HB   ASN  46          1HB       ASN  46  -3.374   2.397  10.496
  356   2HB   ASN  46          2HB       ASN  46  -3.580   0.685  10.126
  357   2HD2  ASN  46          2HD2      ASN  46  -3.630   0.652  12.657
  358   1HD2  ASN  46          1HD2      ASN  46  -2.135   0.467  13.439
  359    H    ALA  47           H        ALA  47  -1.952   0.448   6.833
  360    HA   ALA  47           HA       ALA  47  -1.484  -2.251   7.635
  361   1HB   ALA  47          1HB       ALA  47  -2.367  -1.438   5.387
  362   2HB   ALA  47          2HB       ALA  47  -1.162  -2.724   5.307
  363   3HB   ALA  47          3HB       ALA  47  -0.698  -1.057   4.969
  364    H    LYS  48           H        LYS  48   0.402  -3.378   8.010
  365    HA   LYS  48           HA       LYS  48   2.906  -1.799   8.138
  366   1HB   LYS  48          1HB       LYS  48   3.675  -4.178   9.130
  367   2HB   LYS  48          2HB       LYS  48   2.813  -2.999  10.112
  368   1HG   LYS  48          1HG       LYS  48   1.821  -5.239  10.345
  369   2HG   LYS  48          2HG       LYS  48   0.676  -4.122   9.609
  370   1HD   LYS  48          1HD       LYS  48   1.136  -5.016   7.404
  371   2HD   LYS  48          2HD       LYS  48   2.449  -6.010   8.033
  372   1HE   LYS  48          1HE       LYS  48  -0.446  -6.261   8.898
  373   2HE   LYS  48          2HE       LYS  48   0.318  -7.287   7.684
  374   1HZ   LYS  48          1HZ       LYS  48   2.015  -7.829   9.417
  375   2HZ   LYS  48          2HZ       LYS  48   1.024  -7.044  10.552
  376   3HZ   LYS  48          3HZ       LYS  48   0.455  -8.418   9.739
  377    H    THR  49           H        THR  49   1.382  -3.622   5.823
  378    HA   THR  49           HA       THR  49   3.861  -3.863   4.297
  379    HB   THR  49           HB       THR  49   2.326  -6.427   4.740
  380    HG1  THR  49           HG1      THR  49   4.729  -5.746   6.047
  381   1HG2  THR  49          1HG2      THR  49   3.890  -6.084   2.768
  382   2HG2  THR  49          2HG2      THR  49   5.202  -5.946   3.939
  383   3HG2  THR  49          3HG2      THR  49   4.287  -7.449   3.812
  384    H    VAL  50           H        VAL  50   3.449  -4.166   2.053
  385    HA   VAL  50           HA       VAL  50   0.857  -3.254   1.151
  386    HB   VAL  50           HB       VAL  50   2.831  -2.676  -0.102
  387   1HG1  VAL  50          1HG1      VAL  50   3.177  -5.665  -0.452
  388   2HG1  VAL  50          2HG1      VAL  50   4.127  -4.445  -1.297
  389   3HG1  VAL  50          3HG1      VAL  50   4.236  -4.587   0.458
  390   1HG2  VAL  50          1HG2      VAL  50   0.670  -3.102  -1.336
  391   2HG2  VAL  50          2HG2      VAL  50   2.118  -3.262  -2.328
  392   3HG2  VAL  50          3HG2      VAL  50   1.291  -4.704  -1.740
  393    H    GLU  51           H        GLU  51   2.306  -6.386   1.645
  394    HA   GLU  51           HA       GLU  51   0.661  -7.942  -0.086
  395   1HB   GLU  51          1HB       GLU  51   1.919  -8.600   2.598
  396   2HB   GLU  51          2HB       GLU  51   1.104  -9.795   1.587
  397   1HG   GLU  51          1HG       GLU  51   2.667  -9.330  -0.253
  398   2HG   GLU  51          2HG       GLU  51   3.476  -8.109   0.731
  399    H    GLY  52           H        GLY  52   0.169  -6.728   3.199
  400   1HA   GLY  52          1HA       GLY  52  -1.756  -6.759   4.557
  401   2HA   GLY  52          2HA       GLY  52  -2.424  -8.008   3.503
  402    H    VAL  53           H        VAL  53  -1.256  -4.976   2.152
  403    HA   VAL  53           HA       VAL  53  -3.703  -3.504   2.291
  404    HB   VAL  53           HB       VAL  53  -1.379  -3.373   0.356
  405   1HG1  VAL  53          1HG1      VAL  53  -3.878  -1.684   0.562
  406   2HG1  VAL  53          2HG1      VAL  53  -2.380  -1.040  -0.114
  407   3HG1  VAL  53          3HG1      VAL  53  -3.171  -2.419  -0.877
  408   1HG2  VAL  53          1HG2      VAL  53  -0.919  -2.772   2.712
  409   2HG2  VAL  53          2HG2      VAL  53  -0.830  -1.353   1.669
  410   3HG2  VAL  53          3HG2      VAL  53  -2.253  -1.619   2.676
  411    H    LYS  54           H        LYS  54  -2.412  -5.549  -0.373
  412    HA   LYS  54           HA       LYS  54  -4.773  -5.200  -1.998
  413   1HB   LYS  54          1HB       LYS  54  -3.846  -6.914  -3.423
  414   2HB   LYS  54          2HB       LYS  54  -2.513  -5.904  -2.861
  415   1HG   LYS  54          1HG       LYS  54  -2.149  -7.587  -1.008
  416   2HG   LYS  54          2HG       LYS  54  -3.309  -8.635  -1.822
  417   1HD   LYS  54          1HD       LYS  54  -1.885  -8.428  -3.905
  418   2HD   LYS  54          2HD       LYS  54  -0.669  -7.630  -2.906
  419   1HE   LYS  54          1HE       LYS  54  -0.486  -9.589  -1.476
  420   2HE   LYS  54          2HE       LYS  54  -1.805 -10.383  -2.336
  421   1HZ   LYS  54          1HZ       LYS  54   0.574  -9.457  -3.803
  422   2HZ   LYS  54          2HZ       LYS  54   0.618 -10.932  -2.966
  423   3HZ   LYS  54          3HZ       LYS  54  -0.520 -10.694  -4.205
  424    H    ALA  55           H        ALA  55  -3.841  -7.540   0.463
  425    HA   ALA  55           HA       ALA  55  -5.964  -9.417  -0.077
  426   1HB   ALA  55          1HB       ALA  55  -4.709  -9.007   2.635
  427   2HB   ALA  55          2HB       ALA  55  -5.293 -10.504   1.907
  428   3HB   ALA  55          3HB       ALA  55  -3.807  -9.757   1.319
  429    H    LEU  56           H        LEU  56  -5.722  -6.502   1.849
  430    HA   LEU  56           HA       LEU  56  -8.158  -6.912   3.312
  431   1HB   LEU  56          1HB       LEU  56  -6.422  -5.379   4.097
  432   2HB   LEU  56          2HB       LEU  56  -6.663  -4.356   2.685
  433    HG   LEU  56           HG       LEU  56  -8.925  -3.809   3.400
  434   1HD1  LEU  56          1HD1      LEU  56  -8.408  -5.963   5.446
  435   2HD1  LEU  56          2HD1      LEU  56  -9.556  -4.672   5.802
  436   3HD1  LEU  56          3HD1      LEU  56  -9.819  -5.725   4.416
  437   1HD2  LEU  56          1HD2      LEU  56  -6.768  -2.752   4.505
  438   2HD2  LEU  56          2HD2      LEU  56  -8.356  -2.382   5.169
  439   3HD2  LEU  56          3HD2      LEU  56  -7.329  -3.584   5.950
  440    H    ILE  57           H        ILE  57  -7.374  -5.281   0.264
  441    HA   ILE  57           HA       ILE  57 -10.099  -4.331  -0.133
  442    HB   ILE  57           HB       ILE  57  -7.916  -4.808  -2.182
  443   1HG1  ILE  57          1HG1      ILE  57  -7.070  -3.251  -0.526
  444   2HG1  ILE  57          2HG1      ILE  57  -7.546  -2.314  -1.940
  445   1HG2  ILE  57          1HG2      ILE  57 -10.511  -3.268  -2.218
  446   2HG2  ILE  57          2HG2      ILE  57  -9.222  -2.975  -3.387
  447   3HG2  ILE  57          3HG2      ILE  57  -9.992  -4.559  -3.301
  448   1HD1  ILE  57          1HD1      ILE  57  -9.847  -2.086  -0.701
  449   2HD1  ILE  57          2HD1      ILE  57  -8.918  -2.531   0.732
  450   3HD1  ILE  57          3HD1      ILE  57  -8.497  -1.086  -0.180
  451    H    ASP  58           H        ASP  58  -8.202  -7.152  -1.098
  452    HA   ASP  58           HA       ASP  58 -10.204  -8.264  -2.848
  453   1HB   ASP  58          1HB       ASP  58  -7.895  -9.519  -1.351
  454   2HB   ASP  58          2HB       ASP  58  -8.910 -10.409  -2.484
  455    H    GLU  59           H        GLU  59  -9.519  -8.726   0.624
  456    HA   GLU  59           HA       GLU  59 -11.506 -10.799   0.928
  457   1HB   GLU  59          1HB       GLU  59 -11.074 -10.680   3.260
  458   2HB   GLU  59          2HB       GLU  59  -9.533 -10.268   2.513
  459   1HG   GLU  59          1HG       GLU  59 -10.172  -7.860   2.736
  460   2HG   GLU  59          2HG       GLU  59 -11.552  -8.356   3.703
  461    H    ILE  60           H        ILE  60 -11.500  -7.288   1.280
  462    HA   ILE  60           HA       ILE  60 -14.182  -7.125   2.309
  463    HB   ILE  60           HB       ILE  60 -12.423  -5.103   0.898
  464   1HG1  ILE  60          1HG1      ILE  60 -13.277  -5.246   3.798
  465   2HG1  ILE  60          2HG1      ILE  60 -11.802  -6.005   3.205
  466   1HG2  ILE  60          1HG2      ILE  60 -15.170  -4.829   2.136
  467   2HG2  ILE  60          2HG2      ILE  60 -14.089  -3.451   1.928
  468   3HG2  ILE  60          3HG2      ILE  60 -14.656  -4.348   0.520
  469   1HD1  ILE  60          1HD1      ILE  60 -11.066  -3.789   2.316
  470   2HD1  ILE  60          2HD1      ILE  60 -12.503  -3.059   3.033
  471   3HD1  ILE  60          3HD1      ILE  60 -11.271  -3.782   4.068
  472    H    LEU  61           H        LEU  61 -12.782  -6.953  -0.949
  473    HA   LEU  61           HA       LEU  61 -15.396  -6.500  -2.187
  474   1HB   LEU  61          1HB       LEU  61 -12.665  -7.151  -3.348
  475   2HB   LEU  61          2HB       LEU  61 -14.100  -6.850  -4.330
  476    HG   LEU  61           HG       LEU  61 -12.854  -4.901  -2.362
  477   1HD1  LEU  61          1HD1      LEU  61 -11.686  -5.435  -4.625
  478   2HD1  LEU  61          2HD1      LEU  61 -13.042  -4.580  -5.359
  479   3HD1  LEU  61          3HD1      LEU  61 -11.982  -3.744  -4.225
  480   1HD2  LEU  61          1HD2      LEU  61 -15.394  -4.861  -3.977
  481   2HD2  LEU  61          2HD2      LEU  61 -15.084  -4.222  -2.363
  482   3HD2  LEU  61          3HD2      LEU  61 -14.510  -3.348  -3.777
  483    H    ALA  62           H        ALA  62 -13.762  -9.202  -0.970
  484    HA   ALA  62           HA       ALA  62 -14.487 -11.223  -2.839
  485   1HB   ALA  62          1HB       ALA  62 -14.257 -11.395   0.182
  486   2HB   ALA  62          2HB       ALA  62 -14.317 -12.779  -0.909
  487   3HB   ALA  62          3HB       ALA  62 -12.953 -11.663  -0.974
  488    H    ALA  63           H        ALA  63 -16.271  -9.915  -0.034
  489    HA   ALA  63           HA       ALA  63 -18.561 -11.630  -0.400
  490   1HB   ALA  63          1HB       ALA  63 -17.959 -10.346   1.711
  491   2HB   ALA  63          2HB       ALA  63 -19.649 -10.235   1.224
  492   3HB   ALA  63          3HB       ALA  63 -18.548  -8.896   0.901
  493    H    LEU  64           H        LEU  64 -17.762  -8.349  -1.513
  494    HA   LEU  64           HA       LEU  64 -20.337  -7.916  -2.745
  495   1HB   LEU  64          1HB       LEU  64 -17.637  -6.585  -3.061
  496   2HB   LEU  64          2HB       LEU  64 -19.058  -6.039  -3.945
  497    HG   LEU  64           HG       LEU  64 -19.247  -6.368  -0.952
  498   1HD1  LEU  64          1HD1      LEU  64 -18.020  -3.994  -2.389
  499   2HD1  LEU  64          2HD1      LEU  64 -18.510  -4.001  -0.694
  500   3HD1  LEU  64          3HD1      LEU  64 -17.207  -5.057  -1.240
  501   1HD2  LEU  64          1HD2      LEU  64 -21.207  -5.791  -2.516
  502   2HD2  LEU  64          2HD2      LEU  64 -20.955  -4.707  -1.149
  503   3HD2  LEU  64          3HD2      LEU  64 -20.415  -4.236  -2.759
  504    HA   PRO  65           HA       PRO  65 -19.759 -10.308  -6.461
  505   1HB   PRO  65          1HB       PRO  65 -20.866  -8.439  -8.308
  506   2HB   PRO  65          2HB       PRO  65 -21.725  -9.734  -7.467
  507   1HG   PRO  65          1HG       PRO  65 -21.747  -6.831  -6.930
  508   2HG   PRO  65          2HG       PRO  65 -22.917  -8.067  -6.448
  509   1HD   PRO  65          1HD       PRO  65 -21.091  -6.820  -4.722
  510   2HD   PRO  65          2HD       PRO  65 -21.918  -8.362  -4.391

  No H/Q in entry =         510
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1  31.328   4.042  -9.020
    2    H2   MET   1           H2       MET   1  30.369   4.864  -7.882
    3    H3   MET   1           H3       MET   1  32.046   5.119  -7.919
    4    HA   MET   1           HA       MET   1  32.538   3.106  -6.952
    5   1HB   MET   1          1HB       MET   1  29.803   3.859  -5.869
    6   2HB   MET   1          2HB       MET   1  30.999   2.868  -5.035
    7   1HG   MET   1          1HG       MET   1  31.535   5.700  -5.963
    8   2HG   MET   1          2HG       MET   1  30.986   5.297  -4.336
    9   1HE   MET   1          1HE       MET   1  33.422   6.948  -4.691
   10   2HE   MET   1          2HE       MET   1  34.998   6.178  -4.852
   11   3HE   MET   1          3HE       MET   1  33.924   6.269  -6.245
   12    H    LYS   2           H        LYS   2  32.528   1.191  -8.096
   13    HA   LYS   2           HA       LYS   2  30.281   0.100  -9.458
   14   1HB   LYS   2          1HB       LYS   2  32.602  -0.612  -9.908
   15   2HB   LYS   2          2HB       LYS   2  32.682  -1.352  -8.309
   16   1HG   LYS   2          1HG       LYS   2  30.982  -2.955  -8.872
   17   2HG   LYS   2          2HG       LYS   2  30.604  -2.112 -10.374
   18   1HD   LYS   2          1HD       LYS   2  31.977  -4.054 -10.893
   19   2HD   LYS   2          2HD       LYS   2  32.924  -2.594 -11.178
   20   1HE   LYS   2          1HE       LYS   2  34.190  -2.890  -9.200
   21   2HE   LYS   2          2HE       LYS   2  33.032  -4.039  -8.528
   22   1HZ   LYS   2          1HZ       LYS   2  33.618  -5.464 -10.532
   23   2HZ   LYS   2          2HZ       LYS   2  34.961  -4.443 -10.730
   24   3HZ   LYS   2          3HZ       LYS   2  34.784  -5.341  -9.302
   25    H    ALA   3           H        ALA   3  31.498  -0.457  -6.161
   26    HA   ALA   3           HA       ALA   3  28.824  -1.283  -5.311
   27   1HB   ALA   3          1HB       ALA   3  29.639  -3.405  -6.223
   28   2HB   ALA   3          2HB       ALA   3  29.576  -3.503  -4.462
   29   3HB   ALA   3          3HB       ALA   3  31.121  -3.265  -5.278
   30    H    ILE   4           H        ILE   4  28.736  -1.511  -2.935
   31    HA   ILE   4           HA       ILE   4  31.167  -0.760  -1.437
   32    HB   ILE   4           HB       ILE   4  30.299   1.418  -2.071
   33   1HG1  ILE   4          1HG1      ILE   4  29.403   0.922   0.770
   34   2HG1  ILE   4          2HG1      ILE   4  31.104   0.934   0.318
   35   1HG2  ILE   4          1HG2      ILE   4  27.681   0.332  -1.007
   36   2HG2  ILE   4          2HG2      ILE   4  27.973   2.054  -1.241
   37   3HG2  ILE   4          3HG2      ILE   4  28.022   0.957  -2.619
   38   1HD1  ILE   4          1HD1      ILE   4  30.663   3.240  -0.709
   39   2HD1  ILE   4          2HD1      ILE   4  29.110   3.201   0.128
   40   3HD1  ILE   4          3HD1      ILE   4  30.611   3.153   1.049
   41    H    PHE   5           H        PHE   5  30.992  -1.273   0.802
   42    HA   PHE   5           HA       PHE   5  29.305  -3.474   1.436
   43   1HB   PHE   5          1HB       PHE   5  30.935  -1.570   3.122
   44   2HB   PHE   5          2HB       PHE   5  29.988  -2.863   3.859
   45    HD1  PHE   5           HD1      PHE   5  30.540  -5.214   3.471
   46    HD2  PHE   5           HD2      PHE   5  32.880  -2.063   1.726
   47    HE1  PHE   5           HE1      PHE   5  32.329  -6.843   2.933
   48    HE2  PHE   5           HE2      PHE   5  34.671  -3.693   1.187
   49    HZ   PHE   5           HZ       PHE   5  34.396  -6.083   1.791
   50    H    VAL   6           H        VAL   6  28.960  -0.012   2.146
   51    HA   VAL   6           HA       VAL   6  26.262  -0.536   3.318
   52    HB   VAL   6           HB       VAL   6  26.479   1.953   3.944
   53   1HG1  VAL   6          1HG1      VAL   6  28.446  -0.074   5.056
   54   2HG1  VAL   6          2HG1      VAL   6  27.955   1.412   5.871
   55   3HG1  VAL   6          3HG1      VAL   6  26.773   0.139   5.571
   56   1HG2  VAL   6          1HG2      VAL   6  28.325   2.443   2.338
   57   2HG2  VAL   6          2HG2      VAL   6  28.766   2.839   3.998
   58   3HG2  VAL   6          3HG2      VAL   6  29.377   1.364   3.252
   59    H    LEU   7           H        LEU   7  24.501  -0.112   2.098
   60    HA   LEU   7           HA       LEU   7  24.841   1.462  -0.432
   61   1HB   LEU   7          1HB       LEU   7  24.018  -0.963  -0.471
   62   2HB   LEU   7          2HB       LEU   7  22.557  -0.388   0.316
   63    HG   LEU   7           HG       LEU   7  23.545   0.877  -2.252
   64   1HD1  LEU   7          1HD1      LEU   7  21.864  -1.617  -1.921
   65   2HD1  LEU   7          2HD1      LEU   7  21.890  -0.665  -3.405
   66   3HD1  LEU   7          3HD1      LEU   7  23.365  -1.442  -2.829
   67   1HD2  LEU   7          1HD2      LEU   7  20.929   0.787  -0.733
   68   2HD2  LEU   7          2HD2      LEU   7  21.809   2.184  -1.341
   69   3HD2  LEU   7          3HD2      LEU   7  20.948   1.136  -2.459
   70    H    ASN   8           H        ASN   8  24.138   3.537  -0.218
   71    HA   ASN   8           HA       ASN   8  21.814   4.098   1.607
   72   1HB   ASN   8          1HB       ASN   8  22.714   6.353   1.844
   73   2HB   ASN   8          2HB       ASN   8  23.962   5.180   2.263
   74   2HD2  ASN   8          2HD2      ASN   8  25.932   5.421   1.189
   75   1HD2  ASN   8          1HD2      ASN   8  26.157   6.322  -0.232
   76    H    ALA   9           H        ALA   9  22.741   3.874  -1.604
   77    HA   ALA   9           HA       ALA   9  20.552   5.739  -2.481
   78   1HB   ALA   9          1HB       ALA   9  23.162   4.998  -3.830
   79   2HB   ALA   9          2HB       ALA   9  22.654   6.598  -3.291
   80   3HB   ALA   9          3HB       ALA   9  21.844   5.829  -4.657
   81    H    GLN  10           H        GLN  10  18.835   4.446  -2.930
   82    HA   GLN  10           HA       GLN  10  19.315   1.836  -4.340
   83   1HB   GLN  10          1HB       GLN  10  18.200   1.653  -2.135
   84   2HB   GLN  10          2HB       GLN  10  16.940   2.754  -2.685
   85   1HG   GLN  10          1HG       GLN  10  16.321   1.161  -4.472
   86   2HG   GLN  10          2HG       GLN  10  17.584   0.059  -3.921
   87   2HE2  GLN  10          2HE2      GLN  10  16.416  -1.646  -2.974
   88   1HE2  GLN  10          1HE2      GLN  10  15.240  -1.444  -1.767
   89    H    HIS  11           H        HIS  11  18.634   1.740  -6.428
   90    HA   HIS  11           HA       HIS  11  16.399   3.506  -7.321
   91   1HB   HIS  11          1HB       HIS  11  18.645   4.569  -7.853
   92   2HB   HIS  11          2HB       HIS  11  18.965   3.187  -8.902
   93    HD1  HIS  11           HD1      HIS  11  17.597   2.998 -11.091
   94    HD2  HIS  11           HD2      HIS  11  16.613   6.343  -8.806
   95    HE1  HIS  11           HE1      HIS  11  16.158   4.473 -12.564
   96    H    ASP  12           H        ASP  12  17.334   0.473  -6.925
   97    HA   ASP  12           HA       ASP  12  17.132  -0.781  -9.474
   98   1HB   ASP  12          1HB       ASP  12  16.571  -2.821  -8.224
   99   2HB   ASP  12          2HB       ASP  12  17.882  -1.955  -7.424
  100    H    GLU  13           H        GLU  13  14.618   0.166  -7.141
  101    HA   GLU  13           HA       GLU  13  12.642   0.385  -9.246
  102   1HB   GLU  13          1HB       GLU  13  12.758  -2.110  -8.920
  103   2HB   GLU  13          2HB       GLU  13  12.257  -1.866  -7.247
  104   1HG   GLU  13          1HG       GLU  13  10.293  -2.404  -8.568
  105   2HG   GLU  13          2HG       GLU  13  10.197  -0.709  -8.090
  106    H    ALA  14           H        ALA  14  13.004  -0.236  -5.742
  107    HA   ALA  14           HA       ALA  14  10.787   1.593  -5.128
  108   1HB   ALA  14          1HB       ALA  14  11.349   1.062  -2.768
  109   2HB   ALA  14          2HB       ALA  14  11.119  -0.397  -3.732
  110   3HB   ALA  14          3HB       ALA  14  12.748   0.143  -3.323
  111    H    VAL  15           H        VAL  15  11.851   3.473  -6.187
  112    HA   VAL  15           HA       VAL  15  14.317   4.573  -5.241
  113    HB   VAL  15           HB       VAL  15  11.884   5.849  -6.526
  114   1HG1  VAL  15          1HG1      VAL  15  14.573   7.013  -5.785
  115   2HG1  VAL  15          2HG1      VAL  15  13.552   7.717  -7.039
  116   3HG1  VAL  15          3HG1      VAL  15  12.972   7.628  -5.376
  117   1HG2  VAL  15          1HG2      VAL  15  13.160   4.200  -7.888
  118   2HG2  VAL  15          2HG2      VAL  15  13.284   5.834  -8.539
  119   3HG2  VAL  15          3HG2      VAL  15  14.627   5.144  -7.624
  120    H    ASP  16           H        ASP  16  10.925   5.166  -4.286
  121    HA   ASP  16           HA       ASP  16  11.893   6.130  -1.633
  122   1HB   ASP  16          1HB       ASP  16   9.964   7.591  -3.457
  123   2HB   ASP  16          2HB       ASP  16  10.137   7.948  -1.740
  124    H    ALA  17           H        ALA  17  10.091   6.111  -0.005
  125    HA   ALA  17           HA       ALA  17   8.520   3.693  -0.240
  126   1HB   ALA  17          1HB       ALA  17   7.937   5.839   1.801
  127   2HB   ALA  17          2HB       ALA  17   9.424   4.899   1.909
  128   3HB   ALA  17          3HB       ALA  17   7.862   4.086   1.980
  129    H    ASN  18           H        ASN  18   8.108   6.635  -1.669
  130    HA   ASN  18           HA       ASN  18   5.357   7.255  -1.286
  131   1HB   ASN  18          1HB       ASN  18   6.931   8.756  -2.470
  132   2HB   ASN  18          2HB       ASN  18   7.027   7.598  -3.797
  133   2HD2  ASN  18          2HD2      ASN  18   5.765   8.350  -5.509
  134   1HD2  ASN  18          1HD2      ASN  18   4.235   9.068  -5.349
  135    H    SER  19           H        SER  19   6.935   5.001  -3.559
  136    HA   SER  19           HA       SER  19   4.608   4.339  -5.055
  137   1HB   SER  19          1HB       SER  19   6.876   3.642  -5.739
  138   2HB   SER  19          2HB       SER  19   6.958   2.552  -4.358
  139    HG   SER  19           HG       SER  19   6.275   1.423  -6.186
  140    H    LEU  20           H        LEU  20   5.948   2.820  -2.109
  141    HA   LEU  20           HA       LEU  20   3.954   0.796  -1.855
  142   1HB   LEU  20          1HB       LEU  20   6.159   1.121  -0.535
  143   2HB   LEU  20          2HB       LEU  20   5.243   2.218   0.490
  144    HG   LEU  20           HG       LEU  20   4.362  -0.632  -0.072
  145   1HD1  LEU  20          1HD1      LEU  20   6.622  -0.513   1.047
  146   2HD1  LEU  20          2HD1      LEU  20   5.851   0.362   2.371
  147   3HD1  LEU  20          3HD1      LEU  20   5.373  -1.297   2.013
  148   1HD2  LEU  20          1HD2      LEU  20   3.488   1.562   1.812
  149   2HD2  LEU  20          2HD2      LEU  20   2.505   0.524   0.784
  150   3HD2  LEU  20          3HD2      LEU  20   3.230  -0.126   2.248
  151    H    ALA  21           H        ALA  21   4.143   4.067  -0.453
  152    HA   ALA  21           HA       ALA  21   1.608   4.033   0.828
  153   1HB   ALA  21          1HB       ALA  21   3.365   6.254  -0.212
  154   2HB   ALA  21          2HB       ALA  21   3.094   5.769   1.461
  155   3HB   ALA  21          3HB       ALA  21   1.817   6.590   0.563
  156    H    GLU  22           H        GLU  22   2.562   4.683  -2.492
  157    HA   GLU  22           HA       GLU  22   0.188   5.960  -3.395
  158   1HB   GLU  22          1HB       GLU  22   2.332   5.712  -4.702
  159   2HB   GLU  22          2HB       GLU  22   1.901   4.025  -4.978
  160   1HG   GLU  22          1HG       GLU  22   1.184   5.301  -6.900
  161   2HG   GLU  22          2HG       GLU  22  -0.251   4.807  -6.002
  162    H    ALA  23           H        ALA  23   0.997   2.505  -3.060
  163    HA   ALA  23           HA       ALA  23  -1.349   1.470  -4.301
  164   1HB   ALA  23          1HB       ALA  23  -0.945  -0.552  -2.924
  165   2HB   ALA  23          2HB       ALA  23   0.553   0.034  -3.645
  166   3HB   ALA  23          3HB       ALA  23   0.209   0.351  -1.945
  167    H    LYS  24           H        LYS  24  -0.706   2.515  -0.961
  168    HA   LYS  24           HA       LYS  24  -3.300   1.824   0.072
  169   1HB   LYS  24          1HB       LYS  24  -1.290   3.927   0.939
  170   2HB   LYS  24          2HB       LYS  24  -2.732   3.504   1.860
  171   1HG   LYS  24          1HG       LYS  24  -1.946   1.172   2.031
  172   2HG   LYS  24          2HG       LYS  24  -0.499   1.592   1.111
  173   1HD   LYS  24          1HD       LYS  24   0.133   3.228   2.850
  174   2HD   LYS  24          2HD       LYS  24  -1.310   2.805   3.771
  175   1HE   LYS  24          1HE       LYS  24  -0.521   0.564   4.127
  176   2HE   LYS  24          2HE       LYS  24   0.811   0.790   2.994
  177   1HZ   LYS  24          1HZ       LYS  24   1.704   2.500   4.466
  178   2HZ   LYS  24          2HZ       LYS  24   0.440   2.231   5.565
  179   3HZ   LYS  24          3HZ       LYS  24   1.576   1.005   5.263
  180    H    VAL  25           H        VAL  25  -1.957   4.776  -1.390
  181    HA   VAL  25           HA       VAL  25  -4.296   6.396  -1.030
  182    HB   VAL  25           HB       VAL  25  -2.037   6.536  -3.042
  183   1HG1  VAL  25          1HG1      VAL  25  -4.332   8.439  -2.519
  184   2HG1  VAL  25          2HG1      VAL  25  -2.849   8.923  -3.340
  185   3HG1  VAL  25          3HG1      VAL  25  -3.886   7.691  -4.053
  186   1HG2  VAL  25          1HG2      VAL  25  -1.507   6.880  -0.612
  187   2HG2  VAL  25          2HG2      VAL  25  -1.207   8.310  -1.599
  188   3HG2  VAL  25          3HG2      VAL  25  -2.654   8.219  -0.596
  189    H    LEU  26           H        LEU  26  -3.165   4.425  -3.795
  190    HA   LEU  26           HA       LEU  26  -5.392   5.011  -5.491
  191   1HB   LEU  26          1HB       LEU  26  -3.534   2.618  -5.362
  192   2HB   LEU  26          2HB       LEU  26  -4.740   2.831  -6.630
  193    HG   LEU  26           HG       LEU  26  -2.589   4.868  -5.980
  194   1HD1  LEU  26          1HD1      LEU  26  -2.665   2.738  -8.138
  195   2HD1  LEU  26          2HD1      LEU  26  -1.470   4.032  -8.038
  196   3HD1  LEU  26          3HD1      LEU  26  -1.547   2.804  -6.775
  197   1HD2  LEU  26          1HD2      LEU  26  -4.759   4.654  -8.060
  198   2HD2  LEU  26          2HD2      LEU  26  -4.217   6.063  -7.152
  199   3HD2  LEU  26          3HD2      LEU  26  -3.248   5.455  -8.488
  200    H    ALA  27           H        ALA  27  -4.879   2.466  -3.066
  201    HA   ALA  27           HA       ALA  27  -7.404   1.148  -3.602
  202   1HB   ALA  27          1HB       ALA  27  -5.629  -0.100  -2.518
  203   2HB   ALA  27          2HB       ALA  27  -5.556   1.071  -1.200
  204   3HB   ALA  27          3HB       ALA  27  -6.975   0.040  -1.386
  205    H    ASN  28           H        ASN  28  -6.366   3.765  -1.485
  206    HA   ASN  28           HA       ASN  28  -8.607   3.842   0.259
  207   1HB   ASN  28          1HB       ASN  28  -6.433   5.183   0.414
  208   2HB   ASN  28          2HB       ASN  28  -7.151   6.289  -0.757
  209   2HD2  ASN  28          2HD2      ASN  28  -6.685   6.019   2.482
  210   1HD2  ASN  28          1HD2      ASN  28  -8.072   6.813   3.054
  211    H    ARG  29           H        ARG  29  -8.111   5.473  -2.883
  212    HA   ARG  29           HA       ARG  29 -10.691   6.766  -2.853
  213   1HB   ARG  29          1HB       ARG  29  -8.749   6.143  -5.092
  214   2HB   ARG  29          2HB       ARG  29 -10.237   7.061  -5.330
  215   1HG   ARG  29          1HG       ARG  29  -9.500   8.704  -3.642
  216   2HG   ARG  29          2HG       ARG  29  -8.010   7.791  -3.403
  217   1HD   ARG  29          1HD       ARG  29  -7.405   8.154  -5.769
  218   2HD   ARG  29          2HD       ARG  29  -8.896   9.066  -6.010
  219    HE   ARG  29           HE       ARG  29  -7.651  10.361  -3.894
  220   1HH1  ARG  29          1HH1      ARG  29  -6.226  12.088  -4.202
  221   2HH1  ARG  29          2HH1      ARG  29  -5.380  12.237  -5.705
  222   1HH2  ARG  29          1HH2      ARG  29  -6.796   9.394  -7.092
  223   2HH2  ARG  29          2HH2      ARG  29  -5.702  10.713  -7.341
  224    H    GLU  30           H        GLU  30  -9.559   3.617  -3.920
  225    HA   GLU  30           HA       GLU  30 -11.737   2.903  -5.602
  226   1HB   GLU  30          1HB       GLU  30  -9.654   1.581  -5.406
  227   2HB   GLU  30          2HB       GLU  30 -10.105   1.123  -3.764
  228   1HG   GLU  30          1HG       GLU  30 -12.141   0.020  -4.623
  229   2HG   GLU  30          2HG       GLU  30 -11.697   0.483  -6.266
  230    H    LEU  31           H        LEU  31 -11.385   2.656  -2.061
  231    HA   LEU  31           HA       LEU  31 -13.806   1.218  -1.574
  232   1HB   LEU  31          1HB       LEU  31 -12.823   3.404   0.274
  233   2HB   LEU  31          2HB       LEU  31 -13.571   1.864   0.690
  234    HG   LEU  31           HG       LEU  31 -10.801   2.320  -0.412
  235   1HD1  LEU  31          1HD1      LEU  31 -11.118   2.675   2.021
  236   2HD1  LEU  31          2HD1      LEU  31 -11.801   1.055   2.160
  237   3HD1  LEU  31          3HD1      LEU  31 -10.111   1.263   1.701
  238   1HD2  LEU  31          1HD2      LEU  31 -12.429  -0.213  -0.081
  239   2HD2  LEU  31          2HD2      LEU  31 -11.545   0.334  -1.506
  240   3HD2  LEU  31          3HD2      LEU  31 -10.665  -0.246  -0.091
  241    H    ASP  32           H        ASP  32 -13.119   4.681  -1.656
  242    HA   ASP  32           HA       ASP  32 -15.757   5.627  -1.215
  243   1HB   ASP  32          1HB       ASP  32 -13.300   6.719  -2.574
  244   2HB   ASP  32          2HB       ASP  32 -14.802   7.650  -2.576
  245    H    LYS  33           H        LYS  33 -14.148   4.431  -4.103
  246    HA   LYS  33           HA       LYS  33 -15.963   5.411  -6.061
  247   1HB   LYS  33          1HB       LYS  33 -13.751   4.233  -6.470
  248   2HB   LYS  33          2HB       LYS  33 -14.579   2.719  -6.117
  249   1HG   LYS  33          1HG       LYS  33 -16.175   3.154  -7.939
  250   2HG   LYS  33          2HG       LYS  33 -15.348   4.671  -8.301
  251   1HD   LYS  33          1HD       LYS  33 -13.229   3.327  -8.627
  252   2HD   LYS  33          2HD       LYS  33 -14.218   1.870  -8.517
  253   1HE   LYS  33          1HE       LYS  33 -14.604   4.105 -10.524
  254   2HE   LYS  33          2HE       LYS  33 -13.871   2.539 -10.866
  255   1HZ   LYS  33          1HZ       LYS  33 -16.023   1.571  -9.975
  256   2HZ   LYS  33          2HZ       LYS  33 -16.672   3.134 -10.130
  257   3HZ   LYS  33          3HZ       LYS  33 -16.090   2.312 -11.499
  258    H    TYR  34           H        TYR  34 -16.078   2.474  -4.035
  259    HA   TYR  34           HA       TYR  34 -18.723   1.766  -5.191
  260   1HB   TYR  34          1HB       TYR  34 -17.021   0.361  -3.108
  261   2HB   TYR  34          2HB       TYR  34 -18.539  -0.254  -3.760
  262    HD1  TYR  34           HD1      TYR  34 -18.713  -0.845  -6.187
  263    HD2  TYR  34           HD2      TYR  34 -14.979   0.232  -4.357
  264    HE1  TYR  34           HE1      TYR  34 -17.488  -1.826  -8.108
  265    HE2  TYR  34           HE2      TYR  34 -13.754  -0.745  -6.277
  266    HH   TYR  34           HH       TYR  34 -13.923  -1.885  -8.178
  267    H    GLY  35           H        GLY  35 -17.548   3.736  -2.753
  268   1HA   GLY  35          1HA       GLY  35 -20.210   4.055  -1.613
  269   2HA   GLY  35          2HA       GLY  35 -18.774   4.966  -1.153
  270    H    VAL  36           H        VAL  36 -17.295   2.346  -0.663
  271    HA   VAL  36           HA       VAL  36 -18.704   0.927   1.410
  272    HB   VAL  36           HB       VAL  36 -15.694   1.146   1.315
  273   1HG1  VAL  36          1HG1      VAL  36 -17.031  -0.231   3.040
  274   2HG1  VAL  36          2HG1      VAL  36 -17.424  -1.301   1.696
  275   3HG1  VAL  36          3HG1      VAL  36 -15.743  -1.062   2.173
  276   1HG2  VAL  36          1HG2      VAL  36 -17.534  -0.233  -0.647
  277   2HG2  VAL  36          2HG2      VAL  36 -16.181   0.843  -0.986
  278   3HG2  VAL  36          3HG2      VAL  36 -15.879  -0.783  -0.383
  279    H    SER  37           H        SER  37 -18.139   1.004   3.752
  280    HA   SER  37           HA       SER  37 -18.417   3.556   4.888
  281   1HB   SER  37          1HB       SER  37 -18.065   2.532   6.972
  282   2HB   SER  37          2HB       SER  37 -18.595   1.183   5.972
  283    HG   SER  37           HG       SER  37 -16.093   1.774   7.032
  284    H    ASP  38           H        ASP  38 -16.948   5.059   5.739
  285    HA   ASP  38           HA       ASP  38 -14.402   5.275   4.397
  286   1HB   ASP  38          1HB       ASP  38 -14.105   7.277   5.824
  287   2HB   ASP  38          2HB       ASP  38 -15.715   7.246   5.103
  288    H    TYR  39           H        TYR  39 -15.403   3.682   7.258
  289    HA   TYR  39           HA       TYR  39 -13.081   3.861   8.879
  290   1HB   TYR  39          1HB       TYR  39 -15.124   2.913   9.750
  291   2HB   TYR  39          2HB       TYR  39 -15.101   1.632   8.538
  292    HD1  TYR  39           HD1      TYR  39 -13.589   2.867  11.663
  293    HD2  TYR  39           HD2      TYR  39 -13.523  -0.203   8.664
  294    HE1  TYR  39           HE1      TYR  39 -12.183   1.453  13.140
  295    HE2  TYR  39           HE2      TYR  39 -12.124  -1.613  10.129
  296    HH   TYR  39           HH       TYR  39 -10.853  -0.392  13.195
  297    H    TYR  40           H        TYR  40 -13.841   1.611   6.232
  298    HA   TYR  40           HA       TYR  40 -11.646  -0.139   6.554
  299   1HB   TYR  40          1HB       TYR  40 -13.153   0.709   4.073
  300   2HB   TYR  40          2HB       TYR  40 -11.952  -0.581   4.083
  301    HD1  TYR  40           HD1      TYR  40 -12.265  -2.463   5.866
  302    HD2  TYR  40           HD2      TYR  40 -15.383   0.223   4.636
  303    HE1  TYR  40           HE1      TYR  40 -13.969  -4.057   6.705
  304    HE2  TYR  40           HE2      TYR  40 -17.088  -1.372   5.475
  305    HH   TYR  40           HH       TYR  40 -16.765  -3.493   7.529
  306    H    LYS  41           H        LYS  41 -11.755   3.016   4.876
  307    HA   LYS  41           HA       LYS  41  -9.247   2.717   3.560
  308   1HB   LYS  41          1HB       LYS  41  -9.513   4.922   2.908
  309   2HB   LYS  41          2HB       LYS  41 -11.156   4.620   3.454
  310   1HG   LYS  41          1HG       LYS  41 -10.625   5.638   5.644
  311   2HG   LYS  41          2HG       LYS  41  -8.964   5.918   5.123
  312   1HD   LYS  41          1HD       LYS  41 -10.270   7.966   4.854
  313   2HD   LYS  41          2HD       LYS  41  -9.778   7.346   3.280
  314   1HE   LYS  41          1HE       LYS  41 -11.940   6.685   2.714
  315   2HE   LYS  41          2HE       LYS  41 -12.438   6.513   4.396
  316   1HZ   LYS  41          1HZ       LYS  41 -12.297   8.938   4.615
  317   2HZ   LYS  41          2HZ       LYS  41 -11.926   9.060   2.962
  318   3HZ   LYS  41          3HZ       LYS  41 -13.438   8.462   3.448
  319    H    ASN  42           H        ASN  42 -10.100   3.843   6.793
  320    HA   ASN  42           HA       ASN  42  -7.445   4.608   7.523
  321   1HB   ASN  42          1HB       ASN  42  -9.834   3.784   9.188
  322   2HB   ASN  42          2HB       ASN  42  -8.319   4.348   9.892
  323   2HD2  ASN  42          2HD2      ASN  42  -7.545   6.512   8.517
  324   1HD2  ASN  42          1HD2      ASN  42  -8.761   7.692   8.415
  325    H    LEU  43           H        LEU  43  -9.228   1.561   7.767
  326    HA   LEU  43           HA       LEU  43  -7.358   0.157   9.368
  327   1HB   LEU  43          1HB       LEU  43  -9.612  -0.703   8.862
  328   2HB   LEU  43          2HB       LEU  43  -9.161  -0.911   7.172
  329    HG   LEU  43           HG       LEU  43  -7.430  -2.547   7.830
  330   1HD1  LEU  43          1HD1      LEU  43  -8.360  -1.775  10.595
  331   2HD1  LEU  43          2HD1      LEU  43  -7.700  -3.385  10.307
  332   3HD1  LEU  43          3HD1      LEU  43  -6.713  -1.961   9.991
  333   1HD2  LEU  43          1HD2      LEU  43 -10.207  -3.058   8.943
  334   2HD2  LEU  43          2HD2      LEU  43  -9.650  -3.401   7.306
  335   3HD2  LEU  43          3HD2      LEU  43  -9.005  -4.319   8.666
  336    H    ILE  44           H        ILE  44  -7.490   0.565   5.814
  337    HA   ILE  44           HA       ILE  44  -5.293  -1.154   5.203
  338    HB   ILE  44           HB       ILE  44  -6.337   1.331   3.818
  339   1HG1  ILE  44          1HG1      ILE  44  -6.534  -1.600   3.072
  340   2HG1  ILE  44          2HG1      ILE  44  -7.774  -0.751   3.996
  341   1HG2  ILE  44          1HG2      ILE  44  -4.168  -0.626   3.009
  342   2HG2  ILE  44          2HG2      ILE  44  -5.035   0.359   1.830
  343   3HG2  ILE  44          3HG2      ILE  44  -4.065   1.134   3.084
  344   1HD1  ILE  44          1HD1      ILE  44  -7.822   0.945   2.071
  345   2HD1  ILE  44          2HD1      ILE  44  -6.886  -0.236   1.155
  346   3HD1  ILE  44          3HD1      ILE  44  -8.500  -0.648   1.733
  347    H    ASN  45           H        ASN  45  -5.403   2.270   6.115
  348    HA   ASN  45           HA       ASN  45  -2.814   3.099   5.646
  349   1HB   ASN  45          1HB       ASN  45  -4.652   4.429   6.755
  350   2HB   ASN  45          2HB       ASN  45  -4.253   3.604   8.261
  351   2HD2  ASN  45          2HD2      ASN  45  -3.598   5.782   9.117
  352   1HD2  ASN  45          1HD2      ASN  45  -2.079   6.414   8.703
  353    H    ASN  46           H        ASN  46  -3.782   0.621   7.930
  354    HA   ASN  46           HA       ASN  46  -1.158   0.721   9.303
  355   1HB   ASN  46          1HB       ASN  46  -2.033  -0.906  10.805
  356   2HB   ASN  46          2HB       ASN  46  -3.359   0.209  10.491
  357   2HD2  ASN  46          2HD2      ASN  46  -4.164  -2.243  11.378
  358   1HD2  ASN  46          1HD2      ASN  46  -4.786  -3.190  10.114
  359    H    ALA  47           H        ALA  47  -2.213  -0.530   6.415
  360    HA   ALA  47           HA       ALA  47  -1.014  -3.162   6.519
  361   1HB   ALA  47          1HB       ALA  47  -1.841  -1.344   4.252
  362   2HB   ALA  47          2HB       ALA  47  -1.068  -2.901   3.960
  363   3HB   ALA  47          3HB       ALA  47  -2.618  -2.829   4.797
  364    H    LYS  48           H        LYS  48   1.089  -3.755   6.129
  365    HA   LYS  48           HA       LYS  48   3.065  -1.553   5.625
  366   1HB   LYS  48          1HB       LYS  48   3.486  -4.290   6.866
  367   2HB   LYS  48          2HB       LYS  48   4.699  -3.022   6.719
  368   1HG   LYS  48          1HG       LYS  48   2.095  -2.684   8.236
  369   2HG   LYS  48          2HG       LYS  48   3.608  -3.169   8.996
  370   1HD   LYS  48          1HD       LYS  48   4.606  -1.031   7.919
  371   2HD   LYS  48          2HD       LYS  48   2.931  -0.538   7.676
  372   1HE   LYS  48          1HE       LYS  48   2.485  -0.719  10.065
  373   2HE   LYS  48          2HE       LYS  48   4.117  -1.323  10.351
  374   1HZ   LYS  48          1HZ       LYS  48   4.105   1.127   8.880
  375   2HZ   LYS  48          2HZ       LYS  48   3.340   1.292  10.384
  376   3HZ   LYS  48          3HZ       LYS  48   4.940   0.724  10.304
  377    H    THR  49           H        THR  49   1.900  -4.667   4.510
  378    HA   THR  49           HA       THR  49   4.046  -4.769   2.429
  379    HB   THR  49           HB       THR  49   3.276  -7.074   2.065
  380    HG1  THR  49           HG1      THR  49   1.491  -7.805   2.981
  381   1HG2  THR  49          1HG2      THR  49   4.902  -6.500   3.910
  382   2HG2  THR  49          2HG2      THR  49   3.541  -6.530   5.031
  383   3HG2  THR  49          3HG2      THR  49   4.006  -7.996   4.169
  384    H    VAL  50           H        VAL  50   3.543  -4.560   0.263
  385    HA   VAL  50           HA       VAL  50   1.172  -3.189  -0.526
  386    HB   VAL  50           HB       VAL  50   3.171  -4.802  -2.113
  387   1HG1  VAL  50          1HG1      VAL  50   0.826  -3.125  -3.015
  388   2HG1  VAL  50          2HG1      VAL  50   2.211  -3.430  -4.065
  389   3HG1  VAL  50          3HG1      VAL  50   1.230  -4.776  -3.485
  390   1HG2  VAL  50          1HG2      VAL  50   2.777  -1.840  -1.608
  391   2HG2  VAL  50          2HG2      VAL  50   4.140  -2.833  -1.092
  392   3HG2  VAL  50          3HG2      VAL  50   3.901  -2.485  -2.804
  393    H    GLU  51           H        GLU  51   2.073  -6.645  -0.834
  394    HA   GLU  51           HA       GLU  51  -0.313  -7.459  -2.159
  395   1HB   GLU  51          1HB       GLU  51   0.255  -9.710  -1.492
  396   2HB   GLU  51          2HB       GLU  51   1.765  -8.872  -1.839
  397   1HG   GLU  51          1HG       GLU  51   1.932  -8.356   0.638
  398   2HG   GLU  51          2HG       GLU  51   0.571  -9.450   0.885
  399    H    GLY  52           H        GLY  52   0.476  -6.988   1.237
  400   1HA   GLY  52          1HA       GLY  52  -0.917  -6.826   3.113
  401   2HA   GLY  52          2HA       GLY  52  -1.912  -8.070   2.352
  402    H    VAL  53           H        VAL  53  -1.183  -4.969   0.809
  403    HA   VAL  53           HA       VAL  53  -3.602  -3.645   1.688
  404    HB   VAL  53           HB       VAL  53  -1.863  -3.139  -0.745
  405   1HG1  VAL  53          1HG1      VAL  53  -4.134  -1.590   0.510
  406   2HG1  VAL  53          2HG1      VAL  53  -2.940  -0.828  -0.539
  407   3HG1  VAL  53          3HG1      VAL  53  -3.972  -2.112  -1.166
  408   1HG2  VAL  53          1HG2      VAL  53  -0.753  -2.922   1.494
  409   2HG2  VAL  53          2HG2      VAL  53  -0.852  -1.394   0.621
  410   3HG2  VAL  53          3HG2      VAL  53  -1.973  -1.731   1.941
  411    H    LYS  54           H        LYS  54  -2.760  -5.150  -1.460
  412    HA   LYS  54           HA       LYS  54  -5.404  -4.928  -2.542
  413   1HB   LYS  54          1HB       LYS  54  -3.400  -5.347  -3.936
  414   2HB   LYS  54          2HB       LYS  54  -3.236  -6.942  -3.202
  415   1HG   LYS  54          1HG       LYS  54  -5.331  -7.675  -4.131
  416   2HG   LYS  54          2HG       LYS  54  -5.729  -6.042  -4.664
  417   1HD   LYS  54          1HD       LYS  54  -4.937  -7.318  -6.580
  418   2HD   LYS  54          2HD       LYS  54  -3.733  -6.097  -6.172
  419   1HE   LYS  54          1HE       LYS  54  -2.287  -7.691  -5.180
  420   2HE   LYS  54          2HE       LYS  54  -3.564  -8.903  -5.067
  421   1HZ   LYS  54          1HZ       LYS  54  -2.916  -7.897  -7.725
  422   2HZ   LYS  54          2HZ       LYS  54  -1.767  -8.910  -6.989
  423   3HZ   LYS  54          3HZ       LYS  54  -3.352  -9.463  -7.232
  424    H    ALA  55           H        ALA  55  -3.776  -7.497  -0.720
  425    HA   ALA  55           HA       ALA  55  -5.819  -9.468  -0.951
  426   1HB   ALA  55          1HB       ALA  55  -4.796 -10.442   1.106
  427   2HB   ALA  55          2HB       ALA  55  -3.821  -8.982   1.275
  428   3HB   ALA  55          3HB       ALA  55  -3.598 -10.033  -0.124
  429    H    LEU  56           H        LEU  56  -5.489  -6.721   1.257
  430    HA   LEU  56           HA       LEU  56  -7.581  -7.567   3.054
  431   1HB   LEU  56          1HB       LEU  56  -5.848  -5.787   3.570
  432   2HB   LEU  56          2HB       LEU  56  -6.717  -4.718   2.473
  433    HG   LEU  56           HG       LEU  56  -8.815  -5.279   3.908
  434   1HD1  LEU  56          1HD1      LEU  56  -6.573  -6.254   5.695
  435   2HD1  LEU  56          2HD1      LEU  56  -8.113  -5.698   6.344
  436   3HD1  LEU  56          3HD1      LEU  56  -8.065  -7.086   5.262
  437   1HD2  LEU  56          1HD2      LEU  56  -6.500  -3.526   4.723
  438   2HD2  LEU  56          2HD2      LEU  56  -8.056  -3.068   4.029
  439   3HD2  LEU  56          3HD2      LEU  56  -7.961  -3.583   5.710
  440    H    ILE  57           H        ILE  57  -7.476  -5.545   0.147
  441    HA   ILE  57           HA       ILE  57 -10.204  -4.699   0.182
  442    HB   ILE  57           HB       ILE  57  -8.463  -5.347  -2.220
  443   1HG1  ILE  57          1HG1      ILE  57  -7.347  -3.685  -0.837
  444   2HG1  ILE  57          2HG1      ILE  57  -8.033  -2.871  -2.238
  445   1HG2  ILE  57          1HG2      ILE  57 -11.000  -3.738  -1.898
  446   2HG2  ILE  57          2HG2      ILE  57  -9.971  -3.653  -3.330
  447   3HG2  ILE  57          3HG2      ILE  57 -10.749  -5.172  -2.890
  448   1HD1  ILE  57          1HD1      ILE  57 -10.105  -2.488  -0.659
  449   2HD1  ILE  57          2HD1      ILE  57  -8.937  -2.790   0.627
  450   3HD1  ILE  57          3HD1      ILE  57  -8.684  -1.457  -0.497
  451    H    ASP  58           H        ASP  58  -8.588  -7.600  -1.040
  452    HA   ASP  58           HA       ASP  58 -10.859  -8.779  -2.305
  453   1HB   ASP  58          1HB       ASP  58  -8.449 -10.027  -0.955
  454   2HB   ASP  58          2HB       ASP  58  -9.645 -10.959  -1.858
  455    H    GLU  59           H        GLU  59  -9.735  -8.872   1.065
  456    HA   GLU  59           HA       GLU  59 -11.795 -10.695   1.952
  457   1HB   GLU  59          1HB       GLU  59 -10.044  -8.711   3.435
  458   2HB   GLU  59          2HB       GLU  59 -11.161  -9.812   4.239
  459   1HG   GLU  59          1HG       GLU  59  -8.957 -10.712   2.362
  460   2HG   GLU  59          2HG       GLU  59  -8.805 -10.682   4.118
  461    H    ILE  60           H        ILE  60 -11.443  -7.171   1.827
  462    HA   ILE  60           HA       ILE  60 -13.919  -6.625   3.183
  463    HB   ILE  60           HB       ILE  60 -12.283  -4.923   1.283
  464   1HG1  ILE  60          1HG1      ILE  60 -12.513  -4.807   4.305
  465   2HG1  ILE  60          2HG1      ILE  60 -11.231  -5.684   3.468
  466   1HG2  ILE  60          1HG2      ILE  60 -14.676  -4.303   3.028
  467   2HG2  ILE  60          2HG2      ILE  60 -13.572  -3.050   2.461
  468   3HG2  ILE  60          3HG2      ILE  60 -14.490  -4.008   1.300
  469   1HD1  ILE  60          1HD1      ILE  60 -11.823  -2.734   3.090
  470   2HD1  ILE  60          2HD1      ILE  60 -10.545  -3.372   4.123
  471   3HD1  ILE  60          3HD1      ILE  60 -10.482  -3.632   2.380
  472    H    LEU  61           H        LEU  61 -13.031  -6.809  -0.270
  473    HA   LEU  61           HA       LEU  61 -15.693  -6.175  -1.195
  474   1HB   LEU  61          1HB       LEU  61 -13.352  -7.550  -2.550
  475   2HB   LEU  61          2HB       LEU  61 -14.865  -7.188  -3.378
  476    HG   LEU  61           HG       LEU  61 -13.001  -5.164  -2.089
  477   1HD1  LEU  61          1HD1      LEU  61 -12.277  -6.267  -4.259
  478   2HD1  LEU  61          2HD1      LEU  61 -13.706  -5.558  -5.010
  479   3HD1  LEU  61          3HD1      LEU  61 -12.452  -4.513  -4.343
  480   1HD2  LEU  61          1HD2      LEU  61 -15.764  -4.950  -3.263
  481   2HD2  LEU  61          2HD2      LEU  61 -15.053  -4.072  -1.909
  482   3HD2  LEU  61          3HD2      LEU  61 -14.634  -3.628  -3.559
  483    H    ALA  62           H        ALA  62 -13.986  -9.211  -0.533
  484    HA   ALA  62           HA       ALA  62 -16.071 -10.932  -1.514
  485   1HB   ALA  62          1HB       ALA  62 -14.087 -11.542   0.694
  486   2HB   ALA  62          2HB       ALA  62 -13.696 -11.632  -1.024
  487   3HB   ALA  62          3HB       ALA  62 -14.918 -12.703  -0.340
  488    H    ALA  63           H        ALA  63 -15.601  -9.209   1.499
  489    HA   ALA  63           HA       ALA  63 -17.348 -10.704   3.168
  490   1HB   ALA  63          1HB       ALA  63 -15.850  -8.892   3.975
  491   2HB   ALA  63          2HB       ALA  63 -16.885  -7.707   3.180
  492   3HB   ALA  63          3HB       ALA  63 -17.512  -8.667   4.519
  493    H    LEU  64           H        LEU  64 -18.042  -8.049   0.891
  494    HA   LEU  64           HA       LEU  64 -20.835  -7.904   1.565
  495   1HB   LEU  64          1HB       LEU  64 -19.266  -7.032  -0.871
  496   2HB   LEU  64          2HB       LEU  64 -20.985  -6.708  -0.692
  497    HG   LEU  64           HG       LEU  64 -18.963  -5.899   1.413
  498   1HD1  LEU  64          1HD1      LEU  64 -19.962  -4.300  -0.964
  499   2HD1  LEU  64          2HD1      LEU  64 -19.043  -3.629   0.384
  500   3HD1  LEU  64          3HD1      LEU  64 -18.303  -4.825  -0.680
  501   1HD2  LEU  64          1HD2      LEU  64 -21.855  -5.227   0.816
  502   2HD2  LEU  64          2HD2      LEU  64 -21.138  -5.759   2.335
  503   3HD2  LEU  64          3HD2      LEU  64 -20.852  -4.124   1.756
  504    HA   PRO  65           HA       PRO  65 -22.309 -11.532  -0.560
  505   1HB   PRO  65          1HB       PRO  65 -24.700 -10.438  -1.637
  506   2HB   PRO  65          2HB       PRO  65 -24.516 -11.219  -0.063
  507   1HG   PRO  65          1HG       PRO  65 -24.765  -8.342  -0.701
  508   2HG   PRO  65          2HG       PRO  65 -25.097  -9.186   0.818
  509   1HD   PRO  65          1HD       PRO  65 -22.872  -7.548   0.346
  510   2HD   PRO  65          2HD       PRO  65 -22.981  -8.770   1.636

  No H/Q in entry =         510
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1  34.640  -5.511 -24.378
    2    H2   MET   1           H2       MET   1  35.382  -6.195 -23.012
    3    H3   MET   1           H3       MET   1  35.382  -7.036 -24.484
    4    HA   MET   1           HA       MET   1  33.292  -7.796 -24.237
    5   1HB   MET   1          1HB       MET   1  34.098  -7.004 -21.427
    6   2HB   MET   1          2HB       MET   1  32.709  -8.031 -21.783
    7   1HG   MET   1          1HG       MET   1  34.195  -9.632 -22.943
    8   2HG   MET   1          2HG       MET   1  35.583  -8.614 -22.561
    9   1HE   MET   1          1HE       MET   1  36.117  -7.773 -20.434
   10   2HE   MET   1          2HE       MET   1  34.784  -7.735 -19.282
   11   3HE   MET   1          3HE       MET   1  36.196  -8.754 -18.973
   12    H    LYS   2           H        LYS   2  31.018  -7.363 -23.635
   13    HA   LYS   2           HA       LYS   2  30.413  -4.466 -23.821
   14   1HB   LYS   2          1HB       LYS   2  27.971  -5.519 -23.952
   15   2HB   LYS   2          2HB       LYS   2  29.044  -5.562 -25.348
   16   1HG   LYS   2          1HG       LYS   2  27.994  -7.758 -24.952
   17   2HG   LYS   2          2HG       LYS   2  29.743  -7.846 -24.773
   18   1HD   LYS   2          1HD       LYS   2  29.599  -7.904 -22.396
   19   2HD   LYS   2          2HD       LYS   2  27.911  -7.393 -22.410
   20   1HE   LYS   2          1HE       LYS   2  27.254  -9.510 -23.461
   21   2HE   LYS   2          2HE       LYS   2  28.941 -10.017 -23.530
   22   1HZ   LYS   2          1HZ       LYS   2  27.959  -9.198 -20.921
   23   2HZ   LYS   2          2HZ       LYS   2  27.308 -10.641 -21.533
   24   3HZ   LYS   2          3HZ       LYS   2  28.989 -10.482 -21.344
   25    H    ALA   3           H        ALA   3  30.998  -6.585 -21.383
   26    HA   ALA   3           HA       ALA   3  28.845  -5.636 -19.572
   27   1HB   ALA   3          1HB       ALA   3  29.733  -8.058 -19.670
   28   2HB   ALA   3          2HB       ALA   3  29.563  -7.327 -18.075
   29   3HB   ALA   3          3HB       ALA   3  31.153  -7.440 -18.830
   30    H    ILE   4           H        ILE   4  29.173  -4.022 -18.117
   31    HA   ILE   4           HA       ILE   4  31.960  -3.227 -17.396
   32    HB   ILE   4           HB       ILE   4  31.385  -0.852 -17.705
   33   1HG1  ILE   4          1HG1      ILE   4  28.790  -1.929 -18.861
   34   2HG1  ILE   4          2HG1      ILE   4  28.946  -1.032 -17.351
   35   1HG2  ILE   4          1HG2      ILE   4  32.367  -2.247 -19.576
   36   2HG2  ILE   4          2HG2      ILE   4  30.736  -2.395 -20.226
   37   3HG2  ILE   4          3HG2      ILE   4  31.495  -0.807 -20.106
   38   1HD1  ILE   4          1HD1      ILE   4  30.050   0.819 -18.760
   39   2HD1  ILE   4          2HD1      ILE   4  29.406  -0.034 -20.162
   40   3HD1  ILE   4          3HD1      ILE   4  28.306   0.606 -18.941
   41    H    PHE   5           H        PHE   5  31.801  -1.557 -15.492
   42    HA   PHE   5           HA       PHE   5  30.557  -2.751 -13.283
   43   1HB   PHE   5          1HB       PHE   5  32.264  -0.926 -13.155
   44   2HB   PHE   5          2HB       PHE   5  31.028   0.226 -13.654
   45    HD1  PHE   5           HD1      PHE   5  32.150  -2.031 -10.961
   46    HD2  PHE   5           HD2      PHE   5  29.233   0.893 -12.145
   47    HE1  PHE   5           HE1      PHE   5  31.401  -1.826  -8.607
   48    HE2  PHE   5           HE2      PHE   5  28.483   1.096  -9.788
   49    HZ   PHE   5           HZ       PHE   5  29.566  -0.264  -8.020
   50    H    VAL   6           H        VAL   6  28.497  -2.681 -12.422
   51    HA   VAL   6           HA       VAL   6  26.351  -1.781 -14.149
   52    HB   VAL   6           HB       VAL   6  24.861  -2.576 -12.361
   53   1HG1  VAL   6          1HG1      VAL   6  25.983  -4.200 -13.908
   54   2HG1  VAL   6          2HG1      VAL   6  27.232  -4.437 -12.686
   55   3HG1  VAL   6          3HG1      VAL   6  25.564  -4.899 -12.342
   56   1HG2  VAL   6          1HG2      VAL   6  27.444  -2.748 -10.785
   57   2HG2  VAL   6          2HG2      VAL   6  26.012  -1.797 -10.392
   58   3HG2  VAL   6          3HG2      VAL   6  25.954  -3.554 -10.295
   59    H    LEU   7           H        LEU   7  25.197   0.098 -14.059
   60    HA   LEU   7           HA       LEU   7  24.999   1.736 -11.695
   61   1HB   LEU   7          1HB       LEU   7  26.238   3.710 -12.552
   62   2HB   LEU   7          2HB       LEU   7  27.297   2.339 -12.257
   63    HG   LEU   7           HG       LEU   7  26.994   1.755 -14.741
   64   1HD1  LEU   7          1HD1      LEU   7  25.466   4.303 -14.609
   65   2HD1  LEU   7          2HD1      LEU   7  26.632   4.212 -15.927
   66   3HD1  LEU   7          3HD1      LEU   7  25.381   2.991 -15.777
   67   1HD2  LEU   7          1HD2      LEU   7  28.437   4.263 -13.839
   68   2HD2  LEU   7          2HD2      LEU   7  29.087   2.625 -13.918
   69   3HD2  LEU   7          3HD2      LEU   7  28.707   3.498 -15.403
   70    H    ASN   8           H        ASN   8  24.249   0.906 -14.883
   71    HA   ASN   8           HA       ASN   8  22.751   3.250 -15.651
   72   1HB   ASN   8          1HB       ASN   8  21.800   1.791 -17.394
   73   2HB   ASN   8          2HB       ASN   8  23.550   1.586 -17.290
   74   2HD2  ASN   8          2HD2      ASN   8  21.803  -0.472 -18.340
   75   1HD2  ASN   8          1HD2      ASN   8  21.878  -1.799 -17.284
   76    H    ALA   9           H        ALA   9  21.879   0.211 -14.025
   77    HA   ALA   9           HA       ALA   9  19.048   1.062 -13.829
   78   1HB   ALA   9          1HB       ALA   9  19.392  -1.267 -14.326
   79   2HB   ALA   9          2HB       ALA   9  18.800  -1.169 -12.668
   80   3HB   ALA   9          3HB       ALA   9  20.514  -1.444 -12.975
   81    H    GLN  10           H        GLN  10  17.980   1.336 -11.811
   82    HA   GLN  10           HA       GLN  10  19.660   2.538  -9.734
   83   1HB   GLN  10          1HB       GLN  10  16.669   2.143  -9.997
   84   2HB   GLN  10          2HB       GLN  10  17.428   2.938  -8.617
   85   1HG   GLN  10          1HG       GLN  10  18.454   4.598 -10.123
   86   2HG   GLN  10          2HG       GLN  10  17.708   3.803 -11.510
   87   2HE2  GLN  10          2HE2      GLN  10  17.257   6.578 -10.177
   88   1HE2  GLN  10          1HE2      GLN  10  15.573   6.650  -9.977
   89    H    HIS  11           H        HIS  11  19.302   1.903  -7.408
   90    HA   HIS  11           HA       HIS  11  20.153  -0.629  -6.761
   91   1HB   HIS  11          1HB       HIS  11  18.212   1.107  -5.212
   92   2HB   HIS  11          2HB       HIS  11  19.038  -0.297  -4.533
   93    HD1  HIS  11           HD1      HIS  11  21.800  -0.164  -4.852
   94    HD2  HIS  11           HD2      HIS  11  19.683   3.428  -4.939
   95    HE1  HIS  11           HE1      HIS  11  23.486   1.673  -4.407
   96    H    ASP  12           H        ASP  12  19.181  -2.240  -8.065
   97    HA   ASP  12           HA       ASP  12  16.376  -2.688  -8.316
   98   1HB   ASP  12          1HB       ASP  12  18.739  -4.572  -8.523
   99   2HB   ASP  12          2HB       ASP  12  17.085  -5.048  -8.910
  100    H    GLU  13           H        GLU  13  18.751  -3.892  -5.959
  101    HA   GLU  13           HA       GLU  13  17.069  -5.753  -4.649
  102   1HB   GLU  13          1HB       GLU  13  18.547  -5.416  -2.670
  103   2HB   GLU  13          2HB       GLU  13  19.448  -5.680  -4.158
  104   1HG   GLU  13          1HG       GLU  13  18.811  -2.891  -3.164
  105   2HG   GLU  13          2HG       GLU  13  20.242  -3.764  -2.623
  106    H    ALA  14           H        ALA  14  16.934  -2.291  -4.650
  107    HA   ALA  14           HA       ALA  14  15.751  -1.764  -2.142
  108   1HB   ALA  14          1HB       ALA  14  14.808   0.213  -3.136
  109   2HB   ALA  14          2HB       ALA  14  14.853  -0.502  -4.746
  110   3HB   ALA  14          3HB       ALA  14  16.358  -0.063  -3.934
  111    H    VAL  15           H        VAL  15  13.871  -2.486  -1.246
  112    HA   VAL  15           HA       VAL  15  12.172  -4.366  -2.535
  113    HB   VAL  15           HB       VAL  15  11.644  -2.567  -0.154
  114   1HG1  VAL  15          1HG1      VAL  15  10.121  -4.924  -1.281
  115   2HG1  VAL  15          2HG1      VAL  15   9.946  -4.397   0.393
  116   3HG1  VAL  15          3HG1      VAL  15   9.510  -3.308  -0.925
  117   1HG2  VAL  15          1HG2      VAL  15  12.692  -5.393  -0.461
  118   2HG2  VAL  15          2HG2      VAL  15  13.509  -4.016   0.280
  119   3HG2  VAL  15          3HG2      VAL  15  12.113  -4.745   1.073
  120    H    ASP  16           H        ASP  16  11.597  -0.894  -1.862
  121    HA   ASP  16           HA       ASP  16  10.203  -0.460  -4.335
  122   1HB   ASP  16          1HB       ASP  16   7.921  -0.084  -3.323
  123   2HB   ASP  16          2HB       ASP  16   8.413  -1.777  -3.375
  124    H    ALA  17           H        ALA  17   8.531   1.636  -3.638
  125    HA   ALA  17           HA       ALA  17   9.894   3.419  -1.754
  126   1HB   ALA  17          1HB       ALA  17  11.385   3.748  -3.610
  127   2HB   ALA  17          2HB       ALA  17  10.041   3.865  -4.746
  128   3HB   ALA  17          3HB       ALA  17  10.315   5.149  -3.568
  129    H    ASN  18           H        ASN  18   8.484   5.088  -4.351
  130    HA   ASN  18           HA       ASN  18   6.267   5.985  -2.738
  131   1HB   ASN  18          1HB       ASN  18   6.948   6.323  -5.666
  132   2HB   ASN  18          2HB       ASN  18   5.530   7.064  -4.923
  133   2HD2  ASN  18          2HD2      ASN  18   6.279   8.120  -2.600
  134   1HD2  ASN  18          1HD2      ASN  18   7.624   9.146  -2.738
  135    H    SER  19           H        SER  19   6.694   3.301  -4.868
  136    HA   SER  19           HA       SER  19   4.030   2.903  -5.782
  137   1HB   SER  19          1HB       SER  19   6.164   0.865  -5.071
  138   2HB   SER  19          2HB       SER  19   4.693   0.501  -5.970
  139    HG   SER  19           HG       SER  19   6.039   2.659  -6.953
  140    H    LEU  20           H        LEU  20   5.615   1.936  -2.754
  141    HA   LEU  20           HA       LEU  20   3.491   0.351  -1.713
  142   1HB   LEU  20          1HB       LEU  20   5.973   0.854  -0.879
  143   2HB   LEU  20          2HB       LEU  20   5.165   2.057   0.116
  144    HG   LEU  20           HG       LEU  20   4.541  -0.913   0.046
  145   1HD1  LEU  20          1HD1      LEU  20   5.807   0.849   2.164
  146   2HD1  LEU  20          2HD1      LEU  20   5.398  -0.853   2.371
  147   3HD1  LEU  20          3HD1      LEU  20   6.634  -0.380   1.208
  148   1HD2  LEU  20          1HD2      LEU  20   3.241   1.440   1.425
  149   2HD2  LEU  20          2HD2      LEU  20   2.477   0.126   0.527
  150   3HD2  LEU  20          3HD2      LEU  20   3.152  -0.173   2.128
  151    H    ALA  21           H        ALA  21   4.227   3.821  -1.152
  152    HA   ALA  21           HA       ALA  21   1.885   4.341   0.394
  153   1HB   ALA  21          1HB       ALA  21   4.007   5.797   0.120
  154   2HB   ALA  21          2HB       ALA  21   3.240   6.403  -1.348
  155   3HB   ALA  21          3HB       ALA  21   2.457   6.632   0.217
  156    H    GLU  22           H        GLU  22   2.547   4.610  -3.080
  157    HA   GLU  22           HA       GLU  22   0.098   5.828  -3.849
  158   1HB   GLU  22          1HB       GLU  22   2.089   5.525  -5.334
  159   2HB   GLU  22          2HB       GLU  22   1.705   3.806  -5.433
  160   1HG   GLU  22          1HG       GLU  22  -0.483   4.323  -6.408
  161   2HG   GLU  22          2HG       GLU  22  -0.156   6.052  -6.262
  162    H    ALA  23           H        ALA  23   0.941   2.400  -3.381
  163    HA   ALA  23           HA       ALA  23  -1.466   1.292  -4.404
  164   1HB   ALA  23          1HB       ALA  23   0.020   0.186  -2.013
  165   2HB   ALA  23          2HB       ALA  23  -0.893  -0.704  -3.232
  166   3HB   ALA  23          3HB       ALA  23   0.647   0.046  -3.656
  167    H    LYS  24           H        LYS  24  -0.683   2.479  -1.126
  168    HA   LYS  24           HA       LYS  24  -3.259   1.779  -0.034
  169   1HB   LYS  24          1HB       LYS  24  -1.194   3.825   0.829
  170   2HB   LYS  24          2HB       LYS  24  -2.665   3.483   1.743
  171   1HG   LYS  24          1HG       LYS  24  -2.001   1.108   1.921
  172   2HG   LYS  24          2HG       LYS  24  -0.527   1.457   1.018
  173   1HD   LYS  24          1HD       LYS  24   0.182   3.039   2.776
  174   2HD   LYS  24          2HD       LYS  24  -1.291   2.688   3.681
  175   1HE   LYS  24          1HE       LYS  24  -0.640   0.386   3.991
  176   2HE   LYS  24          2HE       LYS  24   0.730   0.572   2.895
  177   1HZ   LYS  24          1HZ       LYS  24   1.390   2.435   4.552
  178   2HZ   LYS  24          2HZ       LYS  24   0.385   1.595   5.629
  179   3HZ   LYS  24          3HZ       LYS  24   1.722   0.813   4.930
  180    H    VAL  25           H        VAL  25  -1.938   4.686  -1.582
  181    HA   VAL  25           HA       VAL  25  -4.230   6.351  -1.186
  182    HB   VAL  25           HB       VAL  25  -2.099   6.351  -3.333
  183   1HG1  VAL  25          1HG1      VAL  25  -4.380   8.254  -2.796
  184   2HG1  VAL  25          2HG1      VAL  25  -2.913   8.776  -3.624
  185   3HG1  VAL  25          3HG1      VAL  25  -3.917   7.506  -4.324
  186   1HG2  VAL  25          1HG2      VAL  25  -1.528   6.804  -0.871
  187   2HG2  VAL  25          2HG2      VAL  25  -1.059   8.052  -2.024
  188   3HG2  VAL  25          3HG2      VAL  25  -2.497   8.268  -1.028
  189    H    LEU  26           H        LEU  26  -3.273   4.276  -3.938
  190    HA   LEU  26           HA       LEU  26  -5.628   4.781  -5.491
  191   1HB   LEU  26          1HB       LEU  26  -3.717   2.426  -5.429
  192   2HB   LEU  26          2HB       LEU  26  -5.010   2.586  -6.614
  193    HG   LEU  26           HG       LEU  26  -2.820   4.641  -6.179
  194   1HD1  LEU  26          1HD1      LEU  26  -3.117   2.489  -8.296
  195   2HD1  LEU  26          2HD1      LEU  26  -1.901   3.767  -8.319
  196   3HD1  LEU  26          3HD1      LEU  26  -1.881   2.552  -7.040
  197   1HD2  LEU  26          1HD2      LEU  26  -5.178   4.421  -8.043
  198   2HD2  LEU  26          2HD2      LEU  26  -4.537   5.840  -7.215
  199   3HD2  LEU  26          3HD2      LEU  26  -3.708   5.199  -8.627
  200    H    ALA  27           H        ALA  27  -4.858   2.322  -3.045
  201    HA   ALA  27           HA       ALA  27  -7.355   0.894  -3.337
  202   1HB   ALA  27          1HB       ALA  27  -5.310  -0.084  -2.281
  203   2HB   ALA  27          2HB       ALA  27  -5.522   1.019  -0.922
  204   3HB   ALA  27          3HB       ALA  27  -6.738  -0.215  -1.253
  205    H    ASN  28           H        ASN  28  -6.271   3.608  -1.363
  206    HA   ASN  28           HA       ASN  28  -8.441   3.716   0.467
  207   1HB   ASN  28          1HB       ASN  28  -6.392   5.071   0.700
  208   2HB   ASN  28          2HB       ASN  28  -6.842   6.002  -0.728
  209   2HD2  ASN  28          2HD2      ASN  28  -7.583   5.463   2.681
  210   1HD2  ASN  28          1HD2      ASN  28  -8.649   6.775   2.841
  211    H    ARG  29           H        ARG  29  -8.054   5.391  -2.676
  212    HA   ARG  29           HA       ARG  29 -10.705   6.529  -2.595
  213   1HB   ARG  29          1HB       ARG  29 -10.300   7.050  -4.982
  214   2HB   ARG  29          2HB       ARG  29  -8.943   7.523  -3.965
  215   1HG   ARG  29          1HG       ARG  29  -7.764   5.437  -4.562
  216   2HG   ARG  29          2HG       ARG  29  -9.120   4.969  -5.590
  217   1HD   ARG  29          1HD       ARG  29  -7.241   6.041  -6.861
  218   2HD   ARG  29          2HD       ARG  29  -8.772   6.898  -7.024
  219    HE   ARG  29           HE       ARG  29  -7.518   8.131  -4.868
  220   1HH1  ARG  29          1HH1      ARG  29  -6.186   9.935  -5.119
  221   2HH1  ARG  29          2HH1      ARG  29  -5.401  10.210  -6.638
  222   1HH2  ARG  29          1HH2      ARG  29  -6.741   7.388  -8.143
  223   2HH2  ARG  29          2HH2      ARG  29  -5.714   8.768  -8.349
  224    H    GLU  30           H        GLU  30  -9.460   3.435  -3.525
  225    HA   GLU  30           HA       GLU  30 -11.484   2.625  -5.349
  226   1HB   GLU  30          1HB       GLU  30  -9.373   1.358  -4.859
  227   2HB   GLU  30          2HB       GLU  30 -10.077   0.874  -3.315
  228   1HG   GLU  30          1HG       GLU  30 -11.952  -0.189  -4.494
  229   2HG   GLU  30          2HG       GLU  30 -11.267   0.296  -6.043
  230    H    LEU  31           H        LEU  31 -11.391   2.537  -1.809
  231    HA   LEU  31           HA       LEU  31 -13.942   1.197  -1.497
  232   1HB   LEU  31          1HB       LEU  31 -12.595   3.101   0.435
  233   2HB   LEU  31          2HB       LEU  31 -13.767   1.845   0.827
  234    HG   LEU  31           HG       LEU  31 -11.017   1.404  -0.335
  235   1HD1  LEU  31          1HD1      LEU  31 -12.183   1.086   2.443
  236   2HD1  LEU  31          2HD1      LEU  31 -10.715   0.244   1.945
  237   3HD1  LEU  31          3HD1      LEU  31 -10.758   2.006   1.960
  238   1HD2  LEU  31          1HD2      LEU  31 -13.342  -0.423   0.303
  239   2HD2  LEU  31          2HD2      LEU  31 -12.305  -0.407  -1.125
  240   3HD2  LEU  31          3HD2      LEU  31 -11.694  -1.036   0.401
  241    H    ASP  32           H        ASP  32 -12.871   4.480  -1.885
  242    HA   ASP  32           HA       ASP  32 -15.188   5.863  -1.043
  243   1HB   ASP  32          1HB       ASP  32 -12.892   6.776  -1.648
  244   2HB   ASP  32          2HB       ASP  32 -13.393   6.663  -3.333
  245    H    LYS  33           H        LYS  33 -14.380   4.424  -4.218
  246    HA   LYS  33           HA       LYS  33 -16.636   5.458  -5.623
  247   1HB   LYS  33          1HB       LYS  33 -15.093   2.881  -5.982
  248   2HB   LYS  33          2HB       LYS  33 -16.352   3.418  -7.093
  249   1HG   LYS  33          1HG       LYS  33 -15.089   5.559  -7.409
  250   2HG   LYS  33          2HG       LYS  33 -13.791   4.899  -6.415
  251   1HD   LYS  33          1HD       LYS  33 -14.793   3.368  -8.820
  252   2HD   LYS  33          2HD       LYS  33 -13.623   4.672  -9.017
  253   1HE   LYS  33          1HE       LYS  33 -12.130   3.546  -7.381
  254   2HE   LYS  33          2HE       LYS  33 -13.280   2.214  -7.274
  255   1HZ   LYS  33          1HZ       LYS  33 -13.041   2.065  -9.772
  256   2HZ   LYS  33          2HZ       LYS  33 -11.681   3.071  -9.608
  257   3HZ   LYS  33          3HZ       LYS  33 -11.707   1.553  -8.853
  258    H    TYR  34           H        TYR  34 -16.286   2.465  -3.704
  259    HA   TYR  34           HA       TYR  34 -19.031   1.657  -4.221
  260   1HB   TYR  34          1HB       TYR  34 -17.164   0.716  -2.024
  261   2HB   TYR  34          2HB       TYR  34 -18.621  -0.104  -2.581
  262    HD1  TYR  34           HD1      TYR  34 -18.603  -0.237  -5.394
  263    HD2  TYR  34           HD2      TYR  34 -15.199  -0.304  -2.765
  264    HE1  TYR  34           HE1      TYR  34 -17.272  -1.376  -7.139
  265    HE2  TYR  34           HE2      TYR  34 -13.883  -1.457  -4.515
  266    HH   TYR  34           HH       TYR  34 -13.826  -1.914  -6.770
  267    H    GLY  35           H        GLY  35 -17.453   3.688  -1.870
  268   1HA   GLY  35          1HA       GLY  35 -20.107   4.403  -0.778
  269   2HA   GLY  35          2HA       GLY  35 -18.600   5.271  -0.491
  270    H    VAL  36           H        VAL  36 -17.195   2.707   0.225
  271    HA   VAL  36           HA       VAL  36 -18.537   1.506   2.461
  272    HB   VAL  36           HB       VAL  36 -15.531   1.741   2.340
  273   1HG1  VAL  36          1HG1      VAL  36 -16.880   0.471   4.135
  274   2HG1  VAL  36          2HG1      VAL  36 -17.243  -0.692   2.861
  275   3HG1  VAL  36          3HG1      VAL  36 -15.571  -0.404   3.343
  276   1HG2  VAL  36          1HG2      VAL  36 -17.330   0.189   0.467
  277   2HG2  VAL  36          2HG2      VAL  36 -16.022   1.294   0.047
  278   3HG2  VAL  36          3HG2      VAL  36 -15.654  -0.275   0.763
  279    H    SER  37           H        SER  37 -17.901   1.820   4.773
  280    HA   SER  37           HA       SER  37 -18.147   4.534   5.587
  281   1HB   SER  37          1HB       SER  37 -18.693   2.506   6.982
  282   2HB   SER  37          2HB       SER  37 -16.964   2.275   7.223
  283    HG   SER  37           HG       SER  37 -17.357   4.769   7.758
  284    H    ASP  38           H        ASP  38 -16.556   5.860   6.747
  285    HA   ASP  38           HA       ASP  38 -14.018   5.990   5.375
  286   1HB   ASP  38          1HB       ASP  38 -13.524   7.843   6.911
  287   2HB   ASP  38          2HB       ASP  38 -15.161   7.997   6.271
  288    H    TYR  39           H        TYR  39 -15.107   4.214   8.077
  289    HA   TYR  39           HA       TYR  39 -12.756   4.075   9.669
  290   1HB   TYR  39          1HB       TYR  39 -14.863   3.171  10.468
  291   2HB   TYR  39          2HB       TYR  39 -14.913   2.010   9.141
  292    HD1  TYR  39           HD1      TYR  39 -13.447   0.075   9.095
  293    HD2  TYR  39           HD2      TYR  39 -13.305   2.880  12.341
  294    HE1  TYR  39           HE1      TYR  39 -12.124  -1.537  10.424
  295    HE2  TYR  39           HE2      TYR  39 -11.977   1.265  13.678
  296    HH   TYR  39           HH       TYR  39 -10.296  -0.948  12.740
  297    H    TYR  40           H        TYR  40 -13.793   2.032   6.933
  298    HA   TYR  40           HA       TYR  40 -11.583   0.257   6.954
  299   1HB   TYR  40          1HB       TYR  40 -13.239   1.230   4.609
  300   2HB   TYR  40          2HB       TYR  40 -12.162  -0.167   4.575
  301    HD1  TYR  40           HD1      TYR  40 -12.697  -2.210   5.818
  302    HD2  TYR  40           HD2      TYR  40 -15.331   1.183   5.862
  303    HE1  TYR  40           HE1      TYR  40 -14.504  -3.623   6.763
  304    HE2  TYR  40           HE2      TYR  40 -17.136  -0.229   6.806
  305    HH   TYR  40           HH       TYR  40 -16.555  -3.641   7.638
  306    H    LYS  41           H        LYS  41 -11.863   3.523   5.630
  307    HA   LYS  41           HA       LYS  41  -9.585   3.502   3.905
  308   1HB   LYS  41          1HB       LYS  41 -10.432   5.831   5.683
  309   2HB   LYS  41          2HB       LYS  41  -9.596   5.919   4.137
  310   1HG   LYS  41          1HG       LYS  41 -12.348   4.721   4.383
  311   2HG   LYS  41          2HG       LYS  41 -12.101   6.450   4.176
  312   1HD   LYS  41          1HD       LYS  41 -10.886   6.053   2.092
  313   2HD   LYS  41          2HD       LYS  41 -11.085   4.307   2.298
  314   1HE   LYS  41          1HE       LYS  41 -13.451   4.460   2.130
  315   2HE   LYS  41          2HE       LYS  41 -13.424   6.215   2.266
  316   1HZ   LYS  41          1HZ       LYS  41 -11.927   4.989   0.071
  317   2HZ   LYS  41          2HZ       LYS  41 -13.621   5.033  -0.051
  318   3HZ   LYS  41          3HZ       LYS  41 -12.748   6.476   0.128
  319    H    ASN  42           H        ASN  42 -10.002   4.403   7.269
  320    HA   ASN  42           HA       ASN  42  -7.278   4.946   7.866
  321   1HB   ASN  42          1HB       ASN  42  -9.121   5.576   9.379
  322   2HB   ASN  42          2HB       ASN  42  -9.427   3.873   9.718
  323   2HD2  ASN  42          2HD2      ASN  42  -6.816   6.345   9.958
  324   1HD2  ASN  42          1HD2      ASN  42  -6.071   5.638  11.310
  325    H    LEU  43           H        LEU  43  -9.100   1.928   7.885
  326    HA   LEU  43           HA       LEU  43  -7.140   0.310   9.151
  327   1HB   LEU  43          1HB       LEU  43  -9.444  -0.459   8.726
  328   2HB   LEU  43          2HB       LEU  43  -9.131  -0.452   6.992
  329    HG   LEU  43           HG       LEU  43  -7.357  -2.153   7.313
  330   1HD1  LEU  43          1HD1      LEU  43  -8.095  -1.739  10.203
  331   2HD1  LEU  43          2HD1      LEU  43  -7.510  -3.316   9.676
  332   3HD1  LEU  43          3HD1      LEU  43  -6.497  -1.890   9.473
  333   1HD2  LEU  43          1HD2      LEU  43 -10.042  -2.853   8.544
  334   2HD2  LEU  43          2HD2      LEU  43  -9.655  -2.875   6.825
  335   3HD2  LEU  43          3HD2      LEU  43  -8.882  -4.023   7.916
  336    H    ILE  44           H        ILE  44  -7.537   1.279   5.736
  337    HA   ILE  44           HA       ILE  44  -5.474  -0.377   4.649
  338    HB   ILE  44           HB       ILE  44  -6.141   2.447   3.762
  339   1HG1  ILE  44          1HG1      ILE  44  -8.255   1.364   3.767
  340   2HG1  ILE  44          2HG1      ILE  44  -7.686   1.218   2.113
  341   1HG2  ILE  44          1HG2      ILE  44  -4.958   0.028   2.375
  342   2HG2  ILE  44          2HG2      ILE  44  -5.494   1.475   1.520
  343   3HG2  ILE  44          3HG2      ILE  44  -4.171   1.576   2.683
  344   1HD1  ILE  44          1HD1      ILE  44  -6.768  -1.071   2.763
  345   2HD1  ILE  44          2HD1      ILE  44  -7.686  -0.906   4.261
  346   3HD1  ILE  44          3HD1      ILE  44  -8.526  -0.932   2.715
  347    H    ASN  45           H        ASN  45  -5.372   2.849   6.129
  348    HA   ASN  45           HA       ASN  45  -2.610   3.375   5.681
  349   1HB   ASN  45          1HB       ASN  45  -4.496   4.249   7.890
  350   2HB   ASN  45          2HB       ASN  45  -2.843   4.855   7.737
  351   2HD2  ASN  45          2HD2      ASN  45  -5.177   6.556   7.464
  352   1HD2  ASN  45          1HD2      ASN  45  -5.220   7.116   5.862
  353    H    ASN  46           H        ASN  46  -4.284   1.626   8.264
  354    HA   ASN  46           HA       ASN  46  -2.057   1.197   9.972
  355   1HB   ASN  46          1HB       ASN  46  -4.382   0.724  10.640
  356   2HB   ASN  46          2HB       ASN  46  -4.446  -0.606   9.483
  357   2HD2  ASN  46          2HD2      ASN  46  -4.551  -2.391  10.927
  358   1HD2  ASN  46          1HD2      ASN  46  -3.352  -2.736  12.078
  359    H    ALA  47           H        ALA  47  -3.192  -0.673   7.151
  360    HA   ALA  47           HA       ALA  47  -1.582  -2.942   7.364
  361   1HB   ALA  47          1HB       ALA  47  -2.033  -1.386   4.799
  362   2HB   ALA  47          2HB       ALA  47  -1.670  -3.106   4.939
  363   3HB   ALA  47          3HB       ALA  47  -3.215  -2.480   5.515
  364    H    LYS  48           H        LYS  48   0.573  -3.257   7.448
  365    HA   LYS  48           HA       LYS  48   2.380  -0.971   6.832
  366   1HB   LYS  48          1HB       LYS  48   4.035  -2.700   8.039
  367   2HB   LYS  48          2HB       LYS  48   2.969  -1.648   8.964
  368   1HG   LYS  48          1HG       LYS  48   2.838  -3.964   9.784
  369   2HG   LYS  48          2HG       LYS  48   1.293  -3.456   9.114
  370   1HD   LYS  48          1HD       LYS  48   1.727  -4.657   7.051
  371   2HD   LYS  48          2HD       LYS  48   3.375  -5.018   7.570
  372   1HE   LYS  48          1HE       LYS  48   1.966  -6.979   7.949
  373   2HE   LYS  48          2HE       LYS  48   2.460  -6.298   9.499
  374   1HZ   LYS  48          1HZ       LYS  48  -0.107  -5.640   8.169
  375   2HZ   LYS  48          2HZ       LYS  48   0.057  -6.872   9.328
  376   3HZ   LYS  48          3HZ       LYS  48   0.361  -5.256   9.753
  377    H    THR  49           H        THR  49   1.150  -3.407   5.102
  378    HA   THR  49           HA       THR  49   3.588  -3.553   3.414
  379    HB   THR  49           HB       THR  49   2.063  -6.095   4.000
  380    HG1  THR  49           HG1      THR  49   4.301  -5.019   5.364
  381   1HG2  THR  49          1HG2      THR  49   3.617  -5.849   2.022
  382   2HG2  THR  49          2HG2      THR  49   4.928  -5.603   3.174
  383   3HG2  THR  49          3HG2      THR  49   4.057  -7.134   3.147
  384    H    VAL  50           H        VAL  50   3.090  -3.533   1.261
  385    HA   VAL  50           HA       VAL  50   0.409  -2.877   0.476
  386    HB   VAL  50           HB       VAL  50   2.407  -2.045  -0.687
  387   1HG1  VAL  50          1HG1      VAL  50   3.583  -4.335  -0.494
  388   2HG1  VAL  50          2HG1      VAL  50   2.657  -4.790  -1.925
  389   3HG1  VAL  50          3HG1      VAL  50   3.801  -3.450  -2.002
  390   1HG2  VAL  50          1HG2      VAL  50   0.116  -2.296  -1.792
  391   2HG2  VAL  50          2HG2      VAL  50   1.488  -2.165  -2.891
  392   3HG2  VAL  50          3HG2      VAL  50   0.760  -3.741  -2.572
  393    H    GLU  51           H        GLU  51   2.230  -5.914   0.415
  394    HA   GLU  51           HA       GLU  51   0.530  -7.308  -1.401
  395   1HB   GLU  51          1HB       GLU  51   1.452  -9.340  -0.499
  396   2HB   GLU  51          2HB       GLU  51   2.744  -8.141  -0.459
  397   1HG   GLU  51          1HG       GLU  51   2.123  -7.668   1.942
  398   2HG   GLU  51          2HG       GLU  51   1.018  -9.041   1.866
  399    H    GLY  52           H        GLY  52   0.285  -6.649   2.047
  400   1HA   GLY  52          1HA       GLY  52  -1.464  -7.072   3.566
  401   2HA   GLY  52          2HA       GLY  52  -2.125  -8.233   2.414
  402    H    VAL  53           H        VAL  53  -1.381  -4.899   1.514
  403    HA   VAL  53           HA       VAL  53  -3.944  -3.754   2.029
  404    HB   VAL  53           HB       VAL  53  -1.837  -3.102  -0.046
  405   1HG1  VAL  53          1HG1      VAL  53  -4.433  -1.711   0.630
  406   2HG1  VAL  53          2HG1      VAL  53  -3.079  -0.859  -0.112
  407   3HG1  VAL  53          3HG1      VAL  53  -3.844  -2.205  -0.958
  408   1HG2  VAL  53          1HG2      VAL  53  -1.429  -2.837   2.491
  409   2HG2  VAL  53          2HG2      VAL  53  -1.134  -1.423   1.482
  410   3HG2  VAL  53          3HG2      VAL  53  -2.620  -1.541   2.422
  411    H    LYS  54           H        LYS  54  -2.664  -5.218  -0.981
  412    HA   LYS  54           HA       LYS  54  -5.100  -4.928  -2.453
  413   1HB   LYS  54          1HB       LYS  54  -2.800  -6.879  -2.740
  414   2HB   LYS  54          2HB       LYS  54  -4.121  -6.767  -3.898
  415   1HG   LYS  54          1HG       LYS  54  -2.529  -4.319  -3.128
  416   2HG   LYS  54          2HG       LYS  54  -1.947  -5.417  -4.375
  417   1HD   LYS  54          1HD       LYS  54  -4.185  -5.128  -5.538
  418   2HD   LYS  54          2HD       LYS  54  -4.539  -3.845  -4.382
  419   1HE   LYS  54          1HE       LYS  54  -3.586  -2.942  -6.480
  420   2HE   LYS  54          2HE       LYS  54  -2.542  -2.618  -5.097
  421   1HZ   LYS  54          1HZ       LYS  54  -2.105  -5.095  -6.584
  422   2HZ   LYS  54          2HZ       LYS  54  -1.614  -3.644  -7.317
  423   3HZ   LYS  54          3HZ       LYS  54  -0.984  -4.089  -5.804
  424    H    ALA  55           H        ALA  55  -3.849  -7.539  -0.410
  425    HA   ALA  55           HA       ALA  55  -6.011  -9.366  -0.953
  426   1HB   ALA  55          1HB       ALA  55  -4.333  -9.260   1.562
  427   2HB   ALA  55          2HB       ALA  55  -5.140 -10.665   0.865
  428   3HB   ALA  55          3HB       ALA  55  -3.749  -9.952   0.048
  429    H    LEU  56           H        LEU  56  -5.517  -6.788   1.395
  430    HA   LEU  56           HA       LEU  56  -7.647  -7.412   3.157
  431   1HB   LEU  56          1HB       LEU  56  -5.946  -5.742   3.706
  432   2HB   LEU  56          2HB       LEU  56  -6.488  -4.718   2.380
  433    HG   LEU  56           HG       LEU  56  -8.663  -4.417   3.459
  434   1HD1  LEU  56          1HD1      LEU  56  -7.542  -6.432   5.407
  435   2HD1  LEU  56          2HD1      LEU  56  -8.777  -5.283   5.923
  436   3HD1  LEU  56          3HD1      LEU  56  -9.122  -6.416   4.619
  437   1HD2  LEU  56          1HD2      LEU  56  -6.602  -3.026   4.087
  438   2HD2  LEU  56          2HD2      LEU  56  -7.940  -3.004   5.235
  439   3HD2  LEU  56          3HD2      LEU  56  -6.524  -4.003   5.554
  440    H    ILE  57           H        ILE  57  -7.600  -5.277   0.287
  441    HA   ILE  57           HA       ILE  57 -10.416  -4.699   0.355
  442    HB   ILE  57           HB       ILE  57  -8.253  -4.537  -1.721
  443   1HG1  ILE  57          1HG1      ILE  57  -8.924  -2.138  -1.716
  444   2HG1  ILE  57          2HG1      ILE  57 -10.196  -2.517  -0.562
  445   1HG2  ILE  57          1HG2      ILE  57 -11.214  -4.332  -2.242
  446   2HG2  ILE  57          2HG2      ILE  57 -10.037  -3.494  -3.255
  447   3HG2  ILE  57          3HG2      ILE  57 -10.004  -5.252  -3.134
  448   1HD1  ILE  57          1HD1      ILE  57  -7.246  -2.987  -0.056
  449   2HD1  ILE  57          2HD1      ILE  57  -8.145  -1.577   0.515
  450   3HD1  ILE  57          3HD1      ILE  57  -8.560  -3.189   1.106
  451    H    ASP  58           H        ASP  58  -8.468  -7.291  -1.052
  452    HA   ASP  58           HA       ASP  58 -10.489  -8.469  -2.678
  453   1HB   ASP  58          1HB       ASP  58  -8.103  -9.149  -2.751
  454   2HB   ASP  58          2HB       ASP  58  -8.272  -9.862  -1.149
  455    H    GLU  59           H        GLU  59  -9.737  -8.876   0.776
  456    HA   GLU  59           HA       GLU  59 -11.740 -10.932   1.187
  457   1HB   GLU  59          1HB       GLU  59 -10.340  -9.045   3.102
  458   2HB   GLU  59          2HB       GLU  59 -11.474 -10.290   3.626
  459   1HG   GLU  59          1HG       GLU  59 -10.070 -12.021   2.569
  460   2HG   GLU  59          2HG       GLU  59  -8.930 -10.779   2.046
  461    H    ILE  60           H        ILE  60 -11.655  -7.417   1.497
  462    HA   ILE  60           HA       ILE  60 -14.302  -7.159   2.568
  463    HB   ILE  60           HB       ILE  60 -12.602  -5.198   1.007
  464   1HG1  ILE  60          1HG1      ILE  60 -13.097  -5.382   3.990
  465   2HG1  ILE  60          2HG1      ILE  60 -11.713  -6.138   3.203
  466   1HG2  ILE  60          1HG2      ILE  60 -15.133  -4.842   2.635
  467   2HG2  ILE  60          2HG2      ILE  60 -14.085  -3.505   2.158
  468   3HG2  ILE  60          3HG2      ILE  60 -14.902  -4.469   0.927
  469   1HD1  ILE  60          1HD1      ILE  60 -12.315  -3.211   2.788
  470   2HD1  ILE  60          2HD1      ILE  60 -11.399  -3.760   4.192
  471   3HD1  ILE  60          3HD1      ILE  60 -10.788  -4.066   2.567
  472    H    LEU  61           H        LEU  61 -13.014  -6.827  -0.748
  473    HA   LEU  61           HA       LEU  61 -15.624  -6.436  -1.919
  474   1HB   LEU  61          1HB       LEU  61 -12.890  -7.079  -3.015
  475   2HB   LEU  61          2HB       LEU  61 -14.300  -7.138  -4.075
  476    HG   LEU  61           HG       LEU  61 -13.507  -4.736  -2.394
  477   1HD1  LEU  61          1HD1      LEU  61 -11.959  -5.446  -4.362
  478   2HD1  LEU  61          2HD1      LEU  61 -13.289  -4.938  -5.399
  479   3HD1  LEU  61          3HD1      LEU  61 -12.523  -3.777  -4.317
  480   1HD2  LEU  61          1HD2      LEU  61 -15.816  -5.367  -4.195
  481   2HD2  LEU  61          2HD2      LEU  61 -15.739  -4.300  -2.793
  482   3HD2  LEU  61          3HD2      LEU  61 -15.124  -3.754  -4.348
  483    H    ALA  62           H        ALA  62 -13.697  -9.260  -1.140
  484    HA   ALA  62           HA       ALA  62 -15.391 -11.075  -2.690
  485   1HB   ALA  62          1HB       ALA  62 -13.355 -11.646  -0.511
  486   2HB   ALA  62          2HB       ALA  62 -13.027 -11.637  -2.243
  487   3HB   ALA  62          3HB       ALA  62 -14.100 -12.856  -1.556
  488    H    ALA  63           H        ALA  63 -15.676  -9.429   0.239
  489    HA   ALA  63           HA       ALA  63 -18.037 -11.058   0.975
  490   1HB   ALA  63          1HB       ALA  63 -17.301 -11.185   3.349
  491   2HB   ALA  63          2HB       ALA  63 -15.741 -10.507   2.883
  492   3HB   ALA  63          3HB       ALA  63 -16.232 -12.089   2.277
  493    H    LEU  64           H        LEU  64 -18.647  -8.819  -0.026
  494    HA   LEU  64           HA       LEU  64 -18.265  -6.443   1.515
  495   1HB   LEU  64          1HB       LEU  64 -20.298  -7.281  -0.553
  496   2HB   LEU  64          2HB       LEU  64 -20.402  -5.705   0.223
  497    HG   LEU  64           HG       LEU  64 -17.794  -6.597  -1.014
  498   1HD1  LEU  64          1HD1      LEU  64 -19.528  -6.922  -2.749
  499   2HD1  LEU  64          2HD1      LEU  64 -20.088  -5.269  -2.492
  500   3HD1  LEU  64          3HD1      LEU  64 -18.474  -5.563  -3.139
  501   1HD2  LEU  64          1HD2      LEU  64 -19.142  -3.914  -0.535
  502   2HD2  LEU  64          2HD2      LEU  64 -17.728  -4.551   0.303
  503   3HD2  LEU  64          3HD2      LEU  64 -17.618  -4.112  -1.398
  504    HA   PRO  65           HA       PRO  65 -20.939  -6.986   5.029
  505   1HB   PRO  65          1HB       PRO  65 -22.416  -4.505   4.454
  506   2HB   PRO  65          2HB       PRO  65 -21.330  -4.869   5.799
  507   1HG   PRO  65          1HG       PRO  65 -20.771  -3.233   3.521
  508   2HG   PRO  65          2HG       PRO  65 -19.651  -3.688   4.809
  509   1HD   PRO  65          1HD       PRO  65 -19.582  -4.558   2.072
  510   2HD   PRO  65          2HD       PRO  65 -18.540  -5.116   3.402

  No H/Q in entry =         510
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1  29.122  -3.959 -10.367
    2    H2   MET   1           H2       MET   1  30.207  -4.924  -9.486
    3    H3   MET   1           H3       MET   1  30.797  -3.737 -10.544
    4    HA   MET   1           HA       MET   1  30.262  -4.927 -12.433
    5   1HB   MET   1          1HB       MET   1  31.075  -6.823 -10.215
    6   2HB   MET   1          2HB       MET   1  30.997  -7.325 -11.902
    7   1HG   MET   1          1HG       MET   1  33.262  -6.685 -11.556
    8   2HG   MET   1          2HG       MET   1  32.536  -5.324 -12.404
    9   1HE   MET   1          1HE       MET   1  33.106  -6.947  -9.052
   10   2HE   MET   1          2HE       MET   1  34.715  -6.292  -9.385
   11   3HE   MET   1          3HE       MET   1  33.776  -5.683  -8.024
   12    H    LYS   2           H        LYS   2  28.555  -5.761 -13.532
   13    HA   LYS   2           HA       LYS   2  26.104  -6.450 -12.161
   14   1HB   LYS   2          1HB       LYS   2  26.915  -6.901 -15.052
   15   2HB   LYS   2          2HB       LYS   2  25.271  -7.000 -14.427
   16   1HG   LYS   2          1HG       LYS   2  26.988  -4.508 -14.224
   17   2HG   LYS   2          2HG       LYS   2  25.853  -4.799 -15.540
   18   1HD   LYS   2          1HD       LYS   2  24.089  -5.155 -13.661
   19   2HD   LYS   2          2HD       LYS   2  25.260  -4.361 -12.611
   20   1HE   LYS   2          1HE       LYS   2  24.194  -3.184 -15.192
   21   2HE   LYS   2          2HE       LYS   2  23.619  -2.760 -13.579
   22   1HZ   LYS   2          1HZ       LYS   2  26.287  -2.489 -13.338
   23   2HZ   LYS   2          2HZ       LYS   2  26.035  -1.973 -14.938
   24   3HZ   LYS   2          3HZ       LYS   2  25.212  -1.218 -13.659
   25    H    ALA   3           H        ALA   3  25.223  -8.496 -11.774
   26    HA   ALA   3           HA       ALA   3  26.362 -10.915 -12.881
   27   1HB   ALA   3          1HB       ALA   3  28.152 -10.388 -11.280
   28   2HB   ALA   3          2HB       ALA   3  27.268 -11.823 -10.758
   29   3HB   ALA   3          3HB       ALA   3  26.968 -10.270  -9.978
   30    H    ILE   4           H        ILE   4  23.809  -9.349 -11.951
   31    HA   ILE   4           HA       ILE   4  22.457 -11.664 -10.591
   32    HB   ILE   4           HB       ILE   4  20.813 -10.023  -9.781
   33   1HG1  ILE   4          1HG1      ILE   4  21.883  -7.503 -10.126
   34   2HG1  ILE   4          2HG1      ILE   4  22.299  -8.237 -11.672
   35   1HG2  ILE   4          1HG2      ILE   4  22.907 -10.537  -8.506
   36   2HG2  ILE   4          2HG2      ILE   4  23.653  -9.112  -9.230
   37   3HG2  ILE   4          3HG2      ILE   4  22.260  -8.933  -8.163
   38   1HD1  ILE   4          1HD1      ILE   4  19.768  -9.021 -11.630
   39   2HD1  ILE   4          2HD1      ILE   4  19.594  -7.690 -10.490
   40   3HD1  ILE   4          3HD1      ILE   4  20.181  -7.380 -12.123
   41    H    PHE   5           H        PHE   5  20.831 -12.656 -11.694
   42    HA   PHE   5           HA       PHE   5  20.115 -11.573 -14.382
   43   1HB   PHE   5          1HB       PHE   5  19.831 -14.319 -13.136
   44   2HB   PHE   5          2HB       PHE   5  19.177 -13.895 -14.718
   45    HD1  PHE   5           HD1      PHE   5  22.247 -14.459 -12.762
   46    HD2  PHE   5           HD2      PHE   5  20.650 -13.402 -16.608
   47    HE1  PHE   5           HE1      PHE   5  24.474 -14.831 -13.790
   48    HE2  PHE   5           HE2      PHE   5  22.875 -13.775 -17.635
   49    HZ   PHE   5           HZ       PHE   5  24.788 -14.489 -16.226
   50    H    VAL   6           H        VAL   6  18.928 -11.384 -11.314
   51    HA   VAL   6           HA       VAL   6  16.056 -11.515 -12.188
   52    HB   VAL   6           HB       VAL   6  15.513 -11.686  -9.808
   53   1HG1  VAL   6          1HG1      VAL   6  17.718 -13.577 -10.682
   54   2HG1  VAL   6          2HG1      VAL   6  16.606 -13.878  -9.345
   55   3HG1  VAL   6          3HG1      VAL   6  15.992 -13.768 -10.994
   56   1HG2  VAL   6          1HG2      VAL   6  18.496 -11.292  -9.497
   57   2HG2  VAL   6          2HG2      VAL   6  17.192 -10.372  -8.749
   58   3HG2  VAL   6          3HG2      VAL   6  17.518 -12.024  -8.224
   59    H    LEU   7           H        LEU   7  14.942  -9.621 -12.296
   60    HA   LEU   7           HA       LEU   7  15.764  -7.300 -10.687
   61   1HB   LEU   7          1HB       LEU   7  17.187  -7.276 -12.792
   62   2HB   LEU   7          2HB       LEU   7  15.702  -7.082 -13.715
   63    HG   LEU   7           HG       LEU   7  16.196  -5.165 -11.440
   64   1HD1  LEU   7          1HD1      LEU   7  18.365  -5.257 -12.640
   65   2HD1  LEU   7          2HD1      LEU   7  17.529  -4.908 -14.153
   66   3HD1  LEU   7          3HD1      LEU   7  17.555  -3.706 -12.862
   67   1HD2  LEU   7          1HD2      LEU   7  14.942  -4.970 -14.200
   68   2HD2  LEU   7          2HD2      LEU   7  14.119  -4.893 -12.642
   69   3HD2  LEU   7          3HD2      LEU   7  15.181  -3.582 -13.142
   70    H    ASN   8           H        ASN   8  13.708  -8.422 -13.399
   71    HA   ASN   8           HA       ASN   8  11.622  -6.512 -12.987
   72   1HB   ASN   8          1HB       ASN   8  10.210  -8.060 -14.281
   73   2HB   ASN   8          2HB       ASN   8  11.802  -7.912 -15.026
   74   2HD2  ASN   8          2HD2      ASN   8  13.184  -9.778 -15.034
   75   1HD2  ASN   8          1HD2      ASN   8  12.668 -11.300 -14.486
   76    H    ALA   9           H        ALA   9  12.142  -9.769 -11.638
   77    HA   ALA   9           HA       ALA   9   9.659  -9.791 -10.151
   78   1HB   ALA   9          1HB       ALA   9  10.767 -11.894 -10.637
   79   2HB   ALA   9          2HB       ALA   9  10.755 -11.670  -8.888
   80   3HB   ALA   9          3HB       ALA   9  12.229 -11.363  -9.806
   81    H    GLN  10           H        GLN  10  13.043  -9.458  -9.029
   82    HA   GLN  10           HA       GLN  10  12.053  -7.685  -6.812
   83   1HB   GLN  10          1HB       GLN  10  14.274  -9.754  -6.799
   84   2HB   GLN  10          2HB       GLN  10  14.008  -8.586  -5.503
   85   1HG   GLN  10          1HG       GLN  10  11.883 -10.515  -6.475
   86   2HG   GLN  10          2HG       GLN  10  12.943 -10.845  -5.105
   87   2HE2  GLN  10          2HE2      GLN  10  13.051  -8.428  -3.765
   88   1HE2  GLN  10          1HE2      GLN  10  11.498  -7.950  -3.273
   89    H    HIS  11           H        HIS  11  12.867  -5.645  -7.031
   90    HA   HIS  11           HA       HIS  11  14.803  -4.975  -9.035
   91   1HB   HIS  11          1HB       HIS  11  13.861  -3.418  -6.608
   92   2HB   HIS  11          2HB       HIS  11  14.840  -2.741  -7.909
   93    HD1  HIS  11           HD1      HIS  11  11.536  -2.587  -6.951
   94    HD2  HIS  11           HD2      HIS  11  13.296  -3.734 -10.550
   95    HE1  HIS  11           HE1      HIS  11   9.750  -2.347  -8.729
   96    H    ASP  12           H        ASP  12  15.094  -5.138  -5.473
   97    HA   ASP  12           HA       ASP  12  17.773  -6.188  -5.584
   98   1HB   ASP  12          1HB       ASP  12  18.139  -3.771  -6.291
   99   2HB   ASP  12          2HB       ASP  12  17.583  -3.300  -4.686
  100    H    GLU  13           H        GLU  13  18.787  -5.873  -3.220
  101    HA   GLU  13           HA       GLU  13  16.948  -7.022  -1.366
  102   1HB   GLU  13          1HB       GLU  13  19.590  -5.592  -0.932
  103   2HB   GLU  13          2HB       GLU  13  18.709  -6.413   0.355
  104   1HG   GLU  13          1HG       GLU  13  20.275  -8.018  -0.441
  105   2HG   GLU  13          2HG       GLU  13  18.736  -8.488  -1.159
  106    H    ALA  14           H        ALA  14  18.025  -3.678  -1.866
  107    HA   ALA  14           HA       ALA  14  16.401  -2.667   0.349
  108   1HB   ALA  14          1HB       ALA  14  18.569  -1.621  -0.602
  109   2HB   ALA  14          2HB       ALA  14  17.238  -0.525  -0.233
  110   3HB   ALA  14          3HB       ALA  14  17.548  -1.007  -1.903
  111    H    VAL  15           H        VAL  15  14.581  -1.148  -0.032
  112    HA   VAL  15           HA       VAL  15  13.157  -1.615  -2.636
  113    HB   VAL  15           HB       VAL  15  11.049  -1.779  -1.378
  114   1HG1  VAL  15          1HG1      VAL  15  12.356  -3.834  -1.879
  115   2HG1  VAL  15          2HG1      VAL  15  13.161  -3.681  -0.317
  116   3HG1  VAL  15          3HG1      VAL  15  11.426  -3.988  -0.388
  117   1HG2  VAL  15          1HG2      VAL  15  12.894  -1.504   1.012
  118   2HG2  VAL  15          2HG2      VAL  15  11.566  -0.434   0.560
  119   3HG2  VAL  15          3HG2      VAL  15  11.227  -2.068   1.131
  120    H    ASP  16           H        ASP  16  11.564   0.071  -3.131
  121    HA   ASP  16           HA       ASP  16  12.539   2.729  -2.323
  122   1HB   ASP  16          1HB       ASP  16  10.985   3.564  -4.026
  123   2HB   ASP  16          2HB       ASP  16  11.934   2.234  -4.691
  124    H    ALA  17           H        ALA  17  10.538   4.378  -2.014
  125    HA   ALA  17           HA       ALA  17   8.625   3.163  -0.039
  126   1HB   ALA  17          1HB       ALA  17   8.893   5.172   1.350
  127   2HB   ALA  17          2HB       ALA  17  10.072   5.818   0.208
  128   3HB   ALA  17          3HB       ALA  17  10.446   4.364   1.133
  129    H    ASN  18           H        ASN  18   8.365   4.008  -2.945
  130    HA   ASN  18           HA       ASN  18   6.315   6.181  -2.620
  131   1HB   ASN  18          1HB       ASN  18   8.269   6.556  -4.196
  132   2HB   ASN  18          2HB       ASN  18   7.608   5.261  -5.195
  133   2HD2  ASN  18          2HD2      ASN  18   6.427   6.149  -6.891
  134   1HD2  ASN  18          1HD2      ASN  18   5.412   7.506  -6.771
  135    H    SER  19           H        SER  19   6.893   2.991  -4.098
  136    HA   SER  19           HA       SER  19   4.362   2.736  -5.372
  137   1HB   SER  19          1HB       SER  19   4.823   0.368  -5.476
  138   2HB   SER  19          2HB       SER  19   6.341   1.227  -5.719
  139    HG   SER  19           HG       SER  19   6.930   0.754  -3.648
  140    H    LEU  20           H        LEU  20   5.352   1.941  -2.051
  141    HA   LEU  20           HA       LEU  20   2.975   0.596  -1.274
  142   1HB   LEU  20          1HB       LEU  20   4.915   0.529   0.161
  143   2HB   LEU  20          2HB       LEU  20   4.922   2.284   0.318
  144    HG   LEU  20           HG       LEU  20   2.855   2.247   1.583
  145   1HD1  LEU  20          1HD1      LEU  20   2.788  -0.636   0.700
  146   2HD1  LEU  20          2HD1      LEU  20   1.957  -0.150   2.177
  147   3HD1  LEU  20          3HD1      LEU  20   1.509   0.572   0.635
  148   1HD2  LEU  20          1HD2      LEU  20   4.825   0.123   2.481
  149   2HD2  LEU  20          2HD2      LEU  20   4.845   1.836   2.902
  150   3HD2  LEU  20          3HD2      LEU  20   3.561   0.793   3.513
  151    H    ALA  21           H        ALA  21   3.809   4.066  -0.950
  152    HA   ALA  21           HA       ALA  21   1.344   4.848   0.199
  153   1HB   ALA  21          1HB       ALA  21   3.243   6.390  -1.590
  154   2HB   ALA  21          2HB       ALA  21   3.241   6.366   0.174
  155   3HB   ALA  21          3HB       ALA  21   1.908   7.122  -0.700
  156    H    GLU  22           H        GLU  22   2.332   4.698  -3.232
  157    HA   GLU  22           HA       GLU  22  -0.105   5.707  -4.309
  158   1HB   GLU  22          1HB       GLU  22   2.021   5.354  -5.602
  159   2HB   GLU  22          2HB       GLU  22   1.701   3.620  -5.559
  160   1HG   GLU  22          1HG       GLU  22  -0.444   3.977  -6.710
  161   2HG   GLU  22          2HG       GLU  22  -0.138   5.712  -6.754
  162    H    ALA  23           H        ALA  23   0.860   2.394  -3.423
  163    HA   ALA  23           HA       ALA  23  -1.429   1.073  -4.477
  164   1HB   ALA  23          1HB       ALA  23  -0.107   0.207  -1.906
  165   2HB   ALA  23          2HB       ALA  23   0.736   0.066  -3.448
  166   3HB   ALA  23          3HB       ALA  23  -0.782  -0.793  -3.193
  167    H    LYS  24           H        LYS  24  -0.877   2.545  -1.265
  168    HA   LYS  24           HA       LYS  24  -3.503   1.847  -0.279
  169   1HB   LYS  24          1HB       LYS  24  -1.511   3.960   0.581
  170   2HB   LYS  24          2HB       LYS  24  -3.025   3.654   1.433
  171   1HG   LYS  24          1HG       LYS  24  -2.334   1.268   1.712
  172   2HG   LYS  24          2HG       LYS  24  -0.780   1.664   0.981
  173   1HD   LYS  24          1HD       LYS  24  -1.885   3.033   3.451
  174   2HD   LYS  24          2HD       LYS  24  -0.754   1.686   3.500
  175   1HE   LYS  24          1HE       LYS  24   0.723   3.157   1.938
  176   2HE   LYS  24          2HE       LYS  24  -0.298   4.485   2.486
  177   1HZ   LYS  24          1HZ       LYS  24   0.888   2.657   4.456
  178   2HZ   LYS  24          2HZ       LYS  24   1.839   3.890   3.785
  179   3HZ   LYS  24          3HZ       LYS  24   0.422   4.280   4.637
  180    H    VAL  25           H        VAL  25  -2.146   4.711  -1.897
  181    HA   VAL  25           HA       VAL  25  -4.476   6.346  -1.683
  182    HB   VAL  25           HB       VAL  25  -2.290   6.260  -3.773
  183   1HG1  VAL  25          1HG1      VAL  25  -4.600   8.177  -3.410
  184   2HG1  VAL  25          2HG1      VAL  25  -3.139   8.608  -4.297
  185   3HG1  VAL  25          3HG1      VAL  25  -4.154   7.284  -4.864
  186   1HG2  VAL  25          1HG2      VAL  25  -1.773   6.898  -1.352
  187   2HG2  VAL  25          2HG2      VAL  25  -1.345   8.100  -2.569
  188   3HG2  VAL  25          3HG2      VAL  25  -2.806   8.305  -1.603
  189    H    LEU  26           H        LEU  26  -3.392   4.163  -4.297
  190    HA   LEU  26           HA       LEU  26  -5.704   4.499  -5.941
  191   1HB   LEU  26          1HB       LEU  26  -3.751   2.196  -5.666
  192   2HB   LEU  26          2HB       LEU  26  -5.006   2.253  -6.901
  193    HG   LEU  26           HG       LEU  26  -2.870   4.375  -6.522
  194   1HD1  LEU  26          1HD1      LEU  26  -1.902   2.226  -7.241
  195   2HD1  LEU  26          2HD1      LEU  26  -3.070   2.134  -8.559
  196   3HD1  LEU  26          3HD1      LEU  26  -1.846   3.404  -8.551
  197   1HD2  LEU  26          1HD2      LEU  26  -5.186   4.021  -8.409
  198   2HD2  LEU  26          2HD2      LEU  26  -4.555   5.494  -7.674
  199   3HD2  LEU  26          3HD2      LEU  26  -3.712   4.759  -9.032
  200    H    ALA  27           H        ALA  27  -4.982   2.212  -3.323
  201    HA   ALA  27           HA       ALA  27  -7.514   0.803  -3.639
  202   1HB   ALA  27          1HB       ALA  27  -5.537  -0.321  -2.686
  203   2HB   ALA  27          2HB       ALA  27  -5.543   0.810  -1.334
  204   3HB   ALA  27          3HB       ALA  27  -6.875  -0.326  -1.539
  205    H    ASN  28           H        ASN  28  -6.272   3.348  -1.492
  206    HA   ASN  28           HA       ASN  28  -8.472   3.448   0.300
  207   1HB   ASN  28          1HB       ASN  28  -6.357   4.640   0.702
  208   2HB   ASN  28          2HB       ASN  28  -6.703   5.721  -0.648
  209   2HD2  ASN  28          2HD2      ASN  28  -6.445   6.360   2.300
  210   1HD2  ASN  28          1HD2      ASN  28  -7.904   7.120   2.717
  211    H    ARG  29           H        ARG  29  -7.956   5.262  -2.751
  212    HA   ARG  29           HA       ARG  29 -10.486   6.640  -2.562
  213   1HB   ARG  29          1HB       ARG  29 -10.086   7.339  -4.845
  214   2HB   ARG  29          2HB       ARG  29  -8.556   7.404  -3.974
  215   1HG   ARG  29          1HG       ARG  29  -8.059   5.092  -4.866
  216   2HG   ARG  29          2HG       ARG  29  -9.482   5.254  -5.896
  217   1HD   ARG  29          1HD       ARG  29  -8.473   7.405  -6.778
  218   2HD   ARG  29          2HD       ARG  29  -6.996   6.983  -5.913
  219    HE   ARG  29           HE       ARG  29  -7.551   4.725  -7.425
  220   1HH1  ARG  29          1HH1      ARG  29  -6.785   4.444  -9.536
  221   2HH1  ARG  29          2HH1      ARG  29  -6.362   5.833 -10.480
  222   1HH2  ARG  29          1HH2      ARG  29  -7.169   8.104  -7.988
  223   2HH2  ARG  29          2HH2      ARG  29  -6.578   7.904  -9.604
  224    H    GLU  30           H        GLU  30  -9.523   3.505  -3.735
  225    HA   GLU  30           HA       GLU  30 -11.731   2.950  -5.444
  226   1HB   GLU  30          1HB       GLU  30  -9.739   1.486  -5.276
  227   2HB   GLU  30          2HB       GLU  30 -10.214   1.036  -3.641
  228   1HG   GLU  30          1HG       GLU  30 -12.315   0.082  -4.499
  229   2HG   GLU  30          2HG       GLU  30 -11.855   0.537  -6.140
  230    H    LEU  31           H        LEU  31 -11.371   2.638  -1.922
  231    HA   LEU  31           HA       LEU  31 -13.930   1.402  -1.460
  232   1HB   LEU  31          1HB       LEU  31 -12.576   3.268   0.501
  233   2HB   LEU  31          2HB       LEU  31 -13.546   1.832   0.838
  234    HG   LEU  31           HG       LEU  31 -10.777   1.938  -0.365
  235   1HD1  LEU  31          1HD1      LEU  31 -11.070   2.145   2.139
  236   2HD1  LEU  31          2HD1      LEU  31 -11.806   0.543   2.124
  237   3HD1  LEU  31          3HD1      LEU  31 -10.126   0.745   1.634
  238   1HD2  LEU  31          1HD2      LEU  31 -12.783  -0.318  -0.151
  239   2HD2  LEU  31          2HD2      LEU  31 -11.842   0.182  -1.557
  240   3HD2  LEU  31          3HD2      LEU  31 -11.050  -0.640  -0.214
  241    H    ASP  32           H        ASP  32 -12.846   4.680  -1.896
  242    HA   ASP  32           HA       ASP  32 -15.086   6.077  -0.870
  243   1HB   ASP  32          1HB       ASP  32 -12.827   6.984  -1.683
  244   2HB   ASP  32          2HB       ASP  32 -13.511   6.912  -3.307
  245    H    LYS  33           H        LYS  33 -14.530   4.565  -4.041
  246    HA   LYS  33           HA       LYS  33 -16.830   5.607  -5.363
  247   1HB   LYS  33          1HB       LYS  33 -15.559   2.868  -5.673
  248   2HB   LYS  33          2HB       LYS  33 -16.661   3.624  -6.823
  249   1HG   LYS  33          1HG       LYS  33 -15.056   5.467  -7.155
  250   2HG   LYS  33          2HG       LYS  33 -13.950   4.708  -6.008
  251   1HD   LYS  33          1HD       LYS  33 -14.045   2.632  -7.497
  252   2HD   LYS  33          2HD       LYS  33 -14.843   3.647  -8.697
  253   1HE   LYS  33          1HE       LYS  33 -12.829   5.256  -8.357
  254   2HE   LYS  33          2HE       LYS  33 -12.043   3.861  -7.612
  255   1HZ   LYS  33          1HZ       LYS  33 -13.182   2.912  -9.925
  256   2HZ   LYS  33          2HZ       LYS  33 -12.504   4.407 -10.363
  257   3HZ   LYS  33          3HZ       LYS  33 -11.531   3.212  -9.654
  258    H    TYR  34           H        TYR  34 -16.414   2.752  -3.281
  259    HA   TYR  34           HA       TYR  34 -19.230   1.992  -3.550
  260   1HB   TYR  34          1HB       TYR  34 -17.072   0.986  -1.670
  261   2HB   TYR  34          2HB       TYR  34 -18.652   0.237  -1.908
  262    HD1  TYR  34           HD1      TYR  34 -19.242  -0.789  -4.095
  263    HD2  TYR  34           HD2      TYR  34 -15.320   0.772  -3.311
  264    HE1  TYR  34           HE1      TYR  34 -18.364  -1.995  -6.077
  265    HE2  TYR  34           HE2      TYR  34 -14.443  -0.423  -5.298
  266    HH   TYR  34           HH       TYR  34 -15.899  -1.363  -7.669
  267    H    GLY  35           H        GLY  35 -17.478   4.217  -1.660
  268   1HA   GLY  35          1HA       GLY  35 -19.845   5.030  -0.226
  269   2HA   GLY  35          2HA       GLY  35 -18.221   5.667   0.033
  270    H    VAL  36           H        VAL  36 -17.123   2.942   0.571
  271    HA   VAL  36           HA       VAL  36 -18.517   1.696   2.719
  272    HB   VAL  36           HB       VAL  36 -15.503   1.774   2.693
  273   1HG1  VAL  36          1HG1      VAL  36 -17.009   0.394   4.290
  274   2HG1  VAL  36          2HG1      VAL  36 -17.337  -0.618   2.883
  275   3HG1  VAL  36          3HG1      VAL  36 -15.686  -0.444   3.480
  276   1HG2  VAL  36          1HG2      VAL  36 -17.310   0.533   0.609
  277   2HG2  VAL  36          2HG2      VAL  36 -15.925   1.594   0.350
  278   3HG2  VAL  36          3HG2      VAL  36 -15.676  -0.059   0.907
  279    H    SER  37           H        SER  37 -17.854   1.787   5.061
  280    HA   SER  37           HA       SER  37 -17.996   4.460   6.050
  281   1HB   SER  37          1HB       SER  37 -17.711   3.477   8.249
  282   2HB   SER  37          2HB       SER  37 -18.735   2.411   7.294
  283    HG   SER  37           HG       SER  37 -16.078   1.889   6.985
  284    H    ASP  38           H        ASP  38 -16.358   5.531   7.426
  285    HA   ASP  38           HA       ASP  38 -13.819   5.719   6.095
  286   1HB   ASP  38          1HB       ASP  38 -14.975   7.561   7.398
  287   2HB   ASP  38          2HB       ASP  38 -14.480   6.726   8.871
  288    H    TYR  39           H        TYR  39 -14.989   3.597   8.498
  289    HA   TYR  39           HA       TYR  39 -12.642   3.098  10.020
  290   1HB   TYR  39          1HB       TYR  39 -14.777   2.184  10.708
  291   2HB   TYR  39          2HB       TYR  39 -14.914   1.260   9.214
  292    HD1  TYR  39           HD1      TYR  39 -13.565  -0.732   8.829
  293    HD2  TYR  39           HD2      TYR  39 -13.231   1.497  12.486
  294    HE1  TYR  39           HE1      TYR  39 -12.347  -2.622   9.869
  295    HE2  TYR  39           HE2      TYR  39 -12.011  -0.396  13.527
  296    HH   TYR  39           HH       TYR  39 -11.884  -3.496  12.113
  297    H    TYR  40           H        TYR  40 -13.796   1.452   7.042
  298    HA   TYR  40           HA       TYR  40 -11.532  -0.289   6.821
  299   1HB   TYR  40          1HB       TYR  40 -13.345   0.816   4.654
  300   2HB   TYR  40          2HB       TYR  40 -12.214  -0.518   4.439
  301    HD1  TYR  40           HD1      TYR  40 -15.372   0.558   5.962
  302    HD2  TYR  40           HD2      TYR  40 -12.607  -2.696   5.507
  303    HE1  TYR  40           HE1      TYR  40 -17.083  -1.012   6.816
  304    HE2  TYR  40           HE2      TYR  40 -14.319  -4.271   6.368
  305    HH   TYR  40           HH       TYR  40 -17.563  -3.506   6.604
  306    H    LYS  41           H        LYS  41 -12.119   2.979   5.500
  307    HA   LYS  41           HA       LYS  41  -9.799   3.110   3.855
  308   1HB   LYS  41          1HB       LYS  41 -11.342   5.259   5.331
  309   2HB   LYS  41          2HB       LYS  41 -10.040   5.603   4.193
  310   1HG   LYS  41          1HG       LYS  41 -11.244   4.562   2.378
  311   2HG   LYS  41          2HG       LYS  41 -12.461   3.925   3.481
  312   1HD   LYS  41          1HD       LYS  41 -13.518   5.812   2.546
  313   2HD   LYS  41          2HD       LYS  41 -12.914   6.416   4.083
  314   1HE   LYS  41          1HE       LYS  41 -12.382   8.016   2.329
  315   2HE   LYS  41          2HE       LYS  41 -10.892   7.282   2.912
  316   1HZ   LYS  41          1HZ       LYS  41 -11.905   5.674   0.866
  317   2HZ   LYS  41          2HZ       LYS  41 -11.934   7.278   0.310
  318   3HZ   LYS  41          3HZ       LYS  41 -10.480   6.600   0.860
  319    H    ASN  42           H        ASN  42 -10.352   4.015   7.222
  320    HA   ASN  42           HA       ASN  42  -7.751   4.991   7.773
  321   1HB   ASN  42          1HB       ASN  42  -9.654   5.304   9.314
  322   2HB   ASN  42          2HB       ASN  42  -9.668   3.570   9.644
  323   2HD2  ASN  42          2HD2      ASN  42  -9.059   3.739  11.883
  324   1HD2  ASN  42          1HD2      ASN  42  -7.532   4.297  12.371
  325    H    LEU  43           H        LEU  43  -9.081   1.715   7.899
  326    HA   LEU  43           HA       LEU  43  -6.838   0.451   9.086
  327   1HB   LEU  43          1HB       LEU  43  -9.024  -0.657   8.783
  328   2HB   LEU  43          2HB       LEU  43  -8.790  -0.648   7.037
  329    HG   LEU  43           HG       LEU  43  -6.798  -2.076   7.291
  330   1HD1  LEU  43          1HD1      LEU  43  -7.422  -1.707  10.217
  331   2HD1  LEU  43          2HD1      LEU  43  -6.614  -3.176   9.670
  332   3HD1  LEU  43          3HD1      LEU  43  -5.864  -1.608   9.396
  333   1HD2  LEU  43          1HD2      LEU  43  -9.178  -2.993   7.109
  334   2HD2  LEU  43          2HD2      LEU  43  -7.979  -4.103   7.772
  335   3HD2  LEU  43          3HD2      LEU  43  -9.100  -3.272   8.848
  336    H    ILE  44           H        ILE  44  -7.536   1.235   5.677
  337    HA   ILE  44           HA       ILE  44  -5.289  -0.110   4.526
  338    HB   ILE  44           HB       ILE  44  -6.567   2.492   3.614
  339   1HG1  ILE  44          1HG1      ILE  44  -8.319   0.857   3.740
  340   2HG1  ILE  44          2HG1      ILE  44  -7.845   0.958   2.052
  341   1HG2  ILE  44          1HG2      ILE  44  -4.854   0.429   2.208
  342   2HG2  ILE  44          2HG2      ILE  44  -5.770   1.674   1.359
  343   3HG2  ILE  44          3HG2      ILE  44  -4.483   2.133   2.473
  344   1HD1  ILE  44          1HD1      ILE  44  -6.250  -1.017   2.604
  345   2HD1  ILE  44          2HD1      ILE  44  -7.254  -1.218   4.042
  346   3HD1  ILE  44          3HD1      ILE  44  -7.973  -1.356   2.443
  347    H    ASN  45           H        ASN  45  -5.621   3.136   5.912
  348    HA   ASN  45           HA       ASN  45  -3.058   4.127   5.216
  349   1HB   ASN  45          1HB       ASN  45  -4.905   4.674   7.549
  350   2HB   ASN  45          2HB       ASN  45  -3.351   5.495   7.394
  351   2HD2  ASN  45          2HD2      ASN  45  -3.121   6.126   4.754
  352   1HD2  ASN  45          1HD2      ASN  45  -4.436   7.055   4.217
  353    H    ASN  46           H        ASN  46  -4.078   1.948   7.786
  354    HA   ASN  46           HA       ASN  46  -1.312   1.856   8.885
  355   1HB   ASN  46          1HB       ASN  46  -3.362   2.016  10.387
  356   2HB   ASN  46          2HB       ASN  46  -3.765   0.378   9.872
  357   2HD2  ASN  46          2HD2      ASN  46  -3.412  -0.219  12.219
  358   1HD2  ASN  46          1HD2      ASN  46  -1.826  -0.482  12.766
  359    H    ALA  47           H        ALA  47  -1.414   0.843   6.333
  360    HA   ALA  47           HA       ALA  47  -2.014  -1.978   6.220
  361   1HB   ALA  47          1HB       ALA  47  -1.839  -0.617   4.178
  362   2HB   ALA  47          2HB       ALA  47  -0.134  -0.315   4.516
  363   3HB   ALA  47          3HB       ALA  47  -0.681  -1.946   4.129
  364    H    LYS  48           H        LYS  48  -0.918  -3.526   7.306
  365    HA   LYS  48           HA       LYS  48   1.641  -3.041   8.550
  366   1HB   LYS  48          1HB       LYS  48  -0.020  -4.627   9.477
  367   2HB   LYS  48          2HB       LYS  48   0.214  -5.675   8.079
  368   1HG   LYS  48          1HG       LYS  48   2.575  -5.971   8.651
  369   2HG   LYS  48          2HG       LYS  48   2.414  -4.856  10.003
  370   1HD   LYS  48          1HD       LYS  48   0.575  -7.237   9.902
  371   2HD   LYS  48          2HD       LYS  48   2.253  -7.504  10.364
  372   1HE   LYS  48          1HE       LYS  48   0.962  -7.126  12.378
  373   2HE   LYS  48          2HE       LYS  48   1.994  -5.723  12.120
  374   1HZ   LYS  48          1HZ       LYS  48  -0.749  -5.775  11.047
  375   2HZ   LYS  48          2HZ       LYS  48  -0.477  -5.374  12.671
  376   3HZ   LYS  48          3HZ       LYS  48   0.222  -4.438  11.438
  377    H    THR  49           H        THR  49   0.653  -4.789   5.613
  378    HA   THR  49           HA       THR  49   3.511  -4.721   4.742
  379    HB   THR  49           HB       THR  49   1.800  -7.170   4.289
  380    HG1  THR  49           HG1      THR  49   3.633  -7.502   6.209
  381   1HG2  THR  49          1HG2      THR  49   3.920  -6.716   2.982
  382   2HG2  THR  49          2HG2      THR  49   4.796  -6.828   4.509
  383   3HG2  THR  49          3HG2      THR  49   3.920  -8.229   3.890
  384    H    VAL  50           H        VAL  50   3.779  -4.701   2.453
  385    HA   VAL  50           HA       VAL  50   1.826  -3.258   0.973
  386    HB   VAL  50           HB       VAL  50   3.917  -5.062  -0.249
  387   1HG1  VAL  50          1HG1      VAL  50   2.345  -3.940  -1.784
  388   2HG1  VAL  50          2HG1      VAL  50   2.762  -2.382  -1.071
  389   3HG1  VAL  50          3HG1      VAL  50   3.976  -3.295  -1.966
  390   1HG2  VAL  50          1HG2      VAL  50   4.229  -2.395   1.138
  391   2HG2  VAL  50          2HG2      VAL  50   5.121  -3.884   1.436
  392   3HG2  VAL  50          3HG2      VAL  50   5.392  -2.975  -0.051
  393    H    GLU  51           H        GLU  51   2.695  -6.720   0.823
  394    HA   GLU  51           HA       GLU  51   0.788  -7.440  -1.158
  395   1HB   GLU  51          1HB       GLU  51   1.062  -9.741  -0.306
  396   2HB   GLU  51          2HB       GLU  51   2.623  -8.933  -0.436
  397   1HG   GLU  51          1HG       GLU  51   2.530  -8.389   1.984
  398   2HG   GLU  51          2HG       GLU  51   0.994  -9.249   2.105
  399    H    GLY  52           H        GLY  52   0.518  -6.953   2.300
  400   1HA   GLY  52          1HA       GLY  52  -1.353  -6.945   3.709
  401   2HA   GLY  52          2HA       GLY  52  -2.077  -8.140   2.630
  402    H    VAL  53           H        VAL  53  -0.985  -5.082   1.326
  403    HA   VAL  53           HA       VAL  53  -3.385  -3.569   1.698
  404    HB   VAL  53           HB       VAL  53  -1.364  -3.424  -0.561
  405   1HG1  VAL  53          1HG1      VAL  53  -3.685  -1.687   0.251
  406   2HG1  VAL  53          2HG1      VAL  53  -2.250  -0.929  -0.438
  407   3HG1  VAL  53          3HG1      VAL  53  -3.139  -2.136  -1.363
  408   1HG2  VAL  53          1HG2      VAL  53  -0.508  -3.160   1.818
  409   2HG2  VAL  53          2HG2      VAL  53  -0.233  -1.771   0.770
  410   3HG2  VAL  53          3HG2      VAL  53  -1.541  -1.739   1.953
  411    H    LYS  54           H        LYS  54  -2.337  -5.519  -1.123
  412    HA   LYS  54           HA       LYS  54  -4.848  -5.159  -2.515
  413   1HB   LYS  54          1HB       LYS  54  -2.570  -7.117  -2.874
  414   2HB   LYS  54          2HB       LYS  54  -3.970  -7.053  -3.946
  415   1HG   LYS  54          1HG       LYS  54  -3.492  -4.681  -4.442
  416   2HG   LYS  54          2HG       LYS  54  -2.089  -4.743  -3.375
  417   1HD   LYS  54          1HD       LYS  54  -1.083  -6.496  -4.780
  418   2HD   LYS  54          2HD       LYS  54  -2.481  -6.446  -5.853
  419   1HE   LYS  54          1HE       LYS  54  -2.006  -4.093  -6.385
  420   2HE   LYS  54          2HE       LYS  54  -0.623  -4.116  -5.289
  421   1HZ   LYS  54          1HZ       LYS  54   0.182  -6.058  -6.685
  422   2HZ   LYS  54          2HZ       LYS  54  -0.974  -5.575  -7.834
  423   3HZ   LYS  54          3HZ       LYS  54   0.272  -4.514  -7.389
  424    H    ALA  55           H        ALA  55  -3.546  -7.756  -0.456
  425    HA   ALA  55           HA       ALA  55  -5.713  -9.592  -0.885
  426   1HB   ALA  55          1HB       ALA  55  -4.904 -10.649   1.249
  427   2HB   ALA  55          2HB       ALA  55  -3.786  -9.299   1.439
  428   3HB   ALA  55          3HB       ALA  55  -3.626 -10.389   0.062
  429    H    LEU  56           H        LEU  56  -5.253  -6.954   1.404
  430    HA   LEU  56           HA       LEU  56  -7.460  -7.596   3.102
  431   1HB   LEU  56          1HB       LEU  56  -5.661  -6.067   3.778
  432   2HB   LEU  56          2HB       LEU  56  -6.141  -4.927   2.524
  433    HG   LEU  56           HG       LEU  56  -8.325  -4.622   3.614
  434   1HD1  LEU  56          1HD1      LEU  56  -7.249  -6.767   5.449
  435   2HD1  LEU  56          2HD1      LEU  56  -8.440  -5.606   6.037
  436   3HD1  LEU  56          3HD1      LEU  56  -8.837  -6.662   4.687
  437   1HD2  LEU  56          1HD2      LEU  56  -6.257  -3.303   4.279
  438   2HD2  LEU  56          2HD2      LEU  56  -7.530  -3.356   5.496
  439   3HD2  LEU  56          3HD2      LEU  56  -6.107  -4.381   5.666
  440    H    ILE  57           H        ILE  57  -7.190  -5.552   0.191
  441    HA   ILE  57           HA       ILE  57  -9.937  -4.651   0.267
  442    HB   ILE  57           HB       ILE  57  -8.187  -5.028  -2.183
  443   1HG1  ILE  57          1HG1      ILE  57  -7.202  -3.609  -0.244
  444   2HG1  ILE  57          2HG1      ILE  57  -7.245  -2.883  -1.845
  445   1HG2  ILE  57          1HG2      ILE  57 -10.683  -3.439  -1.603
  446   2HG2  ILE  57          2HG2      ILE  57  -9.606  -2.997  -2.928
  447   3HG2  ILE  57          3HG2      ILE  57 -10.379  -4.579  -2.911
  448   1HD1  ILE  57          1HD1      ILE  57  -9.494  -2.451   0.130
  449   2HD1  ILE  57          2HD1      ILE  57  -8.057  -1.441   0.132
  450   3HD1  ILE  57          3HD1      ILE  57  -9.088  -1.498  -1.293
  451    H    ASP  58           H        ASP  58  -8.243  -7.421  -1.087
  452    HA   ASP  58           HA       ASP  58 -10.375  -8.486  -2.652
  453   1HB   ASP  58          1HB       ASP  58  -8.055  -9.342  -2.750
  454   2HB   ASP  58          2HB       ASP  58  -8.225  -9.976  -1.112
  455    H    GLU  59           H        GLU  59  -9.586  -8.860   0.795
  456    HA   GLU  59           HA       GLU  59 -11.704 -10.753   1.317
  457   1HB   GLU  59          1HB       GLU  59 -10.133  -8.897   3.129
  458   2HB   GLU  59          2HB       GLU  59 -11.323 -10.055   3.724
  459   1HG   GLU  59          1HG       GLU  59 -10.059 -11.899   2.678
  460   2HG   GLU  59          2HG       GLU  59  -8.865 -10.744   2.084
  461    H    ILE  60           H        ILE  60 -11.386  -7.232   1.495
  462    HA   ILE  60           HA       ILE  60 -13.994  -6.784   2.602
  463    HB   ILE  60           HB       ILE  60 -12.213  -4.974   0.946
  464   1HG1  ILE  60          1HG1      ILE  60 -12.710  -4.972   3.935
  465   2HG1  ILE  60          2HG1      ILE  60 -11.378  -5.860   3.196
  466   1HG2  ILE  60          1HG2      ILE  60 -14.736  -4.443   2.537
  467   2HG2  ILE  60          2HG2      ILE  60 -13.618  -3.168   2.051
  468   3HG2  ILE  60          3HG2      ILE  60 -14.458  -4.119   0.826
  469   1HD1  ILE  60          1HD1      ILE  60 -11.793  -2.928   2.611
  470   2HD1  ILE  60          2HD1      ILE  60 -10.908  -3.453   4.042
  471   3HD1  ILE  60          3HD1      ILE  60 -10.325  -3.890   2.439
  472    H    LEU  61           H        LEU  61 -12.745  -6.939  -0.724
  473    HA   LEU  61           HA       LEU  61 -15.271  -6.255  -1.962
  474   1HB   LEU  61          1HB       LEU  61 -12.813  -7.681  -3.022
  475   2HB   LEU  61          2HB       LEU  61 -14.212  -7.297  -4.023
  476    HG   LEU  61           HG       LEU  61 -12.557  -5.271  -2.489
  477   1HD1  LEU  61          1HD1      LEU  61 -12.621  -6.053  -5.420
  478   2HD1  LEU  61          2HD1      LEU  61 -11.806  -4.616  -4.803
  479   3HD1  LEU  61          3HD1      LEU  61 -11.260  -6.220  -4.312
  480   1HD2  LEU  61          1HD2      LEU  61 -15.042  -5.107  -4.181
  481   2HD2  LEU  61          2HD2      LEU  61 -14.605  -4.187  -2.741
  482   3HD2  LEU  61          3HD2      LEU  61 -13.876  -3.788  -4.291
  483    H    ALA  62           H        ALA  62 -13.822  -9.225  -0.800
  484    HA   ALA  62           HA       ALA  62 -15.471 -11.093  -2.164
  485   1HB   ALA  62          1HB       ALA  62 -14.077 -11.140   0.512
  486   2HB   ALA  62          2HB       ALA  62 -15.058 -12.504  -0.025
  487   3HB   ALA  62          3HB       ALA  62 -13.651 -12.005  -0.963
  488    H    ALA  63           H        ALA  63 -16.126  -8.978   0.552
  489    HA   ALA  63           HA       ALA  63 -18.436 -10.276   1.597
  490   1HB   ALA  63          1HB       ALA  63 -17.456  -8.419   2.801
  491   2HB   ALA  63          2HB       ALA  63 -17.704  -7.338   1.430
  492   3HB   ALA  63          3HB       ALA  63 -19.090  -7.947   2.336
  493    H    LEU  64           H        LEU  64 -18.036  -7.985  -1.088
  494    HA   LEU  64           HA       LEU  64 -20.852  -7.777  -1.658
  495   1HB   LEU  64          1HB       LEU  64 -18.389  -7.264  -3.352
  496   2HB   LEU  64          2HB       LEU  64 -20.020  -6.872  -3.880
  497    HG   LEU  64           HG       LEU  64 -18.968  -5.840  -1.241
  498   1HD1  LEU  64          1HD1      LEU  64 -18.594  -4.606  -3.986
  499   2HD1  LEU  64          2HD1      LEU  64 -18.342  -3.745  -2.467
  500   3HD1  LEU  64          3HD1      LEU  64 -17.322  -5.124  -2.880
  501   1HD2  LEU  64          1HD2      LEU  64 -21.115  -4.963  -3.201
  502   2HD2  LEU  64          2HD2      LEU  64 -21.339  -5.525  -1.545
  503   3HD2  LEU  64          3HD2      LEU  64 -20.578  -3.966  -1.852
  504    HA   PRO  65           HA       PRO  65 -21.446 -11.707  -3.680
  505   1HB   PRO  65          1HB       PRO  65 -23.093 -10.813  -5.824
  506   2HB   PRO  65          2HB       PRO  65 -23.634 -11.389  -4.243
  507   1HG   PRO  65          1HG       PRO  65 -23.499  -8.624  -5.271
  508   2HG   PRO  65          2HG       PRO  65 -24.456  -9.275  -3.934
  509   1HD   PRO  65          1HD       PRO  65 -22.183  -7.653  -3.648
  510   2HD   PRO  65          2HD       PRO  65 -22.864  -8.691  -2.371

  No H/Q in entry =         510
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  34.776  -5.391  21.981
    2    H2   MET   1           H2       MET   1  33.617  -5.429  23.223
    3    H3   MET   1           H3       MET   1  34.524  -6.818  22.862
    4    HA   MET   1           HA       MET   1  33.385  -7.251  20.921
    5   1HB   MET   1          1HB       MET   1  31.485  -5.998  22.920
    6   2HB   MET   1          2HB       MET   1  30.940  -6.921  21.520
    7   1HG   MET   1          1HG       MET   1  32.241  -8.874  22.300
    8   2HG   MET   1          2HG       MET   1  32.780  -7.955  23.702
    9   1HE   MET   1          1HE       MET   1  31.548  -7.206  25.539
   10   2HE   MET   1          2HE       MET   1  30.180  -6.371  24.811
   11   3HE   MET   1          3HE       MET   1  29.908  -7.631  26.019
   12    H    LYS   2           H        LYS   2  32.945  -6.421  18.926
   13    HA   LYS   2           HA       LYS   2  33.162  -3.599  18.425
   14   1HB   LYS   2          1HB       LYS   2  32.213  -5.904  16.696
   15   2HB   LYS   2          2HB       LYS   2  32.408  -4.257  16.096
   16   1HG   LYS   2          1HG       LYS   2  34.767  -4.271  16.601
   17   2HG   LYS   2          2HG       LYS   2  34.624  -5.802  17.463
   18   1HD   LYS   2          1HD       LYS   2  35.552  -6.166  15.213
   19   2HD   LYS   2          2HD       LYS   2  33.969  -6.925  15.360
   20   1HE   LYS   2          1HE       LYS   2  34.181  -4.113  14.301
   21   2HE   LYS   2          2HE       LYS   2  34.500  -5.481  13.237
   22   1HZ   LYS   2          1HZ       LYS   2  32.195  -6.083  14.658
   23   2HZ   LYS   2          2HZ       LYS   2  32.021  -4.482  14.124
   24   3HZ   LYS   2          3HZ       LYS   2  32.331  -5.720  13.004
   25    H    ALA   3           H        ALA   3  31.543  -2.061  18.047
   26    HA   ALA   3           HA       ALA   3  28.701  -2.940  18.086
   27   1HB   ALA   3          1HB       ALA   3  29.957  -1.022  20.068
   28   2HB   ALA   3          2HB       ALA   3  28.217  -1.148  19.807
   29   3HB   ALA   3          3HB       ALA   3  29.119  -2.532  20.427
   30    H    ILE   4           H        ILE   4  29.259  -2.204  15.792
   31    HA   ILE   4           HA       ILE   4  29.320   0.759  15.480
   32    HB   ILE   4           HB       ILE   4  29.355  -1.277  13.244
   33   1HG1  ILE   4          1HG1      ILE   4  31.634  -0.390  15.039
   34   2HG1  ILE   4          2HG1      ILE   4  31.071  -2.037  14.765
   35   1HG2  ILE   4          1HG2      ILE   4  29.123   1.227  12.826
   36   2HG2  ILE   4          2HG2      ILE   4  30.736   1.408  13.507
   37   3HG2  ILE   4          3HG2      ILE   4  30.498   0.463  12.038
   38   1HD1  ILE   4          1HD1      ILE   4  31.678  -1.717  12.317
   39   2HD1  ILE   4          2HD1      ILE   4  32.477  -0.218  12.793
   40   3HD1  ILE   4          3HD1      ILE   4  33.045  -1.761  13.429
   41    H    PHE   5           H        PHE   5  27.036  -1.607  15.868
   42    HA   PHE   5           HA       PHE   5  25.141  -0.972  13.801
   43   1HB   PHE   5          1HB       PHE   5  23.507  -2.117  15.237
   44   2HB   PHE   5          2HB       PHE   5  25.013  -3.032  15.170
   45    HD1  PHE   5           HD1      PHE   5  26.521  -3.134  17.086
   46    HD2  PHE   5           HD2      PHE   5  22.848  -0.914  17.265
   47    HE1  PHE   5           HE1      PHE   5  26.720  -3.004  19.554
   48    HE2  PHE   5           HE2      PHE   5  23.048  -0.783  19.734
   49    HZ   PHE   5           HZ       PHE   5  24.984  -1.827  20.878
   50    H    VAL   6           H        VAL   6  26.247   0.845  16.432
   51    HA   VAL   6           HA       VAL   6  23.999   2.181  17.425
   52    HB   VAL   6           HB       VAL   6  25.485   4.163  17.714
   53   1HG1  VAL   6          1HG1      VAL   6  25.553   2.223  19.286
   54   2HG1  VAL   6          2HG1      VAL   6  26.862   1.532  18.326
   55   3HG1  VAL   6          3HG1      VAL   6  27.101   3.063  19.167
   56   1HG2  VAL   6          1HG2      VAL   6  27.381   2.474  16.054
   57   2HG2  VAL   6          2HG2      VAL   6  26.705   4.040  15.608
   58   3HG2  VAL   6          3HG2      VAL   6  27.852   3.923  16.942
   59    H    LEU   7           H        LEU   7  24.994   2.041  14.187
   60    HA   LEU   7           HA       LEU   7  24.134   4.683  13.359
   61   1HB   LEU   7          1HB       LEU   7  24.384   2.134  11.734
   62   2HB   LEU   7          2HB       LEU   7  24.220   3.761  11.077
   63    HG   LEU   7           HG       LEU   7  26.502   2.823  12.842
   64   1HD1  LEU   7          1HD1      LEU   7  26.373   3.359   9.858
   65   2HD1  LEU   7          2HD1      LEU   7  27.835   2.962  10.761
   66   3HD1  LEU   7          3HD1      LEU   7  26.538   1.775  10.615
   67   1HD2  LEU   7          1HD2      LEU   7  25.772   5.460  11.568
   68   2HD2  LEU   7          2HD2      LEU   7  26.397   5.142  13.186
   69   3HD2  LEU   7          3HD2      LEU   7  27.471   5.045  11.794
   70    H    ASN   8           H        ASN   8  22.315   2.558  14.865
   71    HA   ASN   8           HA       ASN   8  20.100   2.003  13.160
   72   1HB   ASN   8          1HB       ASN   8  20.244   2.481  16.152
   73   2HB   ASN   8          2HB       ASN   8  18.782   1.944  15.327
   74   2HD2  ASN   8          2HD2      ASN   8  20.267   0.374  17.320
   75   1HD2  ASN   8          1HD2      ASN   8  20.811  -1.027  16.532
   76    H    ALA   9           H        ALA   9  18.323   3.257  12.570
   77    HA   ALA   9           HA       ALA   9  18.565   6.175  13.101
   78   1HB   ALA   9          1HB       ALA   9  16.585   4.824  11.259
   79   2HB   ALA   9          2HB       ALA   9  18.240   5.171  10.760
   80   3HB   ALA   9          3HB       ALA   9  17.160   6.490  11.211
   81    H    GLN  10           H        GLN  10  17.586   6.687  15.020
   82    HA   GLN  10           HA       GLN  10  15.372   5.305  16.174
   83   1HB   GLN  10          1HB       GLN  10  16.386   8.138  16.541
   84   2HB   GLN  10          2HB       GLN  10  15.102   7.433  17.523
   85   1HG   GLN  10          1HG       GLN  10  17.840   6.175  17.213
   86   2HG   GLN  10          2HG       GLN  10  17.416   7.261  18.538
   87   2HE2  GLN  10          2HE2      GLN  10  14.888   6.468  19.282
   88   1HE2  GLN  10          1HE2      GLN  10  14.878   4.836  19.748
   89    H    HIS  11           H        HIS  11  15.567   8.129  14.044
   90    HA   HIS  11           HA       HIS  11  12.681   8.556  14.032
   91   1HB   HIS  11          1HB       HIS  11  14.852   9.616  12.196
   92   2HB   HIS  11          2HB       HIS  11  13.186  10.194  12.246
   93    HD1  HIS  11           HD1      HIS  11  16.401  10.244  14.179
   94    HD2  HIS  11           HD2      HIS  11  12.540  11.778  14.528
   95    HE1  HIS  11           HE1      HIS  11  16.473  11.946  16.054
   96    H    ASP  12           H        ASP  12  11.949   8.831  11.439
   97    HA   ASP  12           HA       ASP  12  12.389   6.115  10.221
   98   1HB   ASP  12          1HB       ASP  12  10.095   6.501  11.201
   99   2HB   ASP  12          2HB       ASP  12   9.885   7.817  10.048
  100    H    GLU  13           H        GLU  13  14.197   7.366   9.115
  101    HA   GLU  13           HA       GLU  13  13.293   9.270   7.031
  102   1HB   GLU  13          1HB       GLU  13  16.029   8.253   7.846
  103   2HB   GLU  13          2HB       GLU  13  15.766   9.337   6.480
  104   1HG   GLU  13          1HG       GLU  13  14.829   9.949   9.296
  105   2HG   GLU  13          2HG       GLU  13  16.373  10.500   8.645
  106    H    ALA  14           H        ALA  14  11.976   7.365   6.098
  107    HA   ALA  14           HA       ALA  14  13.560   5.319   4.701
  108   1HB   ALA  14          1HB       ALA  14  10.619   5.884   4.297
  109   2HB   ALA  14          2HB       ALA  14  11.483   4.365   4.062
  110   3HB   ALA  14          3HB       ALA  14  11.214   4.984   5.692
  111    H    VAL  15           H        VAL  15  14.646   5.938   2.925
  112    HA   VAL  15           HA       VAL  15  14.088   8.242   1.349
  113    HB   VAL  15           HB       VAL  15  16.267   6.989   1.438
  114   1HG1  VAL  15          1HG1      VAL  15  15.148   4.725   1.196
  115   2HG1  VAL  15          2HG1      VAL  15  14.928   5.099  -0.513
  116   3HG1  VAL  15          3HG1      VAL  15  16.552   4.977   0.158
  117   1HG2  VAL  15          1HG2      VAL  15  14.997   7.482  -1.270
  118   2HG2  VAL  15          2HG2      VAL  15  15.941   8.626  -0.317
  119   3HG2  VAL  15          3HG2      VAL  15  16.723   7.215  -1.028
  120    H    ASP  16           H        ASP  16  13.131   4.838   0.938
  121    HA   ASP  16           HA       ASP  16  11.496   5.593  -1.444
  122   1HB   ASP  16          1HB       ASP  16  11.254   3.172  -1.780
  123   2HB   ASP  16          2HB       ASP  16  12.959   3.594  -1.622
  124    H    ALA  17           H        ALA  17   9.285   5.647  -1.318
  125    HA   ALA  17           HA       ALA  17   7.756   4.187   0.637
  126   1HB   ALA  17          1HB       ALA  17   8.652   5.832   2.197
  127   2HB   ALA  17          2HB       ALA  17   6.943   6.171   1.927
  128   3HB   ALA  17          3HB       ALA  17   8.172   7.150   1.128
  129    H    ASN  18           H        ASN  18   8.098   6.339  -1.987
  130    HA   ASN  18           HA       ASN  18   5.435   7.281  -2.314
  131   1HB   ASN  18          1HB       ASN  18   7.335   8.105  -3.662
  132   2HB   ASN  18          2HB       ASN  18   7.450   6.535  -4.458
  133   2HD2  ASN  18          2HD2      ASN  18   4.718   8.776  -3.680
  134   1HD2  ASN  18          1HD2      ASN  18   4.057   8.741  -5.242
  135    H    SER  19           H        SER  19   6.982   4.275  -3.477
  136    HA   SER  19           HA       SER  19   4.704   3.271  -4.874
  137   1HB   SER  19          1HB       SER  19   7.010   2.322  -5.055
  138   2HB   SER  19          2HB       SER  19   6.837   1.670  -3.427
  139    HG   SER  19           HG       SER  19   5.880   0.738  -5.787
  140    H    LEU  20           H        LEU  20   5.790   2.746  -1.515
  141    HA   LEU  20           HA       LEU  20   3.666   1.021  -0.752
  142   1HB   LEU  20          1HB       LEU  20   5.685   1.363   0.623
  143   2HB   LEU  20          2HB       LEU  20   5.196   3.026   0.936
  144    HG   LEU  20           HG       LEU  20   3.154   2.220   2.067
  145   1HD1  LEU  20          1HD1      LEU  20   4.219  -0.447   1.149
  146   2HD1  LEU  20          2HD1      LEU  20   3.263  -0.357   2.630
  147   3HD1  LEU  20          3HD1      LEU  20   2.566   0.168   1.101
  148   1HD2  LEU  20          1HD2      LEU  20   5.716   0.925   3.052
  149   2HD2  LEU  20          2HD2      LEU  20   5.198   2.577   3.388
  150   3HD2  LEU  20          3HD2      LEU  20   4.282   1.217   4.037
  151    H    ALA  21           H        ALA  21   3.945   4.571  -0.426
  152    HA   ALA  21           HA       ALA  21   1.366   4.964   0.703
  153   1HB   ALA  21          1HB       ALA  21   3.041   6.833  -0.994
  154   2HB   ALA  21          2HB       ALA  21   3.082   6.707   0.764
  155   3HB   ALA  21          3HB       ALA  21   1.638   7.320  -0.042
  156    H    GLU  22           H        GLU  22   2.455   4.920  -2.689
  157    HA   GLU  22           HA       GLU  22   0.012   5.788  -3.847
  158   1HB   GLU  22          1HB       GLU  22   2.215   5.489  -5.053
  159   2HB   GLU  22          2HB       GLU  22   1.901   3.753  -5.054
  160   1HG   GLU  22          1HG       GLU  22   1.126   4.632  -7.165
  161   2HG   GLU  22          2HG       GLU  22  -0.296   4.234  -6.200
  162    H    ALA  23           H        ALA  23   1.094   2.531  -2.909
  163    HA   ALA  23           HA       ALA  23  -1.126   1.107  -3.987
  164   1HB   ALA  23          1HB       ALA  23  -0.591  -0.552  -2.107
  165   2HB   ALA  23          2HB       ALA  23   0.730  -0.180  -3.214
  166   3HB   ALA  23          3HB       ALA  23   0.679   0.570  -1.618
  167    H    LYS  24           H        LYS  24  -0.642   2.654  -0.825
  168    HA   LYS  24           HA       LYS  24  -3.219   1.908   0.239
  169   1HB   LYS  24          1HB       LYS  24  -1.263   4.114   0.945
  170   2HB   LYS  24          2HB       LYS  24  -2.726   3.775   1.873
  171   1HG   LYS  24          1HG       LYS  24  -1.958   1.459   2.250
  172   2HG   LYS  24          2HG       LYS  24  -0.492   1.797   1.327
  173   1HD   LYS  24          1HD       LYS  24   0.129   3.552   2.943
  174   2HD   LYS  24          2HD       LYS  24  -1.331   3.216   3.869
  175   1HE   LYS  24          1HE       LYS  24   0.675   2.077   4.812
  176   2HE   LYS  24          2HE       LYS  24  -0.577   0.941   4.314
  177   1HZ   LYS  24          1HZ       LYS  24   1.216   1.577   2.184
  178   2HZ   LYS  24          2HZ       LYS  24   2.032   0.916   3.515
  179   3HZ   LYS  24          3HZ       LYS  24   0.756   0.059   2.792
  180    H    VAL  25           H        VAL  25  -1.994   4.763  -1.497
  181    HA   VAL  25           HA       VAL  25  -4.396   6.312  -1.286
  182    HB   VAL  25           HB       VAL  25  -2.160   6.326  -3.320
  183   1HG1  VAL  25          1HG1      VAL  25  -4.562   8.135  -3.023
  184   2HG1  VAL  25          2HG1      VAL  25  -3.090   8.646  -3.850
  185   3HG1  VAL  25          3HG1      VAL  25  -4.020   7.279  -4.466
  186   1HG2  VAL  25          1HG2      VAL  25  -1.748   6.972  -0.880
  187   2HG2  VAL  25          2HG2      VAL  25  -1.320   8.189  -2.083
  188   3HG2  VAL  25          3HG2      VAL  25  -2.818   8.344  -1.167
  189    H    LEU  26           H        LEU  26  -3.183   4.162  -3.873
  190    HA   LEU  26           HA       LEU  26  -5.455   4.446  -5.575
  191   1HB   LEU  26          1HB       LEU  26  -3.478   2.175  -5.233
  192   2HB   LEU  26          2HB       LEU  26  -4.705   2.201  -6.497
  193    HG   LEU  26           HG       LEU  26  -2.647   4.394  -6.098
  194   1HD1  LEU  26          1HD1      LEU  26  -2.645   2.043  -8.016
  195   2HD1  LEU  26          2HD1      LEU  26  -1.494   3.380  -8.050
  196   3HD1  LEU  26          3HD1      LEU  26  -1.533   2.285  -6.668
  197   1HD2  LEU  26          1HD2      LEU  26  -4.796   3.829  -8.142
  198   2HD2  LEU  26          2HD2      LEU  26  -4.364   5.357  -7.376
  199   3HD2  LEU  26          3HD2      LEU  26  -3.338   4.686  -8.638
  200    H    ALA  27           H        ALA  27  -4.772   2.198  -2.909
  201    HA   ALA  27           HA       ALA  27  -7.181   0.646  -3.250
  202   1HB   ALA  27          1HB       ALA  27  -5.174  -0.084  -1.912
  203   2HB   ALA  27          2HB       ALA  27  -5.621   1.105  -0.689
  204   3HB   ALA  27          3HB       ALA  27  -6.701  -0.244  -1.043
  205    H    ASN  28           H        ASN  28  -6.356   3.548  -1.410
  206    HA   ASN  28           HA       ASN  28  -8.740   3.772   0.129
  207   1HB   ASN  28          1HB       ASN  28  -6.628   5.154   0.371
  208   2HB   ASN  28          2HB       ASN  28  -7.141   6.065  -1.048
  209   2HD2  ASN  28          2HD2      ASN  28  -7.851   5.429   2.357
  210   1HD2  ASN  28          1HD2      ASN  28  -8.978   6.687   2.541
  211    H    ARG  29           H        ARG  29  -7.952   4.842  -3.156
  212    HA   ARG  29           HA       ARG  29 -10.373   6.272  -3.671
  213   1HB   ARG  29          1HB       ARG  29  -8.535   4.788  -5.575
  214   2HB   ARG  29          2HB       ARG  29  -9.778   5.933  -6.069
  215   1HG   ARG  29          1HG       ARG  29  -7.630   6.722  -4.096
  216   2HG   ARG  29          2HG       ARG  29  -7.343   6.806  -5.832
  217   1HD   ARG  29          1HD       ARG  29  -9.438   8.226  -6.016
  218   2HD   ARG  29          2HD       ARG  29  -9.464   8.289  -4.255
  219    HE   ARG  29           HE       ARG  29  -6.903   9.109  -4.893
  220   1HH1  ARG  29          1HH1      ARG  29  -6.381  11.281  -5.256
  221   2HH1  ARG  29          2HH1      ARG  29  -7.614  12.376  -5.782
  222   1HH2  ARG  29          1HH2      ARG  29 -10.111   9.971  -5.812
  223   2HH2  ARG  29          2HH2      ARG  29  -9.726  11.635  -6.096
  224    H    GLU  30           H        GLU  30  -9.542   2.845  -3.954
  225    HA   GLU  30           HA       GLU  30 -11.814   2.000  -5.436
  226   1HB   GLU  30          1HB       GLU  30 -10.157   0.564  -3.349
  227   2HB   GLU  30          2HB       GLU  30 -11.416  -0.228  -4.298
  228   1HG   GLU  30          1HG       GLU  30 -10.272   0.287  -6.365
  229   2HG   GLU  30          2HG       GLU  30  -9.086   1.277  -5.514
  230    H    LEU  31           H        LEU  31 -11.395   2.489  -1.946
  231    HA   LEU  31           HA       LEU  31 -13.889   1.393  -1.119
  232   1HB   LEU  31          1HB       LEU  31 -12.640   3.849   0.139
  233   2HB   LEU  31          2HB       LEU  31 -13.557   2.565   0.928
  234    HG   LEU  31           HG       LEU  31 -10.791   2.359  -0.276
  235   1HD1  LEU  31          1HD1      LEU  31 -11.848   2.049   2.550
  236   2HD1  LEU  31          2HD1      LEU  31 -10.178   1.765   2.059
  237   3HD1  LEU  31          3HD1      LEU  31 -10.867   3.384   1.945
  238   1HD2  LEU  31          1HD2      LEU  31 -12.705   0.247   0.744
  239   2HD2  LEU  31          2HD2      LEU  31 -11.826   0.275  -0.784
  240   3HD2  LEU  31          3HD2      LEU  31 -10.961  -0.018   0.725
  241    H    ASP  32           H        ASP  32 -12.972   4.664  -2.103
  242    HA   ASP  32           HA       ASP  32 -15.500   5.920  -1.786
  243   1HB   ASP  32          1HB       ASP  32 -13.382   7.134  -2.145
  244   2HB   ASP  32          2HB       ASP  32 -13.295   6.496  -3.786
  245    H    LYS  33           H        LYS  33 -14.092   4.145  -4.526
  246    HA   LYS  33           HA       LYS  33 -16.105   4.710  -6.445
  247   1HB   LYS  33          1HB       LYS  33 -14.333   2.286  -6.059
  248   2HB   LYS  33          2HB       LYS  33 -15.380   2.493  -7.459
  249   1HG   LYS  33          1HG       LYS  33 -13.467   4.694  -6.695
  250   2HG   LYS  33          2HG       LYS  33 -12.865   3.292  -7.575
  251   1HD   LYS  33          1HD       LYS  33 -15.358   4.576  -8.642
  252   2HD   LYS  33          2HD       LYS  33 -13.855   5.472  -8.840
  253   1HE   LYS  33          1HE       LYS  33 -14.332   3.995 -10.782
  254   2HE   LYS  33          2HE       LYS  33 -12.827   3.560  -9.973
  255   1HZ   LYS  33          1HZ       LYS  33 -14.162   1.902  -8.692
  256   2HZ   LYS  33          2HZ       LYS  33 -15.458   2.217  -9.743
  257   3HZ   LYS  33          3HZ       LYS  33 -14.013   1.570 -10.351
  258    H    TYR  34           H        TYR  34 -15.958   2.149  -3.969
  259    HA   TYR  34           HA       TYR  34 -18.691   1.254  -4.788
  260   1HB   TYR  34          1HB       TYR  34 -16.892  -0.060  -2.751
  261   2HB   TYR  34          2HB       TYR  34 -18.222  -0.777  -3.659
  262    HD1  TYR  34           HD1      TYR  34 -14.776  -0.765  -3.477
  263    HD2  TYR  34           HD2      TYR  34 -17.912  -0.246  -6.372
  264    HE1  TYR  34           HE1      TYR  34 -13.207  -1.381  -5.295
  265    HE2  TYR  34           HE2      TYR  34 -16.338  -0.855  -8.184
  266    HH   TYR  34           HH       TYR  34 -13.459  -2.381  -7.680
  267    H    GLY  35           H        GLY  35 -17.303   3.402  -2.665
  268   1HA   GLY  35          1HA       GLY  35 -19.753   3.863  -1.268
  269   2HA   GLY  35          2HA       GLY  35 -18.199   4.580  -0.850
  270    H    VAL  36           H        VAL  36 -16.824   2.068  -0.308
  271    HA   VAL  36           HA       VAL  36 -18.340   0.546   1.630
  272    HB   VAL  36           HB       VAL  36 -15.324   0.779   1.642
  273   1HG1  VAL  36          1HG1      VAL  36 -17.284  -1.467   2.207
  274   2HG1  VAL  36          2HG1      VAL  36 -15.528  -1.627   2.255
  275   3HG1  VAL  36          3HG1      VAL  36 -16.351  -0.573   3.405
  276   1HG2  VAL  36          1HG2      VAL  36 -17.063  -0.831  -0.255
  277   2HG2  VAL  36          2HG2      VAL  36 -15.997   0.502  -0.696
  278   3HG2  VAL  36          3HG2      VAL  36 -15.315  -1.006  -0.091
  279    H    SER  37           H        SER  37 -17.784   0.526   4.004
  280    HA   SER  37           HA       SER  37 -18.205   3.006   5.228
  281   1HB   SER  37          1HB       SER  37 -16.807   0.543   6.298
  282   2HB   SER  37          2HB       SER  37 -17.211   1.933   7.300
  283    HG   SER  37           HG       SER  37 -19.153   0.715   5.662
  284    H    ASP  38           H        ASP  38 -16.885   4.660   5.938
  285    HA   ASP  38           HA       ASP  38 -14.319   4.983   4.666
  286   1HB   ASP  38          1HB       ASP  38 -15.726   6.540   6.850
  287   2HB   ASP  38          2HB       ASP  38 -14.183   7.033   6.150
  288    H    TYR  39           H        TYR  39 -15.279   3.414   7.544
  289    HA   TYR  39           HA       TYR  39 -13.039   3.868   9.235
  290   1HB   TYR  39          1HB       TYR  39 -15.006   2.741  10.079
  291   2HB   TYR  39          2HB       TYR  39 -14.825   1.442   8.900
  292    HD1  TYR  39           HD1      TYR  39 -13.096  -0.250   9.137
  293    HD2  TYR  39           HD2      TYR  39 -13.518   2.900  12.025
  294    HE1  TYR  39           HE1      TYR  39 -11.627  -1.487  10.697
  295    HE2  TYR  39           HE2      TYR  39 -12.048   1.659  13.591
  296    HH   TYR  39           HH       TYR  39 -10.026  -0.642  12.778
  297    H    TYR  40           H        TYR  40 -13.544   1.361   6.742
  298    HA   TYR  40           HA       TYR  40 -11.175  -0.098   7.093
  299   1HB   TYR  40          1HB       TYR  40 -12.669   0.569   4.546
  300   2HB   TYR  40          2HB       TYR  40 -11.360  -0.608   4.631
  301    HD1  TYR  40           HD1      TYR  40 -11.581  -2.541   6.317
  302    HD2  TYR  40           HD2      TYR  40 -14.867  -0.044   5.136
  303    HE1  TYR  40           HE1      TYR  40 -13.177  -4.268   7.106
  304    HE2  TYR  40           HE2      TYR  40 -16.464  -1.767   5.925
  305    HH   TYR  40           HH       TYR  40 -15.321  -4.903   7.155
  306    H    LYS  41           H        LYS  41 -11.466   3.170   5.871
  307    HA   LYS  41           HA       LYS  41  -9.058   3.134   4.299
  308   1HB   LYS  41          1HB       LYS  41  -9.344   5.437   4.053
  309   2HB   LYS  41          2HB       LYS  41 -10.991   4.921   4.397
  310   1HG   LYS  41          1HG       LYS  41 -10.459   5.422   6.865
  311   2HG   LYS  41          2HG       LYS  41  -9.020   6.242   6.271
  312   1HD   LYS  41          1HD       LYS  41 -11.866   6.881   5.447
  313   2HD   LYS  41          2HD       LYS  41 -10.882   7.834   6.557
  314   1HE   LYS  41          1HE       LYS  41  -9.162   7.943   4.618
  315   2HE   LYS  41          2HE       LYS  41 -10.500   7.421   3.593
  316   1HZ   LYS  41          1HZ       LYS  41 -11.794   9.306   4.482
  317   2HZ   LYS  41          2HZ       LYS  41 -10.410   9.839   5.312
  318   3HZ   LYS  41          3HZ       LYS  41 -10.421   9.794   3.613
  319    H    ASN  42           H        ASN  42  -9.743   3.872   7.696
  320    HA   ASN  42           HA       ASN  42  -7.098   4.709   8.359
  321   1HB   ASN  42          1HB       ASN  42  -9.024   5.093   9.861
  322   2HB   ASN  42          2HB       ASN  42  -9.165   3.353  10.119
  323   2HD2  ASN  42          2HD2      ASN  42  -8.777   4.108  12.485
  324   1HD2  ASN  42          1HD2      ASN  42  -7.163   4.243  12.995
  325    H    LEU  43           H        LEU  43  -8.674   1.545   8.292
  326    HA   LEU  43           HA       LEU  43  -6.508   0.065   9.413
  327   1HB   LEU  43          1HB       LEU  43  -8.784  -0.861   9.156
  328   2HB   LEU  43          2HB       LEU  43  -8.609  -0.810   7.404
  329    HG   LEU  43           HG       LEU  43  -6.726  -2.398   7.539
  330   1HD1  LEU  43          1HD1      LEU  43  -7.205  -2.048  10.496
  331   2HD1  LEU  43          2HD1      LEU  43  -6.567  -3.579   9.896
  332   3HD1  LEU  43          3HD1      LEU  43  -5.677  -2.086   9.613
  333   1HD2  LEU  43          1HD2      LEU  43  -9.124  -3.165   7.369
  334   2HD2  LEU  43          2HD2      LEU  43  -8.045  -4.356   8.097
  335   3HD2  LEU  43          3HD2      LEU  43  -9.116  -3.397   9.117
  336    H    ILE  44           H        ILE  44  -7.268   1.037   6.073
  337    HA   ILE  44           HA       ILE  44  -5.126  -0.396   4.808
  338    HB   ILE  44           HB       ILE  44  -6.546   2.177   4.051
  339   1HG1  ILE  44          1HG1      ILE  44  -7.758  -0.142   4.116
  340   2HG1  ILE  44          2HG1      ILE  44  -7.958   0.881   2.700
  341   1HG2  ILE  44          1HG2      ILE  44  -4.423   0.602   2.605
  342   2HG2  ILE  44          2HG2      ILE  44  -5.587   1.590   1.722
  343   3HG2  ILE  44          3HG2      ILE  44  -4.505   2.339   2.896
  344   1HD1  ILE  44          1HD1      ILE  44  -5.909  -1.356   2.881
  345   2HD1  ILE  44          2HD1      ILE  44  -7.503  -1.532   2.156
  346   3HD1  ILE  44          3HD1      ILE  44  -6.337  -0.423   1.447
  347    H    ASN  45           H        ASN  45  -5.335   2.849   6.238
  348    HA   ASN  45           HA       ASN  45  -2.855   3.891   5.465
  349   1HB   ASN  45          1HB       ASN  45  -4.369   4.217   8.062
  350   2HB   ASN  45          2HB       ASN  45  -2.934   5.157   7.659
  351   2HD2  ASN  45          2HD2      ASN  45  -3.233   5.875   5.053
  352   1HD2  ASN  45          1HD2      ASN  45  -4.687   6.715   4.800
  353    H    ASN  46           H        ASN  46  -3.537   1.448   7.904
  354    HA   ASN  46           HA       ASN  46  -0.631   1.372   8.645
  355   1HB   ASN  46          1HB       ASN  46  -1.359   0.119  10.625
  356   2HB   ASN  46          2HB       ASN  46  -2.222   1.652  10.518
  357   2HD2  ASN  46          2HD2      ASN  46  -4.236   1.087  11.447
  358   1HD2  ASN  46          1HD2      ASN  46  -5.235  -0.149  10.852
  359    H    ALA  47           H        ALA  47  -1.751   0.202   6.152
  360    HA   ALA  47           HA       ALA  47  -2.145  -2.598   6.386
  361   1HB   ALA  47          1HB       ALA  47  -2.367  -1.067   4.301
  362   2HB   ALA  47          2HB       ALA  47  -1.792  -2.715   4.058
  363   3HB   ALA  47          3HB       ALA  47  -0.647  -1.375   4.069
  364    H    LYS  48           H        LYS  48  -0.741  -4.312   6.583
  365    HA   LYS  48           HA       LYS  48   1.851  -3.861   7.715
  366   1HB   LYS  48          1HB       LYS  48   0.539  -6.334   6.581
  367   2HB   LYS  48          2HB       LYS  48   2.113  -6.358   7.375
  368   1HG   LYS  48          1HG       LYS  48   1.103  -5.390   9.411
  369   2HG   LYS  48          2HG       LYS  48  -0.473  -5.378   8.625
  370   1HD   LYS  48          1HD       LYS  48   1.105  -7.941   8.855
  371   2HD   LYS  48          2HD       LYS  48   0.120  -7.373  10.200
  372   1HE   LYS  48          1HE       LYS  48  -0.861  -7.966   7.388
  373   2HE   LYS  48          2HE       LYS  48  -1.188  -8.914   8.834
  374   1HZ   LYS  48          1HZ       LYS  48  -2.172  -6.803   9.770
  375   2HZ   LYS  48          2HZ       LYS  48  -2.130  -6.186   8.191
  376   3HZ   LYS  48          3HZ       LYS  48  -3.056  -7.567   8.538
  377    H    THR  49           H        THR  49   0.832  -4.784   4.421
  378    HA   THR  49           HA       THR  49   3.411  -3.808   3.395
  379    HB   THR  49           HB       THR  49   4.136  -6.017   3.881
  380    HG1  THR  49           HG1      THR  49   4.402  -5.257   1.663
  381   1HG2  THR  49          1HG2      THR  49   1.440  -6.858   2.808
  382   2HG2  THR  49          2HG2      THR  49   2.756  -8.000   3.080
  383   3HG2  THR  49          3HG2      THR  49   2.080  -7.097   4.433
  384    H    VAL  50           H        VAL  50   3.439  -4.057   0.921
  385    HA   VAL  50           HA       VAL  50   1.052  -2.902  -0.153
  386    HB   VAL  50           HB       VAL  50   2.152  -3.169  -2.344
  387   1HG1  VAL  50          1HG1      VAL  50   2.833  -1.361  -0.737
  388   2HG1  VAL  50          2HG1      VAL  50   4.146  -2.404  -0.194
  389   3HG1  VAL  50          3HG1      VAL  50   4.111  -1.825  -1.859
  390   1HG2  VAL  50          1HG2      VAL  50   4.001  -4.942  -0.731
  391   2HG2  VAL  50          2HG2      VAL  50   3.125  -5.345  -2.207
  392   3HG2  VAL  50          3HG2      VAL  50   4.490  -4.229  -2.268
  393    H    GLU  51           H        GLU  51   2.305  -6.224  -0.233
  394    HA   GLU  51           HA       GLU  51   0.422  -7.283  -2.081
  395   1HB   GLU  51          1HB       GLU  51   1.847  -8.557   0.270
  396   2HB   GLU  51          2HB       GLU  51   0.872  -9.471  -0.882
  397   1HG   GLU  51          1HG       GLU  51   2.297  -8.671  -2.731
  398   2HG   GLU  51          2HG       GLU  51   3.276  -7.759  -1.582
  399    H    GLY  52           H        GLY  52   0.239  -6.808   1.424
  400   1HA   GLY  52          1HA       GLY  52  -1.568  -7.008   2.907
  401   2HA   GLY  52          2HA       GLY  52  -2.318  -8.099   1.745
  402    H    VAL  53           H        VAL  53  -1.375  -4.822   0.842
  403    HA   VAL  53           HA       VAL  53  -3.814  -3.493   1.455
  404    HB   VAL  53           HB       VAL  53  -1.764  -2.997  -0.719
  405   1HG1  VAL  53          1HG1      VAL  53  -4.227  -1.424   0.068
  406   2HG1  VAL  53          2HG1      VAL  53  -2.852  -0.673  -0.742
  407   3HG1  VAL  53          3HG1      VAL  53  -3.751  -1.961  -1.543
  408   1HG2  VAL  53          1HG2      VAL  53  -1.165  -2.754   1.744
  409   2HG2  VAL  53          2HG2      VAL  53  -0.951  -1.297   0.775
  410   3HG2  VAL  53          3HG2      VAL  53  -2.360  -1.460   1.823
  411    H    LYS  54           H        LYS  54  -2.833  -5.072  -1.619
  412    HA   LYS  54           HA       LYS  54  -5.390  -4.594  -2.873
  413   1HB   LYS  54          1HB       LYS  54  -3.162  -6.553  -3.493
  414   2HB   LYS  54          2HB       LYS  54  -4.588  -6.343  -4.512
  415   1HG   LYS  54          1HG       LYS  54  -4.055  -3.948  -4.771
  416   2HG   LYS  54          2HG       LYS  54  -2.628  -4.155  -3.756
  417   1HD   LYS  54          1HD       LYS  54  -1.701  -5.765  -5.381
  418   2HD   LYS  54          2HD       LYS  54  -3.126  -5.555  -6.400
  419   1HE   LYS  54          1HE       LYS  54  -1.223  -4.149  -7.166
  420   2HE   LYS  54          2HE       LYS  54  -2.611  -3.176  -6.680
  421   1HZ   LYS  54          1HZ       LYS  54  -0.524  -3.840  -4.714
  422   2HZ   LYS  54          2HZ       LYS  54  -0.271  -2.570  -5.813
  423   3HZ   LYS  54          3HZ       LYS  54  -1.589  -2.520  -4.742
  424    H    ALA  55           H        ALA  55  -4.013  -7.346  -1.108
  425    HA   ALA  55           HA       ALA  55  -6.240  -9.114  -1.569
  426   1HB   ALA  55          1HB       ALA  55  -5.229 -10.514   0.135
  427   2HB   ALA  55          2HB       ALA  55  -4.255  -9.164   0.717
  428   3HB   ALA  55          3HB       ALA  55  -3.949  -9.848  -0.879
  429    H    LEU  56           H        LEU  56  -5.538  -6.735   0.950
  430    HA   LEU  56           HA       LEU  56  -7.504  -7.559   2.827
  431   1HB   LEU  56          1HB       LEU  56  -5.714  -5.820   3.231
  432   2HB   LEU  56          2HB       LEU  56  -6.653  -4.704   2.249
  433    HG   LEU  56           HG       LEU  56  -8.611  -5.158   3.833
  434   1HD1  LEU  56          1HD1      LEU  56  -6.372  -6.565   5.296
  435   2HD1  LEU  56          2HD1      LEU  56  -7.699  -5.828   6.189
  436   3HD1  LEU  56          3HD1      LEU  56  -8.027  -7.107   5.026
  437   1HD2  LEU  56          1HD2      LEU  56  -7.277  -3.082   3.891
  438   2HD2  LEU  56          2HD2      LEU  56  -7.746  -3.567   5.518
  439   3HD2  LEU  56          3HD2      LEU  56  -6.103  -3.860   4.950
  440    H    ILE  57           H        ILE  57  -7.691  -5.286   0.096
  441    HA   ILE  57           HA       ILE  57 -10.446  -4.582   0.407
  442    HB   ILE  57           HB       ILE  57  -8.858  -4.849  -2.164
  443   1HG1  ILE  57          1HG1      ILE  57  -7.681  -3.347  -0.654
  444   2HG1  ILE  57          2HG1      ILE  57  -8.489  -2.379  -1.882
  445   1HG2  ILE  57          1HG2      ILE  57 -11.413  -3.400  -1.453
  446   2HG2  ILE  57          2HG2      ILE  57 -10.487  -3.055  -2.914
  447   3HG2  ILE  57          3HG2      ILE  57 -11.184  -4.656  -2.668
  448   1HD1  ILE  57          1HD1      ILE  57 -10.445  -2.259  -0.136
  449   2HD1  ILE  57          2HD1      ILE  57  -9.197  -2.718   1.022
  450   3HD1  ILE  57          3HD1      ILE  57  -9.028  -1.235   0.087
  451    H    ASP  58           H        ASP  58  -8.821  -7.265  -1.258
  452    HA   ASP  58           HA       ASP  58 -11.125  -8.294  -2.587
  453   1HB   ASP  58          1HB       ASP  58  -8.665  -9.695  -1.510
  454   2HB   ASP  58          2HB       ASP  58  -9.888 -10.505  -2.488
  455    H    GLU  59           H        GLU  59  -9.904  -8.859   0.709
  456    HA   GLU  59           HA       GLU  59 -11.942 -10.807   1.356
  457   1HB   GLU  59          1HB       GLU  59 -10.152  -9.077   3.083
  458   2HB   GLU  59          2HB       GLU  59 -11.269 -10.274   3.739
  459   1HG   GLU  59          1HG       GLU  59  -9.154 -10.935   1.676
  460   2HG   GLU  59          2HG       GLU  59  -8.902 -11.111   3.413
  461    H    ILE  60           H        ILE  60 -11.606  -7.304   1.756
  462    HA   ILE  60           HA       ILE  60 -14.024  -6.973   3.255
  463    HB   ILE  60           HB       ILE  60 -12.501  -5.005   1.527
  464   1HG1  ILE  60          1HG1      ILE  60 -12.541  -5.331   4.541
  465   2HG1  ILE  60          2HG1      ILE  60 -11.321  -6.078   3.511
  466   1HG2  ILE  60          1HG2      ILE  60 -14.743  -4.646   3.535
  467   2HG2  ILE  60          2HG2      ILE  60 -13.708  -3.322   2.997
  468   3HG2  ILE  60          3HG2      ILE  60 -14.739  -4.165   1.840
  469   1HD1  ILE  60          1HD1      ILE  60 -11.908  -3.104   3.605
  470   2HD1  ILE  60          2HD1      ILE  60 -10.571  -3.891   4.445
  471   3HD1  ILE  60          3HD1      ILE  60 -10.626  -3.888   2.682
  472    H    LEU  61           H        LEU  61 -13.328  -6.592  -0.237
  473    HA   LEU  61           HA       LEU  61 -16.070  -5.944  -0.886
  474   1HB   LEU  61          1HB       LEU  61 -13.765  -6.950  -2.586
  475   2HB   LEU  61          2HB       LEU  61 -15.340  -6.525  -3.253
  476    HG   LEU  61           HG       LEU  61 -13.507  -4.657  -1.712
  477   1HD1  LEU  61          1HD1      LEU  61 -12.876  -5.386  -4.107
  478   2HD1  LEU  61          2HD1      LEU  61 -14.298  -4.479  -4.624
  479   3HD1  LEU  61          3HD1      LEU  61 -12.978  -3.653  -3.797
  480   1HD2  LEU  61          1HD2      LEU  61 -16.316  -4.393  -2.758
  481   2HD2  LEU  61          2HD2      LEU  61 -15.600  -3.725  -1.292
  482   3HD2  LEU  61          3HD2      LEU  61 -15.261  -2.984  -2.852
  483    H    ALA  62           H        ALA  62 -14.229  -8.948  -0.709
  484    HA   ALA  62           HA       ALA  62 -16.106 -10.660  -1.985
  485   1HB   ALA  62          1HB       ALA  62 -14.086 -11.153   0.210
  486   2HB   ALA  62          2HB       ALA  62 -13.942 -11.542  -1.505
  487   3HB   ALA  62          3HB       ALA  62 -15.063 -12.447  -0.486
  488    H    ALA  63           H        ALA  63 -15.952  -9.511   1.382
  489    HA   ALA  63           HA       ALA  63 -18.031 -11.214   2.372
  490   1HB   ALA  63          1HB       ALA  63 -18.254  -9.217   4.079
  491   2HB   ALA  63          2HB       ALA  63 -16.783 -10.189   4.069
  492   3HB   ALA  63          3HB       ALA  63 -16.803  -8.617   3.272
  493    H    LEU  64           H        LEU  64 -18.014  -8.029   0.847
  494    HA   LEU  64           HA       LEU  64 -20.969  -8.275   0.421
  495   1HB   LEU  64          1HB       LEU  64 -21.034  -5.758   0.715
  496   2HB   LEU  64          2HB       LEU  64 -20.785  -6.693   2.186
  497    HG   LEU  64           HG       LEU  64 -18.292  -5.883   0.744
  498   1HD1  LEU  64          1HD1      LEU  64 -19.993  -3.866   2.242
  499   2HD1  LEU  64          2HD1      LEU  64 -18.335  -3.605   1.700
  500   3HD1  LEU  64          3HD1      LEU  64 -19.625  -3.829   0.517
  501   1HD2  LEU  64          1HD2      LEU  64 -18.547  -7.097   3.019
  502   2HD2  LEU  64          2HD2      LEU  64 -17.409  -5.754   2.940
  503   3HD2  LEU  64          3HD2      LEU  64 -19.000  -5.521   3.663
  504    HA   PRO  65           HA       PRO  65 -18.637  -7.310  -3.486
  505   1HB   PRO  65          1HB       PRO  65 -20.165  -9.225  -4.946
  506   2HB   PRO  65          2HB       PRO  65 -18.504  -9.407  -4.372
  507   1HG   PRO  65          1HG       PRO  65 -20.876 -10.755  -3.409
  508   2HG   PRO  65          2HG       PRO  65 -19.204 -10.986  -2.890
  509   1HD   PRO  65          1HD       PRO  65 -21.354  -9.595  -1.483
  510   2HD   PRO  65          2HD       PRO  65 -19.708  -9.954  -0.904

  No H/Q in entry =         510
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  19.417 -10.120  -4.832
    2    H2   MET   1           H2       MET   1  20.097 -10.963  -6.140
    3    H3   MET   1           H3       MET   1  20.107 -11.649  -4.585
    4    HA   MET   1           HA       MET   1  22.270 -10.879  -4.845
    5   1HB   MET   1          1HB       MET   1  22.758  -8.625  -5.732
    6   2HB   MET   1          2HB       MET   1  21.831  -9.570  -6.898
    7   1HG   MET   1          1HG       MET   1  19.740  -8.484  -6.003
    8   2HG   MET   1          2HG       MET   1  20.768  -7.434  -5.028
    9   1HE   MET   1          1HE       MET   1  18.555  -6.713  -7.250
   10   2HE   MET   1          2HE       MET   1  19.356  -5.484  -6.275
   11   3HE   MET   1          3HE       MET   1  19.288  -5.316  -8.035
   12    H    LYS   2           H        LYS   2  19.528  -9.897  -3.245
   13    HA   LYS   2           HA       LYS   2  20.957  -8.065  -1.376
   14   1HB   LYS   2          1HB       LYS   2  18.678  -7.447  -2.206
   15   2HB   LYS   2          2HB       LYS   2  18.037  -8.889  -1.419
   16   1HG   LYS   2          1HG       LYS   2  18.841  -8.067   0.762
   17   2HG   LYS   2          2HG       LYS   2  19.491  -6.624  -0.017
   18   1HD   LYS   2          1HD       LYS   2  17.220  -6.006  -0.770
   19   2HD   LYS   2          2HD       LYS   2  16.568  -7.447   0.014
   20   1HE   LYS   2          1HE       LYS   2  17.347  -6.630   2.198
   21   2HE   LYS   2          2HE       LYS   2  18.048  -5.207   1.429
   22   1HZ   LYS   2          1HZ       LYS   2  15.257  -5.701   0.825
   23   2HZ   LYS   2          2HZ       LYS   2  15.581  -5.290   2.439
   24   3HZ   LYS   2          3HZ       LYS   2  16.053  -4.244   1.187
   25    H    ALA   3           H        ALA   3  21.910  -8.960   0.358
   26    HA   ALA   3           HA       ALA   3  21.264 -11.714   1.165
   27   1HB   ALA   3          1HB       ALA   3  23.615 -10.670   1.089
   28   2HB   ALA   3          2HB       ALA   3  23.200 -11.586   2.538
   29   3HB   ALA   3          3HB       ALA   3  23.160  -9.823   2.568
   30    H    ILE   4           H        ILE   4  20.425 -12.286   3.222
   31    HA   ILE   4           HA       ILE   4  18.466 -10.487   4.316
   32    HB   ILE   4           HB       ILE   4  19.667 -13.006   5.511
   33   1HG1  ILE   4          1HG1      ILE   4  17.070 -12.666   3.977
   34   2HG1  ILE   4          2HG1      ILE   4  18.570 -13.225   3.233
   35   1HG2  ILE   4          1HG2      ILE   4  17.300 -11.278   6.237
   36   2HG2  ILE   4          2HG2      ILE   4  17.325 -12.992   6.652
   37   3HG2  ILE   4          3HG2      ILE   4  18.567 -11.914   7.284
   38   1HD1  ILE   4          1HD1      ILE   4  17.220 -14.549   5.606
   39   2HD1  ILE   4          2HD1      ILE   4  17.105 -15.116   3.939
   40   3HD1  ILE   4          3HD1      ILE   4  18.662 -15.127   4.770
   41    H    PHE   5           H        PHE   5  21.723 -11.469   5.359
   42    HA   PHE   5           HA       PHE   5  21.671 -10.016   7.844
   43   1HB   PHE   5          1HB       PHE   5  23.306 -11.804   7.392
   44   2HB   PHE   5          2HB       PHE   5  24.020 -10.836   6.104
   45    HD1  PHE   5           HD1      PHE   5  25.318  -8.818   6.611
   46    HD2  PHE   5           HD2      PHE   5  23.653 -11.246   9.739
   47    HE1  PHE   5           HE1      PHE   5  26.781  -7.689   8.265
   48    HE2  PHE   5           HE2      PHE   5  25.113 -10.113  11.394
   49    HZ   PHE   5           HZ       PHE   5  26.676  -8.336  10.657
   50    H    VAL   6           H        VAL   6  21.328  -7.846   7.860
   51    HA   VAL   6           HA       VAL   6  23.025  -6.138   6.092
   52    HB   VAL   6           HB       VAL   6  20.043  -5.784   6.535
   53   1HG1  VAL   6          1HG1      VAL   6  22.135  -4.144   5.086
   54   2HG1  VAL   6          2HG1      VAL   6  20.404  -3.952   4.809
   55   3HG1  VAL   6          3HG1      VAL   6  21.082  -3.625   6.403
   56   1HG2  VAL   6          1HG2      VAL   6  21.687  -6.607   4.122
   57   2HG2  VAL   6          2HG2      VAL   6  20.437  -7.553   4.931
   58   3HG2  VAL   6          3HG2      VAL   6  20.000  -6.104   4.025
   59    H    LEU   7           H        LEU   7  24.025  -4.597   7.290
   60    HA   LEU   7           HA       LEU   7  23.465  -4.325  10.118
   61   1HB   LEU   7          1HB       LEU   7  25.021  -2.146   9.600
   62   2HB   LEU   7          2HB       LEU   7  25.685  -3.763   9.800
   63    HG   LEU   7           HG       LEU   7  24.759  -2.926   7.057
   64   1HD1  LEU   7          1HD1      LEU   7  27.309  -2.033   8.418
   65   2HD1  LEU   7          2HD1      LEU   7  27.134  -2.095   6.664
   66   3HD1  LEU   7          3HD1      LEU   7  26.099  -1.031   7.615
   67   1HD2  LEU   7          1HD2      LEU   7  25.671  -5.266   7.823
   68   2HD2  LEU   7          2HD2      LEU   7  26.277  -4.571   6.322
   69   3HD2  LEU   7          3HD2      LEU   7  27.246  -4.477   7.791
   70    H    ASN   8           H        ASN   8  22.093  -2.870  11.103
   71    HA   ASN   8           HA       ASN   8  20.137  -1.476   9.574
   72   1HB   ASN   8          1HB       ASN   8  19.531  -0.372  11.693
   73   2HB   ASN   8          2HB       ASN   8  19.811  -2.094  11.948
   74   2HD2  ASN   8          2HD2      ASN   8  21.267  -2.613  13.592
   75   1HD2  ASN   8          1HD2      ASN   8  22.391  -1.535  14.267
   76    H    ALA   9           H        ALA   9  20.066   0.642   8.815
   77    HA   ALA   9           HA       ALA   9  22.068   2.607   9.631
   78   1HB   ALA   9          1HB       ALA   9  23.393   1.274   8.046
   79   2HB   ALA   9          2HB       ALA   9  22.135   1.460   6.823
   80   3HB   ALA   9          3HB       ALA   9  23.051   2.865   7.367
   81    H    GLN  10           H        GLN  10  21.658   4.710   8.596
   82    HA   GLN  10           HA       GLN  10  18.811   5.116   8.112
   83   1HB   GLN  10          1HB       GLN  10  19.479   7.510   7.818
   84   2HB   GLN  10          2HB       GLN  10  20.067   6.821   9.331
   85   1HG   GLN  10          1HG       GLN  10  22.257   6.347   8.178
   86   2HG   GLN  10          2HG       GLN  10  21.653   7.238   6.782
   87   2HE2  GLN  10          2HE2      GLN  10  23.952   8.069   8.399
   88   1HE2  GLN  10          1HE2      GLN  10  23.548   9.554   9.112
   89    H    HIS  11           H        HIS  11  21.565   4.444   6.193
   90    HA   HIS  11           HA       HIS  11  20.698   5.719   3.747
   91   1HB   HIS  11          1HB       HIS  11  22.580   3.380   4.187
   92   2HB   HIS  11          2HB       HIS  11  22.417   4.294   2.686
   93    HD1  HIS  11           HD1      HIS  11  23.683   4.598   6.218
   94    HD2  HIS  11           HD2      HIS  11  23.643   6.860   2.715
   95    HE1  HIS  11           HE1      HIS  11  25.249   6.549   6.608
   96    H    ASP  12           H        ASP  12  20.312   2.435   5.091
   97    HA   ASP  12           HA       ASP  12  18.514   1.749   2.786
   98   1HB   ASP  12          1HB       ASP  12  20.083   0.018   4.709
   99   2HB   ASP  12          2HB       ASP  12  18.888  -0.621   3.580
  100    H    GLU  13           H        GLU  13  16.390   1.767   3.211
  101    HA   GLU  13           HA       GLU  13  15.258   0.537   5.565
  102   1HB   GLU  13          1HB       GLU  13  14.147   2.659   6.402
  103   2HB   GLU  13          2HB       GLU  13  15.882   2.561   6.704
  104   1HG   GLU  13          1HG       GLU  13  16.312   3.921   4.689
  105   2HG   GLU  13          2HG       GLU  13  14.577   4.022   4.392
  106    H    ALA  14           H        ALA  14  12.834   0.673   5.494
  107    HA   ALA  14           HA       ALA  14  11.925   0.586   2.710
  108   1HB   ALA  14          1HB       ALA  14   9.768  -0.120   3.697
  109   2HB   ALA  14          2HB       ALA  14  11.105  -1.065   4.352
  110   3HB   ALA  14          3HB       ALA  14  10.394   0.236   5.308
  111    H    VAL  15           H        VAL  15  12.707   3.126   3.024
  112    HA   VAL  15           HA       VAL  15  10.521   4.827   3.984
  113    HB   VAL  15           HB       VAL  15  12.854   5.574   4.191
  114   1HG1  VAL  15          1HG1      VAL  15  13.602   4.396   2.078
  115   2HG1  VAL  15          2HG1      VAL  15  12.875   5.719   1.166
  116   3HG1  VAL  15          3HG1      VAL  15  14.219   6.037   2.263
  117   1HG2  VAL  15          1HG2      VAL  15  10.870   7.175   3.729
  118   2HG2  VAL  15          2HG2      VAL  15  12.499   7.810   3.509
  119   3HG2  VAL  15          3HG2      VAL  15  11.544   7.326   2.107
  120    H    ASP  16           H        ASP  16  11.111   3.076   1.169
  121    HA   ASP  16           HA       ASP  16  10.356   4.702  -0.964
  122   1HB   ASP  16          1HB       ASP  16  10.920   2.261  -1.109
  123   2HB   ASP  16          2HB       ASP  16   9.316   1.897  -0.470
  124    H    ALA  17           H        ALA  17   8.699   6.137  -0.990
  125    HA   ALA  17           HA       ALA  17   6.107   5.390   0.326
  126   1HB   ALA  17          1HB       ALA  17   7.055   7.398   1.273
  127   2HB   ALA  17          2HB       ALA  17   7.334   8.080  -0.330
  128   3HB   ALA  17          3HB       ALA  17   5.686   7.870   0.265
  129    H    ASN  18           H        ASN  18   7.256   4.931  -2.570
  130    HA   ASN  18           HA       ASN  18   5.123   6.332  -4.114
  131   1HB   ASN  18          1HB       ASN  18   7.543   4.711  -4.945
  132   2HB   ASN  18          2HB       ASN  18   6.341   5.321  -6.086
  133   2HD2  ASN  18          2HD2      ASN  18   5.787   7.844  -4.948
  134   1HD2  ASN  18          1HD2      ASN  18   7.185   8.806  -5.016
  135    H    SER  19           H        SER  19   6.298   3.059  -3.366
  136    HA   SER  19           HA       SER  19   4.138   1.783  -4.850
  137   1HB   SER  19          1HB       SER  19   6.056   0.670  -2.788
  138   2HB   SER  19          2HB       SER  19   4.998  -0.291  -3.815
  139    HG   SER  19           HG       SER  19   6.223   0.157  -5.516
  140    H    LEU  20           H        LEU  20   4.915   2.054  -1.358
  141    HA   LEU  20           HA       LEU  20   2.499   0.883  -0.421
  142   1HB   LEU  20          1HB       LEU  20   4.342   2.941   0.826
  143   2HB   LEU  20          2HB       LEU  20   2.995   2.211   1.697
  144    HG   LEU  20           HG       LEU  20   5.009   0.424   0.331
  145   1HD1  LEU  20          1HD1      LEU  20   5.350   1.827   2.997
  146   2HD1  LEU  20          2HD1      LEU  20   6.252   0.382   2.538
  147   3HD1  LEU  20          3HD1      LEU  20   6.445   1.872   1.616
  148   1HD2  LEU  20          1HD2      LEU  20   2.939  -0.534   1.338
  149   2HD2  LEU  20          2HD2      LEU  20   4.385  -1.089   2.177
  150   3HD2  LEU  20          3HD2      LEU  20   3.383   0.174   2.889
  151    H    ALA  21           H        ALA  21   3.317   4.323  -0.910
  152    HA   ALA  21           HA       ALA  21   0.791   5.333  -0.125
  153   1HB   ALA  21          1HB       ALA  21   2.542   6.579  -2.244
  154   2HB   ALA  21          2HB       ALA  21   2.948   6.636  -0.528
  155   3HB   ALA  21          3HB       ALA  21   1.466   7.393  -1.108
  156    H    GLU  22           H        GLU  22   2.001   4.581  -3.421
  157    HA   GLU  22           HA       GLU  22  -0.419   5.294  -4.741
  158   1HB   GLU  22          1HB       GLU  22   1.733   4.855  -5.914
  159   2HB   GLU  22          2HB       GLU  22   1.556   3.138  -5.549
  160   1HG   GLU  22          1HG       GLU  22  -0.559   3.081  -6.808
  161   2HG   GLU  22          2HG       GLU  22  -0.394   4.798  -7.172
  162    H    ALA  23           H        ALA  23   0.644   2.107  -3.495
  163    HA   ALA  23           HA       ALA  23  -1.710   0.701  -4.279
  164   1HB   ALA  23          1HB       ALA  23  -1.113  -0.865  -2.404
  165   2HB   ALA  23          2HB       ALA  23   0.241  -0.520  -3.480
  166   3HB   ALA  23          3HB       ALA  23   0.137   0.276  -1.909
  167    H    LYS  24           H        LYS  24  -0.887   2.392  -1.250
  168    HA   LYS  24           HA       LYS  24  -3.455   1.927  -0.022
  169   1HB   LYS  24          1HB       LYS  24  -1.259   3.944   0.499
  170   2HB   LYS  24          2HB       LYS  24  -2.693   3.781   1.514
  171   1HG   LYS  24          1HG       LYS  24  -2.144   1.417   1.934
  172   2HG   LYS  24          2HG       LYS  24  -0.711   1.568   0.918
  173   1HD   LYS  24          1HD       LYS  24   0.194   3.292   2.419
  174   2HD   LYS  24          2HD       LYS  24  -1.238   3.166   3.436
  175   1HE   LYS  24          1HE       LYS  24  -0.714   0.894   4.024
  176   2HE   LYS  24          2HE       LYS  24   0.583   0.828   2.831
  177   1HZ   LYS  24          1HZ       LYS  24   1.267   2.971   4.298
  178   2HZ   LYS  24          2HZ       LYS  24   0.566   1.973   5.480
  179   3HZ   LYS  24          3HZ       LYS  24   1.866   1.402   4.553
  180    H    VAL  25           H        VAL  25  -2.102   4.640  -1.915
  181    HA   VAL  25           HA       VAL  25  -4.364   6.360  -1.533
  182    HB   VAL  25           HB       VAL  25  -2.267   6.269  -3.708
  183   1HG1  VAL  25          1HG1      VAL  25  -4.592   8.147  -3.262
  184   2HG1  VAL  25          2HG1      VAL  25  -3.134   8.680  -4.100
  185   3HG1  VAL  25          3HG1      VAL  25  -4.093   7.354  -4.756
  186   1HG2  VAL  25          1HG2      VAL  25  -1.811   6.917  -1.180
  187   2HG2  VAL  25          2HG2      VAL  25  -1.144   7.913  -2.473
  188   3HG2  VAL  25          3HG2      VAL  25  -2.603   8.424  -1.626
  189    H    LEU  26           H        LEU  26  -3.505   4.155  -4.219
  190    HA   LEU  26           HA       LEU  26  -5.922   4.650  -5.691
  191   1HB   LEU  26          1HB       LEU  26  -4.075   2.242  -5.681
  192   2HB   LEU  26          2HB       LEU  26  -5.361   2.502  -6.856
  193    HG   LEU  26           HG       LEU  26  -2.988   4.336  -6.393
  194   1HD1  LEU  26          1HD1      LEU  26  -2.552   2.099  -7.495
  195   2HD1  LEU  26          2HD1      LEU  26  -3.646   2.595  -8.784
  196   3HD1  LEU  26          3HD1      LEU  26  -2.159   3.498  -8.496
  197   1HD2  LEU  26          1HD2      LEU  26  -5.471   4.543  -8.086
  198   2HD2  LEU  26          2HD2      LEU  26  -4.603   5.806  -7.213
  199   3HD2  LEU  26          3HD2      LEU  26  -3.959   5.187  -8.731
  200    H    ALA  27           H        ALA  27  -5.061   2.208  -3.245
  201    HA   ALA  27           HA       ALA  27  -7.570   0.783  -3.456
  202   1HB   ALA  27          1HB       ALA  27  -5.528  -0.221  -2.470
  203   2HB   ALA  27          2HB       ALA  27  -5.622   0.927  -1.134
  204   3HB   ALA  27          3HB       ALA  27  -6.886  -0.283  -1.349
  205    H    ASN  28           H        ASN  28  -6.378   3.362  -1.324
  206    HA   ASN  28           HA       ASN  28  -8.630   3.508   0.404
  207   1HB   ASN  28          1HB       ASN  28  -6.506   4.667   0.848
  208   2HB   ASN  28          2HB       ASN  28  -6.791   5.730  -0.528
  209   2HD2  ASN  28          2HD2      ASN  28  -6.520   6.744   2.156
  210   1HD2  ASN  28          1HD2      ASN  28  -8.013   7.404   2.619
  211    H    ARG  29           H        ARG  29  -8.012   5.071  -2.727
  212    HA   ARG  29           HA       ARG  29 -10.414   6.665  -2.685
  213   1HB   ARG  29          1HB       ARG  29  -8.610   5.749  -4.938
  214   2HB   ARG  29          2HB       ARG  29  -9.977   6.838  -5.175
  215   1HG   ARG  29          1HG       ARG  29  -9.014   8.408  -3.544
  216   2HG   ARG  29          2HG       ARG  29  -7.640   7.334  -3.307
  217   1HD   ARG  29          1HD       ARG  29  -7.184   7.516  -5.779
  218   2HD   ARG  29          2HD       ARG  29  -8.420   8.764  -5.869
  219    HE   ARG  29           HE       ARG  29  -5.694   9.098  -5.009
  220   1HH1  ARG  29          1HH1      ARG  29  -5.009  10.813  -3.743
  221   2HH1  ARG  29          2HH1      ARG  29  -6.180  11.806  -2.942
  222   1HH2  ARG  29          1HH2      ARG  29  -8.903  10.054  -4.163
  223   2HH2  ARG  29          2HH2      ARG  29  -8.376  11.373  -3.174
  224    H    GLU  30           H        GLU  30  -9.680   3.388  -3.752
  225    HA   GLU  30           HA       GLU  30 -12.008   2.928  -5.316
  226   1HB   GLU  30          1HB       GLU  30 -10.093   1.368  -5.238
  227   2HB   GLU  30          2HB       GLU  30 -10.486   0.973  -3.565
  228   1HG   GLU  30          1HG       GLU  30 -12.682   0.106  -4.275
  229   2HG   GLU  30          2HG       GLU  30 -12.306   0.516  -5.949
  230    H    LEU  31           H        LEU  31 -11.483   2.656  -1.809
  231    HA   LEU  31           HA       LEU  31 -14.060   1.543  -1.192
  232   1HB   LEU  31          1HB       LEU  31 -12.515   3.424   0.611
  233   2HB   LEU  31          2HB       LEU  31 -13.576   2.093   1.077
  234    HG   LEU  31           HG       LEU  31 -10.875   1.901  -0.262
  235   1HD1  LEU  31          1HD1      LEU  31 -11.951   0.956   2.415
  236   2HD1  LEU  31          2HD1      LEU  31 -10.336   0.608   1.802
  237   3HD1  LEU  31          3HD1      LEU  31 -10.803   2.271   2.158
  238   1HD2  LEU  31          1HD2      LEU  31 -13.033  -0.169   0.219
  239   2HD2  LEU  31          2HD2      LEU  31 -12.154   0.167  -1.272
  240   3HD2  LEU  31          3HD2      LEU  31 -11.337  -0.628   0.072
  241    H    ASP  32           H        ASP  32 -12.838   4.836  -1.465
  242    HA   ASP  32           HA       ASP  32 -15.134   6.224  -0.550
  243   1HB   ASP  32          1HB       ASP  32 -12.927   7.264  -0.939
  244   2HB   ASP  32          2HB       ASP  32 -13.126   7.025  -2.674
  245    H    LYS  33           H        LYS  33 -14.282   4.994  -3.778
  246    HA   LYS  33           HA       LYS  33 -16.460   6.144  -5.207
  247   1HB   LYS  33          1HB       LYS  33 -14.545   5.030  -6.309
  248   2HB   LYS  33          2HB       LYS  33 -15.084   3.480  -5.665
  249   1HG   LYS  33          1HG       LYS  33 -17.119   3.563  -6.948
  250   2HG   LYS  33          2HG       LYS  33 -16.811   5.231  -7.430
  251   1HD   LYS  33          1HD       LYS  33 -16.216   3.765  -9.280
  252   2HD   LYS  33          2HD       LYS  33 -14.742   4.461  -8.609
  253   1HE   LYS  33          1HE       LYS  33 -14.145   2.447  -7.524
  254   2HE   LYS  33          2HE       LYS  33 -15.774   1.785  -7.664
  255   1HZ   LYS  33          1HZ       LYS  33 -15.343   2.004 -10.176
  256   2HZ   LYS  33          2HZ       LYS  33 -13.703   2.072  -9.738
  257   3HZ   LYS  33          3HZ       LYS  33 -14.631   0.711  -9.335
  258    H    TYR  34           H        TYR  34 -16.175   2.942  -3.641
  259    HA   TYR  34           HA       TYR  34 -18.921   2.217  -4.162
  260   1HB   TYR  34          1HB       TYR  34 -16.867   1.156  -2.209
  261   2HB   TYR  34          2HB       TYR  34 -18.473   0.451  -2.402
  262    HD1  TYR  34           HD1      TYR  34 -15.123   0.348  -3.561
  263    HD2  TYR  34           HD2      TYR  34 -19.186  -0.047  -4.899
  264    HE1  TYR  34           HE1      TYR  34 -14.349  -0.918  -5.550
  265    HE2  TYR  34           HE2      TYR  34 -18.410  -1.312  -6.885
  266    HH   TYR  34           HH       TYR  34 -15.030  -1.566  -7.693
  267    H    GLY  35           H        GLY  35 -17.272   3.819  -1.472
  268   1HA   GLY  35          1HA       GLY  35 -19.914   4.677  -0.435
  269   2HA   GLY  35          2HA       GLY  35 -18.348   5.324   0.056
  270    H    VAL  36           H        VAL  36 -17.198   2.630   0.450
  271    HA   VAL  36           HA       VAL  36 -18.781   1.199   2.393
  272    HB   VAL  36           HB       VAL  36 -15.766   1.083   2.365
  273   1HG1  VAL  36          1HG1      VAL  36 -17.980  -0.988   2.545
  274   2HG1  VAL  36          2HG1      VAL  36 -16.260  -1.365   2.536
  275   3HG1  VAL  36          3HG1      VAL  36 -16.949  -0.438   3.864
  276   1HG2  VAL  36          1HG2      VAL  36 -17.637   0.223   0.151
  277   2HG2  VAL  36          2HG2      VAL  36 -16.169   1.191   0.024
  278   3HG2  VAL  36          3HG2      VAL  36 -16.059  -0.532   0.382
  279    H    SER  37           H        SER  37 -17.639   0.908   4.730
  280    HA   SER  37           HA       SER  37 -18.007   3.362   6.111
  281   1HB   SER  37          1HB       SER  37 -18.185   1.170   7.226
  282   2HB   SER  37          2HB       SER  37 -16.458   0.912   7.003
  283    HG   SER  37           HG       SER  37 -17.596   2.079   9.013
  284    H    ASP  38           H        ASP  38 -16.594   4.942   6.778
  285    HA   ASP  38           HA       ASP  38 -14.171   5.353   5.308
  286   1HB   ASP  38          1HB       ASP  38 -15.634   7.130   6.381
  287   2HB   ASP  38          2HB       ASP  38 -14.933   6.666   7.930
  288    H    TYR  39           H        TYR  39 -14.846   3.607   8.211
  289    HA   TYR  39           HA       TYR  39 -12.337   3.772   9.532
  290   1HB   TYR  39          1HB       TYR  39 -14.220   2.735  10.637
  291   2HB   TYR  39          2HB       TYR  39 -14.349   1.511   9.372
  292    HD1  TYR  39           HD1      TYR  39 -12.749  -0.297   9.192
  293    HD2  TYR  39           HD2      TYR  39 -12.411   2.644  12.300
  294    HE1  TYR  39           HE1      TYR  39 -11.122  -1.734  10.366
  295    HE2  TYR  39           HE2      TYR  39 -10.778   1.201  13.486
  296    HH   TYR  39           HH       TYR  39 -10.176  -2.080  12.508
  297    H    TYR  40           H        TYR  40 -13.410   1.636   6.901
  298    HA   TYR  40           HA       TYR  40 -11.158  -0.078   6.840
  299   1HB   TYR  40          1HB       TYR  40 -12.989   0.856   4.619
  300   2HB   TYR  40          2HB       TYR  40 -11.773  -0.404   4.411
  301    HD1  TYR  40           HD1      TYR  40 -11.800  -2.278   6.322
  302    HD2  TYR  40           HD2      TYR  40 -15.147   0.182   5.224
  303    HE1  TYR  40           HE1      TYR  40 -13.352  -3.955   7.286
  304    HE2  TYR  40           HE2      TYR  40 -16.697  -1.495   6.191
  305    HH   TYR  40           HH       TYR  40 -16.661  -3.297   7.835
  306    H    LYS  41           H        LYS  41 -11.576   3.147   5.328
  307    HA   LYS  41           HA       LYS  41  -9.177   2.949   3.774
  308   1HB   LYS  41          1HB       LYS  41  -9.624   5.107   3.092
  309   2HB   LYS  41          2HB       LYS  41 -11.196   4.732   3.783
  310   1HG   LYS  41          1HG       LYS  41 -10.608   5.897   5.853
  311   2HG   LYS  41          2HG       LYS  41  -8.964   6.161   5.284
  312   1HD   LYS  41          1HD       LYS  41 -10.394   8.172   4.994
  313   2HD   LYS  41          2HD       LYS  41  -9.746   7.567   3.472
  314   1HE   LYS  41          1HE       LYS  41 -11.819   6.735   2.769
  315   2HE   LYS  41          2HE       LYS  41 -12.453   6.646   4.411
  316   1HZ   LYS  41          1HZ       LYS  41 -11.840   9.158   2.953
  317   2HZ   LYS  41          2HZ       LYS  41 -13.390   8.499   3.146
  318   3HZ   LYS  41          3HZ       LYS  41 -12.523   9.038   4.504
  319    H    ASN  42           H        ASN  42  -9.837   4.056   7.068
  320    HA   ASN  42           HA       ASN  42  -7.227   5.040   7.619
  321   1HB   ASN  42          1HB       ASN  42  -9.306   3.771   9.424
  322   2HB   ASN  42          2HB       ASN  42  -7.815   4.495  10.028
  323   2HD2  ASN  42          2HD2      ASN  42  -8.461   6.328   7.380
  324   1HD2  ASN  42          1HD2      ASN  42  -9.420   7.541   8.079
  325    H    LEU  43           H        LEU  43  -8.641   1.809   7.798
  326    HA   LEU  43           HA       LEU  43  -6.390   0.475   8.938
  327   1HB   LEU  43          1HB       LEU  43  -8.634  -0.550   8.765
  328   2HB   LEU  43          2HB       LEU  43  -8.491  -0.573   7.010
  329    HG   LEU  43           HG       LEU  43  -6.538  -2.072   7.187
  330   1HD1  LEU  43          1HD1      LEU  43  -6.989  -1.615  10.129
  331   2HD1  LEU  43          2HD1      LEU  43  -6.300  -3.144   9.586
  332   3HD1  LEU  43          3HD1      LEU  43  -5.475  -1.632   9.223
  333   1HD2  LEU  43          1HD2      LEU  43  -9.000  -2.875   7.179
  334   2HD2  LEU  43          2HD2      LEU  43  -7.771  -4.040   7.673
  335   3HD2  LEU  43          3HD2      LEU  43  -8.753  -3.224   8.891
  336    H    ILE  44           H        ILE  44  -7.277   1.252   5.597
  337    HA   ILE  44           HA       ILE  44  -5.145  -0.144   4.304
  338    HB   ILE  44           HB       ILE  44  -6.602   2.391   3.497
  339   1HG1  ILE  44          1HG1      ILE  44  -7.874   0.137   3.808
  340   2HG1  ILE  44          2HG1      ILE  44  -8.114   1.039   2.319
  341   1HG2  ILE  44          1HG2      ILE  44  -4.682   0.612   1.989
  342   2HG2  ILE  44          2HG2      ILE  44  -5.817   1.684   1.170
  343   3HG2  ILE  44          3HG2      ILE  44  -4.584   2.355   2.238
  344   1HD1  ILE  44          1HD1      ILE  44  -5.921  -1.004   2.349
  345   2HD1  ILE  44          2HD1      ILE  44  -7.585  -1.577   2.289
  346   3HD1  ILE  44          3HD1      ILE  44  -6.978  -0.504   1.032
  347    H    ASN  45           H        ASN  45  -5.369   3.110   5.675
  348    HA   ASN  45           HA       ASN  45  -2.891   4.116   4.743
  349   1HB   ASN  45          1HB       ASN  45  -4.461   4.704   7.261
  350   2HB   ASN  45          2HB       ASN  45  -3.022   5.610   6.787
  351   2HD2  ASN  45          2HD2      ASN  45  -5.699   6.766   6.951
  352   1HD2  ASN  45          1HD2      ASN  45  -6.131   7.253   5.383
  353    H    ASN  46           H        ASN  46  -3.640   2.185   7.643
  354    HA   ASN  46           HA       ASN  46  -0.722   2.087   8.285
  355   1HB   ASN  46          1HB       ASN  46  -1.374   1.268  10.458
  356   2HB   ASN  46          2HB       ASN  46  -2.361   2.680  10.089
  357   2HD2  ASN  46          2HD2      ASN  46  -3.694   1.398  11.881
  358   1HD2  ASN  46          1HD2      ASN  46  -4.854   0.314  11.281
  359    H    ALA  47           H        ALA  47  -2.118   0.549   6.055
  360    HA   ALA  47           HA       ALA  47  -2.438  -2.170   6.700
  361   1HB   ALA  47          1HB       ALA  47  -2.638  -0.900   4.397
  362   2HB   ALA  47          2HB       ALA  47  -0.964  -1.412   4.184
  363   3HB   ALA  47          3HB       ALA  47  -2.232  -2.616   4.415
  364    H    LYS  48           H        LYS  48  -1.021  -3.826   7.149
  365    HA   LYS  48           HA       LYS  48   1.530  -3.226   8.231
  366   1HB   LYS  48          1HB       LYS  48   0.225  -5.252   8.798
  367   2HB   LYS  48          2HB       LYS  48   0.519  -5.878   7.176
  368   1HG   LYS  48          1HG       LYS  48   2.889  -6.000   7.565
  369   2HG   LYS  48          2HG       LYS  48   2.739  -5.118   9.083
  370   1HD   LYS  48          1HD       LYS  48   2.967  -7.460   9.628
  371   2HD   LYS  48          2HD       LYS  48   1.299  -6.993   9.950
  372   1HE   LYS  48          1HE       LYS  48   2.062  -8.150   7.272
  373   2HE   LYS  48          2HE       LYS  48   1.740  -9.205   8.646
  374   1HZ   LYS  48          1HZ       LYS  48  -0.295  -7.350   8.634
  375   2HZ   LYS  48          2HZ       LYS  48  -0.096  -7.795   7.009
  376   3HZ   LYS  48          3HZ       LYS  48  -0.398  -8.985   8.183
  377    H    THR  49           H        THR  49   0.642  -4.443   5.006
  378    HA   THR  49           HA       THR  49   3.152  -3.396   3.929
  379    HB   THR  49           HB       THR  49   2.732  -6.340   3.441
  380    HG1  THR  49           HG1      THR  49   2.786  -6.388   5.602
  381   1HG2  THR  49          1HG2      THR  49   5.179  -4.557   3.642
  382   2HG2  THR  49          2HG2      THR  49   5.199  -6.274   3.238
  383   3HG2  THR  49          3HG2      THR  49   4.430  -5.119   2.147
  384    H    VAL  50           H        VAL  50   3.237  -3.894   1.494
  385    HA   VAL  50           HA       VAL  50   0.801  -3.090   0.260
  386    HB   VAL  50           HB       VAL  50   3.244  -4.451  -0.882
  387   1HG1  VAL  50          1HG1      VAL  50   0.824  -3.244  -2.226
  388   2HG1  VAL  50          2HG1      VAL  50   2.367  -3.422  -3.060
  389   3HG1  VAL  50          3HG1      VAL  50   1.516  -4.848  -2.469
  390   1HG2  VAL  50          1HG2      VAL  50   2.339  -1.568  -0.695
  391   2HG2  VAL  50          2HG2      VAL  50   3.770  -2.289   0.042
  392   3HG2  VAL  50          3HG2      VAL  50   3.682  -2.097  -1.708
  393    H    GLU  51           H        GLU  51   2.270  -6.310   0.665
  394    HA   GLU  51           HA       GLU  51   0.419  -7.745  -0.952
  395   1HB   GLU  51          1HB       GLU  51   1.956  -8.576   1.527
  396   2HB   GLU  51          2HB       GLU  51   1.018  -9.701   0.544
  397   1HG   GLU  51          1HG       GLU  51   2.374  -9.113  -1.432
  398   2HG   GLU  51          2HG       GLU  51   3.316  -7.989  -0.450
  399    H    GLY  52           H        GLY  52   0.320  -6.744   2.436
  400   1HA   GLY  52          1HA       GLY  52  -1.457  -6.717   3.968
  401   2HA   GLY  52          2HA       GLY  52  -2.172  -8.048   3.053
  402    H    VAL  53           H        VAL  53  -1.312  -4.916   1.628
  403    HA   VAL  53           HA       VAL  53  -3.887  -3.691   1.888
  404    HB   VAL  53           HB       VAL  53  -1.677  -3.309  -0.148
  405   1HG1  VAL  53          1HG1      VAL  53  -4.292  -1.828   0.222
  406   2HG1  VAL  53          2HG1      VAL  53  -2.905  -1.122  -0.607
  407   3HG1  VAL  53          3HG1      VAL  53  -3.674  -2.571  -1.255
  408   1HG2  VAL  53          1HG2      VAL  53  -1.247  -2.694   2.240
  409   2HG2  VAL  53          2HG2      VAL  53  -1.218  -1.301   1.159
  410   3HG2  VAL  53          3HG2      VAL  53  -2.630  -1.603   2.170
  411    H    LYS  54           H        LYS  54  -2.489  -5.587  -0.823
  412    HA   LYS  54           HA       LYS  54  -4.886  -5.532  -2.410
  413   1HB   LYS  54          1HB       LYS  54  -2.573  -6.136  -3.233
  414   2HB   LYS  54          2HB       LYS  54  -2.759  -7.692  -2.423
  415   1HG   LYS  54          1HG       LYS  54  -4.839  -8.091  -3.746
  416   2HG   LYS  54          2HG       LYS  54  -4.544  -6.587  -4.615
  417   1HD   LYS  54          1HD       LYS  54  -2.558  -8.877  -4.504
  418   2HD   LYS  54          2HD       LYS  54  -3.724  -8.663  -5.807
  419   1HE   LYS  54          1HE       LYS  54  -2.734  -6.276  -6.034
  420   2HE   LYS  54          2HE       LYS  54  -1.393  -6.895  -5.069
  421   1HZ   LYS  54          1HZ       LYS  54  -2.157  -8.645  -7.210
  422   2HZ   LYS  54          2HZ       LYS  54  -1.629  -7.125  -7.752
  423   3HZ   LYS  54          3HZ       LYS  54  -0.622  -8.076  -6.769
  424    H    ALA  55           H        ALA  55  -3.658  -7.823   0.016
  425    HA   ALA  55           HA       ALA  55  -5.779  -9.747  -0.334
  426   1HB   ALA  55          1HB       ALA  55  -5.046 -10.555   1.931
  427   2HB   ALA  55          2HB       ALA  55  -3.943  -9.182   2.010
  428   3HB   ALA  55          3HB       ALA  55  -3.726 -10.417   0.770
  429    H    LEU  56           H        LEU  56  -5.337  -6.915   1.703
  430    HA   LEU  56           HA       LEU  56  -7.590  -7.244   3.395
  431   1HB   LEU  56          1HB       LEU  56  -5.873  -5.585   3.882
  432   2HB   LEU  56          2HB       LEU  56  -6.231  -4.725   2.387
  433    HG   LEU  56           HG       LEU  56  -8.459  -4.149   3.204
  434   1HD1  LEU  56          1HD1      LEU  56  -7.678  -5.973   5.482
  435   2HD1  LEU  56          2HD1      LEU  56  -8.885  -4.710   5.716
  436   3HD1  LEU  56          3HD1      LEU  56  -9.160  -5.978   4.525
  437   1HD2  LEU  56          1HD2      LEU  56  -6.386  -2.813   3.874
  438   2HD2  LEU  56          2HD2      LEU  56  -7.805  -2.586   4.897
  439   3HD2  LEU  56          3HD2      LEU  56  -6.485  -3.624   5.437
  440    H    ILE  57           H        ILE  57  -7.261  -5.457   0.324
  441    HA   ILE  57           HA       ILE  57 -10.045  -4.751   0.156
  442    HB   ILE  57           HB       ILE  57  -8.016  -5.090  -2.070
  443   1HG1  ILE  57          1HG1      ILE  57  -7.220  -3.438  -0.462
  444   2HG1  ILE  57          2HG1      ILE  57  -7.810  -2.594  -1.890
  445   1HG2  ILE  57          1HG2      ILE  57 -10.739  -3.802  -1.942
  446   2HG2  ILE  57          2HG2      ILE  57  -9.567  -3.404  -3.198
  447   3HG2  ILE  57          3HG2      ILE  57 -10.170  -5.053  -3.045
  448   1HD1  ILE  57          1HD1      ILE  57 -10.081  -2.506  -0.540
  449   2HD1  ILE  57          2HD1      ILE  57  -9.029  -2.762   0.850
  450   3HD1  ILE  57          3HD1      ILE  57  -8.798  -1.353  -0.182
  451    H    ASP  58           H        ASP  58  -8.136  -7.486  -1.080
  452    HA   ASP  58           HA       ASP  58 -10.198  -8.643  -2.679
  453   1HB   ASP  58          1HB       ASP  58  -7.926  -9.929  -1.149
  454   2HB   ASP  58          2HB       ASP  58  -8.970 -10.813  -2.256
  455    H    GLU  59           H        GLU  59  -9.469  -8.975   0.781
  456    HA   GLU  59           HA       GLU  59 -11.522 -10.949   1.265
  457   1HB   GLU  59          1HB       GLU  59  -9.880  -9.115   3.007
  458   2HB   GLU  59          2HB       GLU  59 -11.213 -10.034   3.701
  459   1HG   GLU  59          1HG       GLU  59  -8.959 -11.176   3.847
  460   2HG   GLU  59          2HG       GLU  59 -10.213 -12.126   3.053
  461    H    ILE  60           H        ILE  60 -11.345  -7.419   1.456
  462    HA   ILE  60           HA       ILE  60 -13.986  -7.078   2.522
  463    HB   ILE  60           HB       ILE  60 -12.194  -5.218   0.946
  464   1HG1  ILE  60          1HG1      ILE  60 -12.921  -5.176   3.883
  465   2HG1  ILE  60          2HG1      ILE  60 -11.522  -6.062   3.270
  466   1HG2  ILE  60          1HG2      ILE  60 -14.857  -4.752   2.305
  467   2HG2  ILE  60          2HG2      ILE  60 -13.732  -3.443   1.946
  468   3HG2  ILE  60          3HG2      ILE  60 -14.422  -4.398   0.634
  469   1HD1  ILE  60          1HD1      ILE  60 -12.024  -3.100   2.854
  470   2HD1  ILE  60          2HD1      ILE  60 -10.906  -3.781   4.034
  471   3HD1  ILE  60          3HD1      ILE  60 -10.609  -3.999   2.309
  472    H    LEU  61           H        LEU  61 -12.706  -6.828  -0.809
  473    HA   LEU  61           HA       LEU  61 -15.262  -6.385  -2.024
  474   1HB   LEU  61          1HB       LEU  61 -12.684  -7.536  -3.137
  475   2HB   LEU  61          2HB       LEU  61 -14.104  -7.216  -4.131
  476    HG   LEU  61           HG       LEU  61 -12.560  -5.164  -2.512
  477   1HD1  LEU  61          1HD1      LEU  61 -11.507  -6.113  -4.632
  478   2HD1  LEU  61          2HD1      LEU  61 -12.854  -5.398  -5.515
  479   3HD1  LEU  61          3HD1      LEU  61 -11.743  -4.364  -4.619
  480   1HD2  LEU  61          1HD2      LEU  61 -15.154  -5.048  -4.031
  481   2HD2  LEU  61          2HD2      LEU  61 -14.686  -4.213  -2.551
  482   3HD2  LEU  61          3HD2      LEU  61 -14.087  -3.646  -4.103
  483    H    ALA  62           H        ALA  62 -13.439  -9.335  -1.310
  484    HA   ALA  62           HA       ALA  62 -15.019 -11.213  -2.669
  485   1HB   ALA  62          1HB       ALA  62 -13.690 -11.447   0.045
  486   2HB   ALA  62          2HB       ALA  62 -14.339 -12.813  -0.862
  487   3HB   ALA  62          3HB       ALA  62 -12.989 -11.883  -1.514
  488    H    ALA  63           H        ALA  63 -15.896  -9.237   0.046
  489    HA   ALA  63           HA       ALA  63 -18.030 -10.970   1.003
  490   1HB   ALA  63          1HB       ALA  63 -17.119  -9.349   2.547
  491   2HB   ALA  63          2HB       ALA  63 -17.441  -8.028   1.425
  492   3HB   ALA  63          3HB       ALA  63 -18.781  -8.872   2.199
  493    H    LEU  64           H        LEU  64 -18.079  -7.824  -0.690
  494    HA   LEU  64           HA       LEU  64 -20.845  -8.149  -1.457
  495   1HB   LEU  64          1HB       LEU  64 -19.960  -6.199  -3.145
  496   2HB   LEU  64          2HB       LEU  64 -20.392  -5.890  -1.469
  497    HG   LEU  64           HG       LEU  64 -17.574  -6.761  -2.072
  498   1HD1  LEU  64          1HD1      LEU  64 -18.735  -4.021  -2.613
  499   2HD1  LEU  64          2HD1      LEU  64 -17.017  -4.283  -2.311
  500   3HD1  LEU  64          3HD1      LEU  64 -17.791  -5.035  -3.706
  501   1HD2  LEU  64          1HD2      LEU  64 -18.596  -6.346   0.269
  502   2HD2  LEU  64          2HD2      LEU  64 -17.070  -5.541  -0.088
  503   3HD2  LEU  64          3HD2      LEU  64 -18.581  -4.638  -0.161
  504    HA   PRO  65           HA       PRO  65 -20.352 -10.629  -5.099
  505   1HB   PRO  65          1HB       PRO  65 -22.012  -9.175  -6.887
  506   2HB   PRO  65          2HB       PRO  65 -22.519 -10.475  -5.802
  507   1HG   PRO  65          1HG       PRO  65 -22.915  -7.555  -5.529
  508   2HG   PRO  65          2HG       PRO  65 -23.824  -8.882  -4.796
  509   1HD   PRO  65          1HD       PRO  65 -22.010  -7.241  -3.432
  510   2HD   PRO  65          2HD       PRO  65 -22.538  -8.851  -2.881

  No H/Q in entry =         510
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1  22.374  14.505   6.424
    2    H2   MET   1           H2       MET   1  22.873  15.616   7.609
    3    H3   MET   1           H3       MET   1  22.719  16.113   5.994
    4    HA   MET   1           HA       MET   1  24.601  14.957   5.305
    5   1HB   MET   1          1HB       MET   1  25.046  16.041   8.101
    6   2HB   MET   1          2HB       MET   1  26.350  15.599   7.000
    7   1HG   MET   1          1HG       MET   1  25.485  17.221   5.338
    8   2HG   MET   1          2HG       MET   1  24.204  17.674   6.462
    9   1HE   MET   1          1HE       MET   1  27.766  17.060   5.888
   10   2HE   MET   1          2HE       MET   1  27.949  18.757   5.427
   11   3HE   MET   1          3HE       MET   1  28.697  18.157   6.904
   12    H    LYS   2           H        LYS   2  24.745  12.751   5.116
   13    HA   LYS   2           HA       LYS   2  24.472  11.006   7.450
   14   1HB   LYS   2          1HB       LYS   2  24.855   9.189   5.854
   15   2HB   LYS   2          2HB       LYS   2  23.669  10.320   5.202
   16   1HG   LYS   2          1HG       LYS   2  25.644  11.483   4.044
   17   2HG   LYS   2          2HG       LYS   2  26.589  10.056   4.460
   18   1HD   LYS   2          1HD       LYS   2  23.976   9.934   2.926
   19   2HD   LYS   2          2HD       LYS   2  25.555  10.004   2.148
   20   1HE   LYS   2          1HE       LYS   2  24.543   7.835   4.008
   21   2HE   LYS   2          2HE       LYS   2  24.892   7.682   2.290
   22   1HZ   LYS   2          1HZ       LYS   2  27.226   8.496   2.999
   23   2HZ   LYS   2          2HZ       LYS   2  26.763   7.963   4.540
   24   3HZ   LYS   2          3HZ       LYS   2  26.798   6.870   3.241
   25    H    ALA   3           H        ALA   3  26.140  10.184   8.652
   26    HA   ALA   3           HA       ALA   3  28.847   9.966   7.610
   27   1HB   ALA   3          1HB       ALA   3  28.318  12.023   9.776
   28   2HB   ALA   3          2HB       ALA   3  28.709  12.408   8.101
   29   3HB   ALA   3          3HB       ALA   3  29.893  11.584   9.115
   30    H    ILE   4           H        ILE   4  26.399   9.228   9.780
   31    HA   ILE   4           HA       ILE   4  28.202   8.040  11.820
   32    HB   ILE   4           HB       ILE   4  26.060   7.435  12.959
   33   1HG1  ILE   4          1HG1      ILE   4  24.767   9.043  10.734
   34   2HG1  ILE   4          2HG1      ILE   4  24.715   7.284  10.829
   35   1HG2  ILE   4          1HG2      ILE   4  26.375  10.329  12.111
   36   2HG2  ILE   4          2HG2      ILE   4  25.419   9.781  13.487
   37   3HG2  ILE   4          3HG2      ILE   4  27.168   9.551  13.480
   38   1HD1  ILE   4          1HD1      ILE   4  23.676   7.484  13.097
   39   2HD1  ILE   4          2HD1      ILE   4  23.607   9.231  12.872
   40   3HD1  ILE   4          3HD1      ILE   4  22.678   8.169  11.814
   41    H    PHE   5           H        PHE   5  27.993   5.741  12.356
   42    HA   PHE   5           HA       PHE   5  28.131   4.033  10.083
   43   1HB   PHE   5          1HB       PHE   5  29.074   3.643  12.439
   44   2HB   PHE   5          2HB       PHE   5  27.453   3.115  12.887
   45    HD1  PHE   5           HD1      PHE   5  26.936   0.836  12.649
   46    HD2  PHE   5           HD2      PHE   5  30.004   2.565  10.186
   47    HE1  PHE   5           HE1      PHE   5  27.396  -1.388  11.659
   48    HE2  PHE   5           HE2      PHE   5  30.465   0.337   9.201
   49    HZ   PHE   5           HZ       PHE   5  29.160  -1.639   9.934
   50    H    VAL   6           H        VAL   6  26.114   2.285  12.052
   51    HA   VAL   6           HA       VAL   6  23.569   3.249  10.913
   52    HB   VAL   6           HB       VAL   6  23.169   0.767  10.096
   53   1HG1  VAL   6          1HG1      VAL   6  23.338   2.860   8.655
   54   2HG1  VAL   6          2HG1      VAL   6  25.055   2.496   8.475
   55   3HG1  VAL   6          3HG1      VAL   6  23.845   1.364   7.872
   56   1HG2  VAL   6          1HG2      VAL   6  25.358  -0.015  11.048
   57   2HG2  VAL   6          2HG2      VAL   6  25.177  -0.356   9.327
   58   3HG2  VAL   6          3HG2      VAL   6  26.176   0.993   9.854
   59    H    LEU   7           H        LEU   7  22.337   3.271  12.742
   60    HA   LEU   7           HA       LEU   7  21.757   0.815  14.130
   61   1HB   LEU   7          1HB       LEU   7  22.673   1.371  16.335
   62   2HB   LEU   7          2HB       LEU   7  23.956   1.248  15.136
   63    HG   LEU   7           HG       LEU   7  23.356   3.934  14.956
   64   1HD1  LEU   7          1HD1      LEU   7  21.769   3.629  16.935
   65   2HD1  LEU   7          2HD1      LEU   7  23.196   3.292  17.912
   66   3HD1  LEU   7          3HD1      LEU   7  23.008   4.864  17.139
   67   1HD2  LEU   7          1HD2      LEU   7  25.287   2.635  16.904
   68   2HD2  LEU   7          2HD2      LEU   7  25.608   2.968  15.202
   69   3HD2  LEU   7          3HD2      LEU   7  25.376   4.302  16.334
   70    H    ASN   8           H        ASN   8  21.723   4.384  14.419
   71    HA   ASN   8           HA       ASN   8  19.388   4.455  16.098
   72   1HB   ASN   8          1HB       ASN   8  20.582   6.507  14.215
   73   2HB   ASN   8          2HB       ASN   8  19.207   6.839  15.267
   74   2HD2  ASN   8          2HD2      ASN   8  22.398   7.430  15.169
   75   1HD2  ASN   8          1HD2      ASN   8  22.795   7.325  16.816
   76    H    ALA   9           H        ALA   9  19.862   4.575  12.580
   77    HA   ALA   9           HA       ALA   9  16.892   4.499  12.193
   78   1HB   ALA   9          1HB       ALA   9  18.059   6.299  11.004
   79   2HB   ALA   9          2HB       ALA   9  17.420   5.126   9.851
   80   3HB   ALA   9          3HB       ALA   9  19.138   5.124  10.252
   81    H    GLN  10           H        GLN  10  16.400   2.315  12.387
   82    HA   GLN  10           HA       GLN  10  18.032   0.210  11.261
   83   1HB   GLN  10          1HB       GLN  10  16.108  -1.247  11.762
   84   2HB   GLN  10          2HB       GLN  10  16.463  -0.192  13.130
   85   1HG   GLN  10          1HG       GLN  10  14.709   1.396  12.264
   86   2HG   GLN  10          2HG       GLN  10  14.279   0.178  11.064
   87   2HE2  GLN  10          2HE2      GLN  10  12.225  -0.455  11.887
   88   1HE2  GLN  10          1HE2      GLN  10  12.007  -1.136  13.426
   89    H    HIS  11           H        HIS  11  15.388   2.186  10.057
   90    HA   HIS  11           HA       HIS  11  15.124   0.525   7.612
   91   1HB   HIS  11          1HB       HIS  11  13.289   2.075   7.049
   92   2HB   HIS  11          2HB       HIS  11  13.080   1.411   8.671
   93    HD1  HIS  11           HD1      HIS  11  14.132   3.028  10.648
   94    HD2  HIS  11           HD2      HIS  11  13.230   4.840   7.003
   95    HE1  HIS  11           HE1      HIS  11  14.007   5.518  11.098
   96    H    ASP  12           H        ASP  12  16.597   0.898   6.047
   97    HA   ASP  12           HA       ASP  12  17.540   3.711   5.566
   98   1HB   ASP  12          1HB       ASP  12  18.856   1.034   5.026
   99   2HB   ASP  12          2HB       ASP  12  19.473   2.567   4.408
  100    H    GLU  13           H        GLU  13  15.224   1.779   4.486
  101    HA   GLU  13           HA       GLU  13  15.691   1.421   1.701
  102   1HB   GLU  13          1HB       GLU  13  13.121   1.853   3.247
  103   2HB   GLU  13          2HB       GLU  13  13.164   1.447   1.532
  104   1HG   GLU  13          1HG       GLU  13  14.422  -0.613   2.048
  105   2HG   GLU  13          2HG       GLU  13  14.376  -0.209   3.765
  106    H    ALA  14           H        ALA  14  15.409   2.775  -0.062
  107    HA   ALA  14           HA       ALA  14  14.098   5.367   0.190
  108   1HB   ALA  14          1HB       ALA  14  16.311   5.864   1.192
  109   2HB   ALA  14          2HB       ALA  14  17.096   5.277  -0.273
  110   3HB   ALA  14          3HB       ALA  14  16.086   6.722  -0.333
  111    H    VAL  15           H        VAL  15  15.407   2.793  -1.557
  112    HA   VAL  15           HA       VAL  15  15.672   3.933  -4.165
  113    HB   VAL  15           HB       VAL  15  14.959   1.129  -3.261
  114   1HG1  VAL  15          1HG1      VAL  15  15.487   2.273  -6.009
  115   2HG1  VAL  15          2HG1      VAL  15  15.762   0.568  -5.647
  116   3HG1  VAL  15          3HG1      VAL  15  14.145   1.253  -5.489
  117   1HG2  VAL  15          1HG2      VAL  15  17.208   2.018  -2.637
  118   2HG2  VAL  15          2HG2      VAL  15  17.307   0.668  -3.768
  119   3HG2  VAL  15          3HG2      VAL  15  17.532   2.320  -4.344
  120    H    ASP  16           H        ASP  16  12.896   2.556  -2.433
  121    HA   ASP  16           HA       ASP  16  11.091   3.873  -4.420
  122   1HB   ASP  16          1HB       ASP  16   9.649   1.885  -4.454
  123   2HB   ASP  16          2HB       ASP  16  11.269   1.467  -5.013
  124    H    ALA  17           H        ALA  17   8.982   4.337  -3.542
  125    HA   ALA  17           HA       ALA  17   8.223   3.759  -0.842
  126   1HB   ALA  17          1HB       ALA  17   9.993   5.197  -0.119
  127   2HB   ALA  17          2HB       ALA  17   9.615   6.398  -1.353
  128   3HB   ALA  17          3HB       ALA  17   8.518   6.155   0.007
  129    H    ASN  18           H        ASN  18   8.046   5.975  -3.591
  130    HA   ASN  18           HA       ASN  18   5.519   7.160  -3.015
  131   1HB   ASN  18          1HB       ASN  18   7.022   7.965  -4.815
  132   2HB   ASN  18          2HB       ASN  18   6.710   6.486  -5.724
  133   2HD2  ASN  18          2HD2      ASN  18   5.125   9.436  -4.464
  134   1HD2  ASN  18          1HD2      ASN  18   3.812   9.382  -5.539
  135    H    SER  19           H        SER  19   6.374   4.134  -4.662
  136    HA   SER  19           HA       SER  19   3.777   3.425  -5.571
  137   1HB   SER  19          1HB       SER  19   5.916   2.247  -6.173
  138   2HB   SER  19          2HB       SER  19   5.924   1.539  -4.560
  139    HG   SER  19           HG       SER  19   3.570   1.326  -6.024
  140    H    LEU  20           H        LEU  20   5.371   2.865  -2.435
  141    HA   LEU  20           HA       LEU  20   3.340   1.218  -1.328
  142   1HB   LEU  20          1HB       LEU  20   5.531   1.500  -0.244
  143   2HB   LEU  20          2HB       LEU  20   5.171   3.197   0.068
  144    HG   LEU  20           HG       LEU  20   3.309   2.571   1.532
  145   1HD1  LEU  20          1HD1      LEU  20   3.966  -0.199   0.533
  146   2HD1  LEU  20          2HD1      LEU  20   3.219   0.011   2.116
  147   3HD1  LEU  20          3HD1      LEU  20   2.393   0.584   0.672
  148   1HD2  LEU  20          1HD2      LEU  20   5.893   1.081   2.097
  149   2HD2  LEU  20          2HD2      LEU  20   5.499   2.727   2.590
  150   3HD2  LEU  20          3HD2      LEU  20   4.635   1.361   3.300
  151    H    ALA  21           H        ALA  21   3.742   4.759  -1.233
  152    HA   ALA  21           HA       ALA  21   1.299   5.227   0.202
  153   1HB   ALA  21          1HB       ALA  21   3.092   6.973  -1.487
  154   2HB   ALA  21          2HB       ALA  21   2.915   6.972   0.267
  155   3HB   ALA  21          3HB       ALA  21   1.615   7.595  -0.750
  156    H    GLU  22           H        GLU  22   2.161   5.292  -3.256
  157    HA   GLU  22           HA       GLU  22  -0.380   6.150  -4.227
  158   1HB   GLU  22          1HB       GLU  22   1.693   6.057  -5.611
  159   2HB   GLU  22          2HB       GLU  22   1.597   4.296  -5.590
  160   1HG   GLU  22          1HG       GLU  22  -0.605   4.392  -6.687
  161   2HG   GLU  22          2HG       GLU  22  -0.527   6.155  -6.700
  162    H    ALA  23           H        ALA  23   0.892   2.920  -3.484
  163    HA   ALA  23           HA       ALA  23  -1.300   1.416  -4.493
  164   1HB   ALA  23          1HB       ALA  23  -0.601  -0.232  -2.623
  165   2HB   ALA  23          2HB       ALA  23   0.612   0.171  -3.837
  166   3HB   ALA  23          3HB       ALA  23   0.667   0.936  -2.249
  167    H    LYS  24           H        LYS  24  -0.746   2.819  -1.247
  168    HA   LYS  24           HA       LYS  24  -3.242   1.958  -0.136
  169   1HB   LYS  24          1HB       LYS  24  -1.459   4.320   0.535
  170   2HB   LYS  24          2HB       LYS  24  -2.862   3.841   1.500
  171   1HG   LYS  24          1HG       LYS  24  -1.888   1.604   1.827
  172   2HG   LYS  24          2HG       LYS  24  -0.482   2.071   0.865
  173   1HD   LYS  24          1HD       LYS  24   0.039   3.854   2.487
  174   2HD   LYS  24          2HD       LYS  24  -1.360   3.386   3.447
  175   1HE   LYS  24          1HE       LYS  24  -0.414   1.187   3.858
  176   2HE   LYS  24          2HE       LYS  24   0.931   1.527   2.771
  177   1HZ   LYS  24          1HZ       LYS  24   1.257   3.546   4.358
  178   2HZ   LYS  24          2HZ       LYS  24   0.400   2.574   5.458
  179   3HZ   LYS  24          3HZ       LYS  24   1.854   2.014   4.788
  180    H    VAL  25           H        VAL  25  -2.299   4.885  -1.935
  181    HA   VAL  25           HA       VAL  25  -4.844   6.219  -1.695
  182    HB   VAL  25           HB       VAL  25  -2.634   6.426  -3.755
  183   1HG1  VAL  25          1HG1      VAL  25  -5.207   7.986  -3.452
  184   2HG1  VAL  25          2HG1      VAL  25  -3.805   8.633  -4.303
  185   3HG1  VAL  25          3HG1      VAL  25  -4.597   7.171  -4.892
  186   1HG2  VAL  25          1HG2      VAL  25  -2.337   7.155  -1.279
  187   2HG2  VAL  25          2HG2      VAL  25  -1.921   8.325  -2.531
  188   3HG2  VAL  25          3HG2      VAL  25  -3.456   8.459  -1.674
  189    H    LEU  26           H        LEU  26  -3.458   4.165  -4.280
  190    HA   LEU  26           HA       LEU  26  -5.788   4.166  -5.924
  191   1HB   LEU  26          1HB       LEU  26  -3.626   2.072  -5.526
  192   2HB   LEU  26          2HB       LEU  26  -4.855   1.976  -6.786
  193    HG   LEU  26           HG       LEU  26  -2.951   4.311  -6.443
  194   1HD1  LEU  26          1HD1      LEU  26  -2.822   1.909  -8.289
  195   2HD1  LEU  26          2HD1      LEU  26  -1.798   3.337  -8.439
  196   3HD1  LEU  26          3HD1      LEU  26  -1.682   2.314  -7.007
  197   1HD2  LEU  26          1HD2      LEU  26  -5.115   3.600  -8.419
  198   2HD2  LEU  26          2HD2      LEU  26  -4.720   5.164  -7.708
  199   3HD2  LEU  26          3HD2      LEU  26  -3.710   4.503  -8.986
  200    H    ALA  27           H        ALA  27  -4.798   2.123  -3.216
  201    HA   ALA  27           HA       ALA  27  -7.114   0.380  -3.356
  202   1HB   ALA  27          1HB       ALA  27  -4.916   0.885  -1.366
  203   2HB   ALA  27          2HB       ALA  27  -5.265  -0.576  -2.283
  204   3HB   ALA  27          3HB       ALA  27  -6.288  -0.126  -0.923
  205    H    ASN  28           H        ASN  28  -6.177   3.012  -1.123
  206    HA   ASN  28           HA       ASN  28  -8.591   3.048   0.372
  207   1HB   ASN  28          1HB       ASN  28  -6.538   4.214   1.076
  208   2HB   ASN  28          2HB       ASN  28  -6.714   5.341  -0.269
  209   2HD2  ASN  28          2HD2      ASN  28  -6.734   6.131   2.538
  210   1HD2  ASN  28          1HD2      ASN  28  -8.268   6.779   2.868
  211    H    ARG  29           H        ARG  29  -7.660   4.944  -2.510
  212    HA   ARG  29           HA       ARG  29 -10.093   6.430  -2.667
  213   1HB   ARG  29          1HB       ARG  29  -7.813   6.728  -3.930
  214   2HB   ARG  29          2HB       ARG  29  -8.521   5.647  -5.124
  215   1HG   ARG  29          1HG       ARG  29  -9.828   8.193  -4.130
  216   2HG   ARG  29          2HG       ARG  29  -8.854   8.101  -5.590
  217   1HD   ARG  29          1HD       ARG  29 -10.609   6.041  -6.036
  218   2HD   ARG  29          2HD       ARG  29 -11.630   7.145  -5.121
  219    HE   ARG  29           HE       ARG  29 -10.962   7.439  -7.848
  220   1HH1  ARG  29          1HH1      ARG  29 -10.906   9.402  -8.930
  221   2HH1  ARG  29          2HH1      ARG  29 -10.823  10.878  -8.027
  222   1HH2  ARG  29          1HH2      ARG  29 -10.827   9.311  -4.944
  223   2HH2  ARG  29          2HH2      ARG  29 -10.770  10.824  -5.778
  224    H    GLU  30           H        GLU  30  -9.211   3.210  -3.758
  225    HA   GLU  30           HA       GLU  30 -11.376   2.717  -5.544
  226   1HB   GLU  30          1HB       GLU  30  -9.366   1.229  -5.186
  227   2HB   GLU  30          2HB       GLU  30 -10.084   0.717  -3.663
  228   1HG   GLU  30          1HG       GLU  30 -10.688  -0.935  -5.291
  229   2HG   GLU  30          2HG       GLU  30 -12.138   0.022  -4.989
  230    H    LEU  31           H        LEU  31 -11.156   2.396  -2.018
  231    HA   LEU  31           HA       LEU  31 -13.748   1.201  -1.657
  232   1HB   LEU  31          1HB       LEU  31 -12.435   3.047   0.351
  233   2HB   LEU  31          2HB       LEU  31 -13.442   1.631   0.655
  234    HG   LEU  31           HG       LEU  31 -10.632   1.674  -0.460
  235   1HD1  LEU  31          1HD1      LEU  31 -11.842   0.506   2.067
  236   2HD1  LEU  31          2HD1      LEU  31 -10.158   0.324   1.573
  237   3HD1  LEU  31          3HD1      LEU  31 -10.792   1.919   1.978
  238   1HD2  LEU  31          1HD2      LEU  31 -12.668  -0.557  -0.228
  239   2HD2  LEU  31          2HD2      LEU  31 -11.753  -0.067  -1.654
  240   3HD2  LEU  31          3HD2      LEU  31 -10.936  -0.879  -0.318
  241    H    ASP  32           H        ASP  32 -12.587   4.510  -1.852
  242    HA   ASP  32           HA       ASP  32 -14.895   5.873  -0.968
  243   1HB   ASP  32          1HB       ASP  32 -12.717   6.943  -1.293
  244   2HB   ASP  32          2HB       ASP  32 -12.854   6.715  -3.035
  245    H    LYS  33           H        LYS  33 -14.067   4.876  -4.345
  246    HA   LYS  33           HA       LYS  33 -16.353   6.126  -5.502
  247   1HB   LYS  33          1HB       LYS  33 -16.102   4.269  -7.298
  248   2HB   LYS  33          2HB       LYS  33 -14.772   5.403  -7.079
  249   1HG   LYS  33          1HG       LYS  33 -13.597   3.789  -5.667
  250   2HG   LYS  33          2HG       LYS  33 -14.936   2.650  -5.817
  251   1HD   LYS  33          1HD       LYS  33 -13.318   3.733  -8.146
  252   2HD   LYS  33          2HD       LYS  33 -13.041   2.170  -7.386
  253   1HE   LYS  33          1HE       LYS  33 -14.444   1.499  -9.102
  254   2HE   LYS  33          2HE       LYS  33 -15.669   1.885  -7.894
  255   1HZ   LYS  33          1HZ       LYS  33 -15.363   4.267  -8.950
  256   2HZ   LYS  33          2HZ       LYS  33 -14.892   3.349 -10.300
  257   3HZ   LYS  33          3HZ       LYS  33 -16.428   3.124  -9.617
  258    H    TYR  34           H        TYR  34 -16.003   2.887  -4.060
  259    HA   TYR  34           HA       TYR  34 -18.700   2.083  -4.730
  260   1HB   TYR  34          1HB       TYR  34 -16.728   1.064  -2.673
  261   2HB   TYR  34          2HB       TYR  34 -18.315   0.337  -2.927
  262    HD1  TYR  34           HD1      TYR  34 -14.920   0.282  -3.963
  263    HD2  TYR  34           HD2      TYR  34 -18.927  -0.194  -5.437
  264    HE1  TYR  34           HE1      TYR  34 -14.054  -0.979  -5.916
  265    HE2  TYR  34           HE2      TYR  34 -18.061  -1.455  -7.388
  266    HH   TYR  34           HH       TYR  34 -14.585  -1.805  -7.953
  267    H    GLY  35           H        GLY  35 -17.263   3.866  -2.061
  268   1HA   GLY  35          1HA       GLY  35 -20.008   4.511  -1.105
  269   2HA   GLY  35          2HA       GLY  35 -18.542   5.408  -0.713
  270    H    VAL  36           H        VAL  36 -17.425   2.444  -0.290
  271    HA   VAL  36           HA       VAL  36 -18.696   1.284   1.926
  272    HB   VAL  36           HB       VAL  36 -15.684   1.454   1.890
  273   1HG1  VAL  36          1HG1      VAL  36 -16.838   0.062   3.577
  274   2HG1  VAL  36          2HG1      VAL  36 -17.654  -0.821   2.288
  275   3HG1  VAL  36          3HG1      VAL  36 -15.903  -0.933   2.462
  276   1HG2  VAL  36          1HG2      VAL  36 -17.463   0.167  -0.190
  277   2HG2  VAL  36          2HG2      VAL  36 -16.065   1.213  -0.438
  278   3HG2  VAL  36          3HG2      VAL  36 -15.838  -0.437   0.136
  279    H    SER  37           H        SER  37 -17.812   1.384   4.271
  280    HA   SER  37           HA       SER  37 -18.188   4.024   5.286
  281   1HB   SER  37          1HB       SER  37 -17.640   3.094   7.444
  282   2HB   SER  37          2HB       SER  37 -18.530   1.861   6.556
  283    HG   SER  37           HG       SER  37 -16.754   0.846   7.344
  284    H    ASP  38           H        ASP  38 -16.575   5.328   6.471
  285    HA   ASP  38           HA       ASP  38 -14.007   5.412   5.002
  286   1HB   ASP  38          1HB       ASP  38 -13.706   7.580   6.134
  287   2HB   ASP  38          2HB       ASP  38 -15.284   7.503   5.349
  288    H    TYR  39           H        TYR  39 -14.937   3.556   7.417
  289    HA   TYR  39           HA       TYR  39 -12.821   4.139   9.379
  290   1HB   TYR  39          1HB       TYR  39 -14.901   3.274  10.244
  291   2HB   TYR  39          2HB       TYR  39 -14.868   1.917   9.120
  292    HD1  TYR  39           HD1      TYR  39 -13.445   3.321  12.213
  293    HD2  TYR  39           HD2      TYR  39 -13.337   0.049   9.435
  294    HE1  TYR  39           HE1      TYR  39 -12.141   1.980  13.842
  295    HE2  TYR  39           HE2      TYR  39 -12.037  -1.289  11.056
  296    HH   TYR  39           HH       TYR  39 -11.724  -0.439  14.313
  297    H    TYR  40           H        TYR  40 -13.526   1.650   6.939
  298    HA   TYR  40           HA       TYR  40 -11.272  -0.019   7.449
  299   1HB   TYR  40          1HB       TYR  40 -12.735   0.456   4.836
  300   2HB   TYR  40          2HB       TYR  40 -11.677  -0.908   5.185
  301    HD1  TYR  40           HD1      TYR  40 -15.024   0.055   5.057
  302    HD2  TYR  40           HD2      TYR  40 -12.280  -2.107   7.563
  303    HE1  TYR  40           HE1      TYR  40 -16.920  -1.166   6.080
  304    HE2  TYR  40           HE2      TYR  40 -14.179  -3.324   8.589
  305    HH   TYR  40           HH       TYR  40 -17.056  -2.479   8.708
  306    H    LYS  41           H        LYS  41 -11.557   2.930   5.498
  307    HA   LYS  41           HA       LYS  41  -9.168   2.612   3.998
  308   1HB   LYS  41          1HB       LYS  41  -9.328   4.936   3.519
  309   2HB   LYS  41          2HB       LYS  41 -10.995   4.413   3.741
  310   1HG   LYS  41          1HG       LYS  41 -10.707   5.116   6.196
  311   2HG   LYS  41          2HG       LYS  41  -9.245   5.940   5.674
  312   1HD   LYS  41          1HD       LYS  41 -11.958   6.418   4.408
  313   2HD   LYS  41          2HD       LYS  41 -11.312   7.402   5.720
  314   1HE   LYS  41          1HE       LYS  41  -9.269   7.814   4.272
  315   2HE   LYS  41          2HE       LYS  41 -10.147   7.048   2.947
  316   1HZ   LYS  41          1HZ       LYS  41 -11.276   9.302   4.493
  317   2HZ   LYS  41          2HZ       LYS  41 -10.314   9.543   3.114
  318   3HZ   LYS  41          3HZ       LYS  41 -11.785   8.702   2.991
  319    H    ASN  42           H        ASN  42  -9.765   3.918   7.236
  320    HA   ASN  42           HA       ASN  42  -7.104   4.799   7.720
  321   1HB   ASN  42          1HB       ASN  42  -8.998   5.445   9.165
  322   2HB   ASN  42          2HB       ASN  42  -9.157   3.771   9.702
  323   2HD2  ASN  42          2HD2      ASN  42  -8.696   4.678  11.936
  324   1HD2  ASN  42          1HD2      ASN  42  -7.083   4.958  12.383
  325    H    LEU  43           H        LEU  43  -8.703   1.682   8.201
  326    HA   LEU  43           HA       LEU  43  -6.576   0.364   9.548
  327   1HB   LEU  43          1HB       LEU  43  -8.851  -0.572   9.385
  328   2HB   LEU  43          2HB       LEU  43  -8.645  -0.784   7.649
  329    HG   LEU  43           HG       LEU  43  -6.808  -2.363   8.032
  330   1HD1  LEU  43          1HD1      LEU  43  -7.233  -1.537  10.900
  331   2HD1  LEU  43          2HD1      LEU  43  -6.626  -3.156  10.546
  332   3HD1  LEU  43          3HD1      LEU  43  -5.722  -1.743  10.013
  333   1HD2  LEU  43          1HD2      LEU  43  -9.291  -3.043   8.090
  334   2HD2  LEU  43          2HD2      LEU  43  -8.140  -4.190   8.777
  335   3HD2  LEU  43          3HD2      LEU  43  -9.097  -3.158   9.840
  336    H    ILE  44           H        ILE  44  -7.231   0.805   6.081
  337    HA   ILE  44           HA       ILE  44  -5.141  -0.866   5.083
  338    HB   ILE  44           HB       ILE  44  -6.234   1.722   3.933
  339   1HG1  ILE  44          1HG1      ILE  44  -7.814  -0.328   4.443
  340   2HG1  ILE  44          2HG1      ILE  44  -7.921   0.481   2.885
  341   1HG2  ILE  44          1HG2      ILE  44  -4.524  -0.478   2.774
  342   2HG2  ILE  44          2HG2      ILE  44  -5.469   0.608   1.755
  343   3HG2  ILE  44          3HG2      ILE  44  -4.206   1.256   2.800
  344   1HD1  ILE  44          1HD1      ILE  44  -6.065  -1.868   3.215
  345   2HD1  ILE  44          2HD1      ILE  44  -7.788  -2.136   2.962
  346   3HD1  ILE  44          3HD1      ILE  44  -6.845  -1.264   1.756
  347    H    ASN  45           H        ASN  45  -5.172   2.523   6.121
  348    HA   ASN  45           HA       ASN  45  -2.609   3.332   5.372
  349   1HB   ASN  45          1HB       ASN  45  -4.374   4.708   6.575
  350   2HB   ASN  45          2HB       ASN  45  -3.850   3.929   8.067
  351   2HD2  ASN  45          2HD2      ASN  45  -3.463   6.578   8.185
  352   1HD2  ASN  45          1HD2      ASN  45  -1.849   7.013   7.892
  353    H    ASN  46           H        ASN  46  -3.586   1.243   8.044
  354    HA   ASN  46           HA       ASN  46  -0.980   1.106   9.289
  355   1HB   ASN  46          1HB       ASN  46  -3.166   0.480  10.392
  356   2HB   ASN  46          2HB       ASN  46  -3.187  -0.971   9.390
  357   2HD2  ASN  46          2HD2      ASN  46  -3.064  -2.076  11.619
  358   1HD2  ASN  46          1HD2      ASN  46  -1.523  -2.306  12.295
  359    H    ALA  47           H        ALA  47  -2.527  -0.557   6.629
  360    HA   ALA  47           HA       ALA  47  -1.072  -2.917   6.402
  361   1HB   ALA  47          1HB       ALA  47  -1.622  -1.080   4.060
  362   2HB   ALA  47          2HB       ALA  47  -2.871  -2.056   4.831
  363   3HB   ALA  47          3HB       ALA  47  -1.505  -2.840   4.042
  364    H    LYS  48           H        LYS  48   1.079  -2.683   7.157
  365    HA   LYS  48           HA       LYS  48   2.912  -0.698   6.188
  366   1HB   LYS  48          1HB       LYS  48   3.280  -1.963   8.278
  367   2HB   LYS  48          2HB       LYS  48   3.486  -3.442   7.338
  368   1HG   LYS  48          1HG       LYS  48   5.457  -2.563   6.252
  369   2HG   LYS  48          2HG       LYS  48   5.189  -0.969   6.951
  370   1HD   LYS  48          1HD       LYS  48   6.929  -2.153   8.212
  371   2HD   LYS  48          2HD       LYS  48   5.503  -1.912   9.219
  372   1HE   LYS  48          1HE       LYS  48   6.617  -4.262   9.215
  373   2HE   LYS  48          2HE       LYS  48   4.862  -4.175   9.071
  374   1HZ   LYS  48          1HZ       LYS  48   6.510  -4.146   6.637
  375   2HZ   LYS  48          2HZ       LYS  48   6.236  -5.622   7.432
  376   3HZ   LYS  48          3HZ       LYS  48   4.923  -4.714   6.859
  377    H    THR  49           H        THR  49   2.218  -4.032   5.146
  378    HA   THR  49           HA       THR  49   4.156  -3.719   2.896
  379    HB   THR  49           HB       THR  49   4.313  -5.759   4.290
  380    HG1  THR  49           HG1      THR  49   4.755  -5.738   1.993
  381   1HG2  THR  49          1HG2      THR  49   1.780  -5.780   4.721
  382   2HG2  THR  49          2HG2      THR  49   1.641  -6.556   3.145
  383   3HG2  THR  49          3HG2      THR  49   2.552  -7.340   4.434
  384    H    VAL  50           H        VAL  50   3.495  -3.876   0.755
  385    HA   VAL  50           HA       VAL  50   0.889  -2.907   0.103
  386    HB   VAL  50           HB       VAL  50   2.953  -4.257  -1.640
  387   1HG1  VAL  50          1HG1      VAL  50   0.475  -2.648  -2.301
  388   2HG1  VAL  50          2HG1      VAL  50   1.766  -2.954  -3.463
  389   3HG1  VAL  50          3HG1      VAL  50   0.843  -4.301  -2.797
  390   1HG2  VAL  50          1HG2      VAL  50   2.389  -1.360  -0.953
  391   2HG2  VAL  50          2HG2      VAL  50   3.853  -2.270  -0.590
  392   3HG2  VAL  50          3HG2      VAL  50   3.460  -1.864  -2.260
  393    H    GLU  51           H        GLU  51   2.238  -6.224  -0.029
  394    HA   GLU  51           HA       GLU  51   0.051  -7.406  -1.395
  395   1HB   GLU  51          1HB       GLU  51   0.746  -9.532  -0.356
  396   2HB   GLU  51          2HB       GLU  51   2.146  -8.631  -0.936
  397   1HG   GLU  51          1HG       GLU  51   2.543  -7.781   1.347
  398   2HG   GLU  51          2HG       GLU  51   1.150  -8.688   1.932
  399    H    GLY  52           H        GLY  52   0.376  -6.324   1.904
  400   1HA   GLY  52          1HA       GLY  52  -1.127  -6.437   3.721
  401   2HA   GLY  52          2HA       GLY  52  -1.994  -7.718   2.872
  402    H    VAL  53           H        VAL  53  -1.354  -4.761   1.149
  403    HA   VAL  53           HA       VAL  53  -3.739  -3.336   1.938
  404    HB   VAL  53           HB       VAL  53  -2.016  -3.153  -0.550
  405   1HG1  VAL  53          1HG1      VAL  53  -4.338  -1.470   0.401
  406   2HG1  VAL  53          2HG1      VAL  53  -3.132  -0.865  -0.735
  407   3HG1  VAL  53          3HG1      VAL  53  -4.130  -2.252  -1.165
  408   1HG2  VAL  53          1HG2      VAL  53  -1.062  -2.572   1.761
  409   2HG2  VAL  53          2HG2      VAL  53  -0.962  -1.310   0.533
  410   3HG2  VAL  53          3HG2      VAL  53  -2.209  -1.233   1.779
  411    H    LYS  54           H        LYS  54  -3.012  -5.140  -1.078
  412    HA   LYS  54           HA       LYS  54  -5.741  -5.039  -2.007
  413   1HB   LYS  54          1HB       LYS  54  -3.391  -6.774  -2.784
  414   2HB   LYS  54          2HB       LYS  54  -4.946  -6.831  -3.611
  415   1HG   LYS  54          1HG       LYS  54  -4.761  -4.390  -4.071
  416   2HG   LYS  54          2HG       LYS  54  -3.163  -4.392  -3.332
  417   1HD   LYS  54          1HD       LYS  54  -3.819  -6.273  -5.602
  418   2HD   LYS  54          2HD       LYS  54  -3.320  -4.614  -5.919
  419   1HE   LYS  54          1HE       LYS  54  -1.735  -6.694  -4.378
  420   2HE   LYS  54          2HE       LYS  54  -1.364  -6.070  -5.981
  421   1HZ   LYS  54          1HZ       LYS  54  -1.558  -3.810  -4.578
  422   2HZ   LYS  54          2HZ       LYS  54  -0.953  -4.856  -3.386
  423   3HZ   LYS  54          3HZ       LYS  54  -0.099  -4.640  -4.839
  424    H    ALA  55           H        ALA  55  -3.857  -7.506  -0.280
  425    HA   ALA  55           HA       ALA  55  -5.756  -9.608  -0.420
  426   1HB   ALA  55          1HB       ALA  55  -3.779  -8.949   1.782
  427   2HB   ALA  55          2HB       ALA  55  -4.618 -10.490   1.608
  428   3HB   ALA  55          3HB       ALA  55  -3.471  -9.966   0.375
  429    H    LEU  56           H        LEU  56  -5.483  -6.938   1.923
  430    HA   LEU  56           HA       LEU  56  -7.555  -7.909   3.660
  431   1HB   LEU  56          1HB       LEU  56  -5.883  -6.218   4.354
  432   2HB   LEU  56          2HB       LEU  56  -6.563  -5.079   3.199
  433    HG   LEU  56           HG       LEU  56  -8.761  -5.241   4.417
  434   1HD1  LEU  56          1HD1      LEU  56  -7.076  -7.020   6.186
  435   2HD1  LEU  56          2HD1      LEU  56  -8.440  -6.124   6.853
  436   3HD1  LEU  56          3HD1      LEU  56  -8.704  -7.301   5.570
  437   1HD2  LEU  56          1HD2      LEU  56  -6.274  -4.331   5.883
  438   2HD2  LEU  56          2HD2      LEU  56  -7.365  -3.356   4.901
  439   3HD2  LEU  56          3HD2      LEU  56  -7.902  -3.979   6.458
  440    H    ILE  57           H        ILE  57  -7.524  -5.710   0.875
  441    HA   ILE  57           HA       ILE  57 -10.349  -5.089   1.060
  442    HB   ILE  57           HB       ILE  57  -8.391  -4.819  -1.220
  443   1HG1  ILE  57          1HG1      ILE  57  -9.602  -2.718   0.605
  444   2HG1  ILE  57          2HG1      ILE  57  -8.025  -3.450   0.887
  445   1HG2  ILE  57          1HG2      ILE  57 -11.273  -3.972  -0.912
  446   2HG2  ILE  57          2HG2      ILE  57 -10.183  -3.178  -2.050
  447   3HG2  ILE  57          3HG2      ILE  57 -10.536  -4.895  -2.221
  448   1HD1  ILE  57          1HD1      ILE  57  -8.534  -2.285  -1.822
  449   2HD1  ILE  57          2HD1      ILE  57  -8.295  -1.172  -0.476
  450   3HD1  ILE  57          3HD1      ILE  57  -7.043  -2.345  -0.880
  451    H    ASP  58           H        ASP  58  -8.434  -7.599  -0.431
  452    HA   ASP  58           HA       ASP  58 -10.341  -8.546  -2.328
  453   1HB   ASP  58          1HB       ASP  58  -8.001  -9.364  -2.229
  454   2HB   ASP  58          2HB       ASP  58  -8.348 -10.150  -0.689
  455    H    GLU  59           H        GLU  59  -9.917  -9.159   1.126
  456    HA   GLU  59           HA       GLU  59 -12.042 -11.113   1.311
  457   1HB   GLU  59          1HB       GLU  59 -10.686  -9.354   3.379
  458   2HB   GLU  59          2HB       GLU  59 -11.906 -10.563   3.785
  459   1HG   GLU  59          1HG       GLU  59  -9.358 -11.184   2.266
  460   2HG   GLU  59          2HG       GLU  59  -9.540 -11.394   4.008
  461    H    ILE  60           H        ILE  60 -11.804  -7.606   1.747
  462    HA   ILE  60           HA       ILE  60 -14.514  -7.263   2.638
  463    HB   ILE  60           HB       ILE  60 -12.641  -5.295   1.301
  464   1HG1  ILE  60          1HG1      ILE  60 -13.257  -5.690   4.244
  465   2HG1  ILE  60          2HG1      ILE  60 -11.856  -6.402   3.448
  466   1HG2  ILE  60          1HG2      ILE  60 -15.251  -4.968   2.791
  467   2HG2  ILE  60          2HG2      ILE  60 -14.111  -3.640   2.581
  468   3HG2  ILE  60          3HG2      ILE  60 -14.849  -4.398   1.171
  469   1HD1  ILE  60          1HD1      ILE  60 -12.276  -3.458   3.094
  470   2HD1  ILE  60          2HD1      ILE  60 -11.725  -4.023   4.671
  471   3HD1  ILE  60          3HD1      ILE  60 -10.775  -4.378   3.231
  472    H    LEU  61           H        LEU  61 -12.964  -7.093  -0.567
  473    HA   LEU  61           HA       LEU  61 -15.390  -6.310  -1.935
  474   1HB   LEU  61          1HB       LEU  61 -12.770  -7.493  -2.872
  475   2HB   LEU  61          2HB       LEU  61 -14.105  -7.213  -3.991
  476    HG   LEU  61           HG       LEU  61 -12.861  -5.084  -2.222
  477   1HD1  LEU  61          1HD1      LEU  61 -11.382  -6.047  -4.064
  478   2HD1  LEU  61          2HD1      LEU  61 -12.564  -5.428  -5.217
  479   3HD1  LEU  61          3HD1      LEU  61 -11.687  -4.313  -4.172
  480   1HD2  LEU  61          1HD2      LEU  61 -15.143  -5.127  -4.177
  481   2HD2  LEU  61          2HD2      LEU  61 -14.949  -4.187  -2.697
  482   3HD2  LEU  61          3HD2      LEU  61 -14.112  -3.698  -4.166
  483    H    ALA  62           H        ALA  62 -14.003  -9.371  -0.957
  484    HA   ALA  62           HA       ALA  62 -15.514 -11.103  -2.634
  485   1HB   ALA  62          1HB       ALA  62 -14.629 -11.564   0.232
  486   2HB   ALA  62          2HB       ALA  62 -15.107 -12.817  -0.913
  487   3HB   ALA  62          3HB       ALA  62 -13.645 -11.872  -1.199
  488    H    ALA  63           H        ALA  63 -16.310  -9.588   0.482
  489    HA   ALA  63           HA       ALA  63 -18.835 -10.933   0.806
  490   1HB   ALA  63          1HB       ALA  63 -17.584  -9.721   2.629
  491   2HB   ALA  63          2HB       ALA  63 -18.056  -8.202   1.867
  492   3HB   ALA  63          3HB       ALA  63 -19.288  -9.283   2.519
  493    H    LEU  64           H        LEU  64 -17.845  -8.764  -1.519
  494    HA   LEU  64           HA       LEU  64 -20.668  -7.892  -2.062
  495   1HB   LEU  64          1HB       LEU  64 -18.134  -6.290  -2.522
  496   2HB   LEU  64          2HB       LEU  64 -19.765  -5.775  -2.938
  497    HG   LEU  64           HG       LEU  64 -19.064  -6.553  -0.103
  498   1HD1  LEU  64          1HD1      LEU  64 -18.631  -3.898  -1.484
  499   2HD1  LEU  64          2HD1      LEU  64 -18.795  -4.041   0.266
  500   3HD1  LEU  64          3HD1      LEU  64 -17.462  -4.844  -0.563
  501   1HD2  LEU  64          1HD2      LEU  64 -21.188  -4.806  -1.393
  502   2HD2  LEU  64          2HD2      LEU  64 -21.435  -6.328  -0.538
  503   3HD2  LEU  64          3HD2      LEU  64 -20.924  -4.894   0.347
  504    HA   PRO  65           HA       PRO  65 -18.789 -10.337  -5.602
  505   1HB   PRO  65          1HB       PRO  65 -21.613 -11.070  -6.062
  506   2HB   PRO  65          2HB       PRO  65 -20.213 -12.120  -5.815
  507   1HG   PRO  65          1HG       PRO  65 -22.236 -11.729  -3.954
  508   2HG   PRO  65          2HG       PRO  65 -20.615 -12.321  -3.568
  509   1HD   PRO  65          1HD       PRO  65 -21.810  -9.673  -2.995
  510   2HD   PRO  65          2HD       PRO  65 -20.384 -10.445  -2.258

  No H/Q in entry =         510
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1  18.965  13.027 -26.241
    2    H2   MET   1           H2       MET   1  19.715  14.549 -26.332
    3    H3   MET   1           H3       MET   1  19.653  13.723 -24.852
    4    HA   MET   1           HA       MET   1  17.575  14.391 -24.393
    5   1HB   MET   1          1HB       MET   1  18.333  16.256 -26.662
    6   2HB   MET   1          2HB       MET   1  16.972  16.531 -25.577
    7   1HG   MET   1          1HG       MET   1  18.535  16.502 -23.645
    8   2HG   MET   1          2HG       MET   1  19.883  16.307 -24.764
    9   1HE   MET   1          1HE       MET   1  20.389  17.695 -26.625
   10   2HE   MET   1          2HE       MET   1  18.915  18.413 -27.291
   11   3HE   MET   1          3HE       MET   1  20.213  19.447 -26.700
   12    H    LYS   2           H        LYS   2  18.138  13.309 -27.601
   13    HA   LYS   2           HA       LYS   2  15.550  13.601 -28.749
   14   1HB   LYS   2          1HB       LYS   2  17.700  11.509 -29.162
   15   2HB   LYS   2          2HB       LYS   2  16.245  11.608 -30.151
   16   1HG   LYS   2          1HG       LYS   2  16.837  13.967 -30.725
   17   2HG   LYS   2          2HG       LYS   2  18.342  13.777 -29.828
   18   1HD   LYS   2          1HD       LYS   2  17.613  11.858 -32.043
   19   2HD   LYS   2          2HD       LYS   2  18.388  13.397 -32.403
   20   1HE   LYS   2          1HE       LYS   2  19.485  11.228 -30.584
   21   2HE   LYS   2          2HE       LYS   2  20.088  11.654 -32.182
   22   1HZ   LYS   2          1HZ       LYS   2  20.035  14.016 -30.797
   23   2HZ   LYS   2          2HZ       LYS   2  20.615  12.889 -29.670
   24   3HZ   LYS   2          3HZ       LYS   2  21.410  13.085 -31.159
   25    H    ALA   3           H        ALA   3  16.934  11.065 -26.684
   26    HA   ALA   3           HA       ALA   3  14.229   9.777 -26.491
   27   1HB   ALA   3          1HB       ALA   3  15.939   8.233 -27.259
   28   2HB   ALA   3          2HB       ALA   3  17.014   8.708 -25.946
   29   3HB   ALA   3          3HB       ALA   3  15.532   7.821 -25.594
   30    H    ILE   4           H        ILE   4  13.483   9.189 -24.354
   31    HA   ILE   4           HA       ILE   4  14.591  10.951 -22.203
   32    HB   ILE   4           HB       ILE   4  11.938   9.478 -22.273
   33   1HG1  ILE   4          1HG1      ILE   4  11.055  11.851 -22.646
   34   2HG1  ILE   4          2HG1      ILE   4  12.712  12.313 -23.017
   35   1HG2  ILE   4          1HG2      ILE   4  12.864  10.077 -20.013
   36   2HG2  ILE   4          2HG2      ILE   4  12.909  11.763 -20.529
   37   3HG2  ILE   4          3HG2      ILE   4  11.366  10.920 -20.398
   38   1HD1  ILE   4          1HD1      ILE   4  11.762   9.930 -24.511
   39   2HD1  ILE   4          2HD1      ILE   4  10.904  11.428 -24.875
   40   3HD1  ILE   4          3HD1      ILE   4  12.651  11.343 -25.073
   41    H    PHE   5           H        PHE   5  15.274  10.070 -20.261
   42    HA   PHE   5           HA       PHE   5  16.408   7.515 -20.180
   43   1HB   PHE   5          1HB       PHE   5  16.886   9.289 -18.529
   44   2HB   PHE   5          2HB       PHE   5  15.266   9.103 -17.858
   45    HD1  PHE   5           HD1      PHE   5  18.633   7.685 -18.071
   46    HD2  PHE   5           HD2      PHE   5  14.626   7.030 -16.673
   47    HE1  PHE   5           HE1      PHE   5  19.443   5.849 -16.613
   48    HE2  PHE   5           HE2      PHE   5  15.433   5.194 -15.216
   49    HZ   PHE   5           HZ       PHE   5  17.843   4.604 -15.184
   50    H    VAL   6           H        VAL   6  15.546   5.519 -20.065
   51    HA   VAL   6           HA       VAL   6  13.165   4.888 -18.542
   52    HB   VAL   6           HB       VAL   6  12.161   5.923 -20.591
   53   1HG1  VAL   6          1HG1      VAL   6  14.121   5.082 -22.048
   54   2HG1  VAL   6          2HG1      VAL   6  13.236   3.558 -22.126
   55   3HG1  VAL   6          3HG1      VAL   6  12.505   5.035 -22.753
   56   1HG2  VAL   6          1HG2      VAL   6  11.239   3.785 -19.281
   57   2HG2  VAL   6          2HG2      VAL   6  10.453   4.345 -20.755
   58   3HG2  VAL   6          3HG2      VAL   6  11.563   2.980 -20.815
   59    H    LEU   7           H        LEU   7  15.909   4.036 -18.698
   60    HA   LEU   7           HA       LEU   7  16.191   1.589 -20.173
   61   1HB   LEU   7          1HB       LEU   7  17.595   2.461 -17.627
   62   2HB   LEU   7          2HB       LEU   7  18.117   1.155 -18.689
   63    HG   LEU   7           HG       LEU   7  17.856   4.069 -19.501
   64   1HD1  LEU   7          1HD1      LEU   7  20.294   2.348 -18.940
   65   2HD1  LEU   7          2HD1      LEU   7  20.339   3.986 -19.592
   66   3HD1  LEU   7          3HD1      LEU   7  19.731   3.702 -17.962
   67   1HD2  LEU   7          1HD2      LEU   7  18.544   1.528 -20.976
   68   2HD2  LEU   7          2HD2      LEU   7  17.560   2.894 -21.506
   69   3HD2  LEU   7          3HD2      LEU   7  19.312   3.040 -21.465
   70    H    ASN   8           H        ASN   8  16.222  -0.598 -19.258
   71    HA   ASN   8           HA       ASN   8  13.870  -1.125 -17.679
   72   1HB   ASN   8          1HB       ASN   8  14.679  -3.492 -17.726
   73   2HB   ASN   8          2HB       ASN   8  14.625  -2.752 -19.326
   74   2HD2  ASN   8          2HD2      ASN   8  16.659  -2.310 -20.402
   75   1HD2  ASN   8          1HD2      ASN   8  18.137  -2.897 -19.808
   76    H    ALA   9           H        ALA   9  14.849   0.471 -15.948
   77    HA   ALA   9           HA       ALA   9  15.707  -1.209 -13.710
   78   1HB   ALA   9          1HB       ALA   9  17.510   0.955 -14.833
   79   2HB   ALA   9          2HB       ALA   9  17.891  -0.756 -14.638
   80   3HB   ALA   9          3HB       ALA   9  17.698   0.271 -13.218
   81    H    GLN  10           H        GLN  10  15.628   0.028 -11.657
   82    HA   GLN  10           HA       GLN  10  13.672   2.275 -11.851
   83   1HB   GLN  10          1HB       GLN  10  13.442   1.815  -9.347
   84   2HB   GLN  10          2HB       GLN  10  12.867   0.545 -10.425
   85   1HG   GLN  10          1HG       GLN  10  15.709   0.485  -9.408
   86   2HG   GLN  10          2HG       GLN  10  14.397  -0.101  -8.392
   87   2HE2  GLN  10          2HE2      GLN  10  13.138  -1.976  -9.194
   88   1HE2  GLN  10          1HE2      GLN  10  13.792  -3.004 -10.375
   89    H    HIS  11           H        HIS  11  14.192   4.312 -11.136
   90    HA   HIS  11           HA       HIS  11  16.931   5.062 -10.844
   91   1HB   HIS  11          1HB       HIS  11  16.050   7.265 -10.160
   92   2HB   HIS  11          2HB       HIS  11  15.181   6.648 -11.565
   93    HD1  HIS  11           HD1      HIS  11  12.874   5.276 -10.892
   94    HD2  HIS  11           HD2      HIS  11  14.370   7.969  -8.085
   95    HE1  HIS  11           HE1      HIS  11  10.969   5.786  -9.302
   96    H    ASP  12           H        ASP  12  14.387   4.405  -8.462
   97    HA   ASP  12           HA       ASP  12  16.069   5.098  -6.188
   98   1HB   ASP  12          1HB       ASP  12  13.449   3.593  -6.435
   99   2HB   ASP  12          2HB       ASP  12  14.230   3.929  -4.890
  100    H    GLU  13           H        GLU  13  17.285   3.692  -4.917
  101    HA   GLU  13           HA       GLU  13  18.273   1.287  -6.114
  102   1HB   GLU  13          1HB       GLU  13  18.423   2.339  -3.277
  103   2HB   GLU  13          2HB       GLU  13  19.269   0.888  -3.816
  104   1HG   GLU  13          1HG       GLU  13  19.580   3.597  -5.138
  105   2HG   GLU  13          2HG       GLU  13  20.669   2.987  -3.892
  106    H    ALA  14           H        ALA  14  15.827   1.859  -3.592
  107    HA   ALA  14           HA       ALA  14  15.415  -0.938  -3.007
  108   1HB   ALA  14          1HB       ALA  14  13.382   1.283  -2.680
  109   2HB   ALA  14          2HB       ALA  14  14.716   1.033  -1.555
  110   3HB   ALA  14          3HB       ALA  14  13.492  -0.220  -1.764
  111    H    VAL  15           H        VAL  15  14.036  -2.404  -3.977
  112    HA   VAL  15           HA       VAL  15  13.205  -1.972  -6.668
  113    HB   VAL  15           HB       VAL  15  13.601  -4.211  -5.559
  114   1HG1  VAL  15          1HG1      VAL  15  12.150  -3.590  -3.544
  115   2HG1  VAL  15          2HG1      VAL  15  10.758  -3.907  -4.580
  116   3HG1  VAL  15          3HG1      VAL  15  11.898  -5.202  -4.216
  117   1HG2  VAL  15          1HG2      VAL  15  12.447  -3.899  -7.769
  118   2HG2  VAL  15          2HG2      VAL  15  11.933  -5.348  -6.904
  119   3HG2  VAL  15          3HG2      VAL  15  10.905  -3.915  -6.912
  120    H    ASP  16           H        ASP  16  11.432  -1.750  -3.600
  121    HA   ASP  16           HA       ASP  16   9.204  -0.359  -5.060
  122   1HB   ASP  16          1HB       ASP  16   9.032  -2.397  -2.823
  123   2HB   ASP  16          2HB       ASP  16   7.680  -1.379  -3.317
  124    H    ALA  17           H        ALA  17   8.463   1.509  -4.064
  125    HA   ALA  17           HA       ALA  17   9.104   2.103  -1.272
  126   1HB   ALA  17          1HB       ALA  17  11.234   2.745  -2.159
  127   2HB   ALA  17          2HB       ALA  17  10.332   4.244  -1.936
  128   3HB   ALA  17          3HB       ALA  17  10.489   3.540  -3.546
  129    H    ASN  18           H        ASN  18   8.743   4.385  -3.957
  130    HA   ASN  18           HA       ASN  18   6.640   5.851  -2.723
  131   1HB   ASN  18          1HB       ASN  18   8.032   6.764  -4.546
  132   2HB   ASN  18          2HB       ASN  18   7.310   5.615  -5.673
  133   2HD2  ASN  18          2HD2      ASN  18   6.626   8.497  -3.704
  134   1HD2  ASN  18          1HD2      ASN  18   5.179   8.901  -4.493
  135    H    SER  19           H        SER  19   6.565   3.185  -5.065
  136    HA   SER  19           HA       SER  19   3.808   3.206  -5.669
  137   1HB   SER  19          1HB       SER  19   4.081   0.893  -6.317
  138   2HB   SER  19          2HB       SER  19   5.555   1.756  -6.748
  139    HG   SER  19           HG       SER  19   5.870  -0.274  -5.618
  140    H    LEU  20           H        LEU  20   5.473   2.024  -2.792
  141    HA   LEU  20           HA       LEU  20   3.375   0.427  -1.728
  142   1HB   LEU  20          1HB       LEU  20   5.625   0.414  -0.757
  143   2HB   LEU  20          2HB       LEU  20   5.451   2.101  -0.278
  144    HG   LEU  20           HG       LEU  20   3.591   1.494   1.232
  145   1HD1  LEU  20          1HD1      LEU  20   4.053  -1.226   0.014
  146   2HD1  LEU  20          2HD1      LEU  20   3.387  -1.086   1.641
  147   3HD1  LEU  20          3HD1      LEU  20   2.531  -0.373   0.275
  148   1HD2  LEU  20          1HD2      LEU  20   6.106  -0.172   1.558
  149   2HD2  LEU  20          2HD2      LEU  20   5.849   1.469   2.150
  150   3HD2  LEU  20          3HD2      LEU  20   4.936   0.130   2.842
  151    H    ALA  21           H        ALA  21   4.082   3.896  -1.203
  152    HA   ALA  21           HA       ALA  21   1.749   4.321   0.414
  153   1HB   ALA  21          1HB       ALA  21   3.613   6.159  -1.086
  154   2HB   ALA  21          2HB       ALA  21   3.472   5.927   0.657
  155   3HB   ALA  21          3HB       ALA  21   2.205   6.782  -0.223
  156    H    GLU  22           H        GLU  22   2.430   4.715  -3.048
  157    HA   GLU  22           HA       GLU  22  -0.022   5.961  -3.777
  158   1HB   GLU  22          1HB       GLU  22   1.944   5.751  -5.287
  159   2HB   GLU  22          2HB       GLU  22   1.632   4.021  -5.416
  160   1HG   GLU  22          1HG       GLU  22  -0.589   4.476  -6.369
  161   2HG   GLU  22          2HG       GLU  22  -0.303   6.211  -6.225
  162    H    ALA  23           H        ALA  23   0.825   2.523  -3.419
  163    HA   ALA  23           HA       ALA  23  -1.550   1.399  -4.471
  164   1HB   ALA  23          1HB       ALA  23  -1.037  -0.560  -3.096
  165   2HB   ALA  23          2HB       ALA  23   0.460   0.090  -3.767
  166   3HB   ALA  23          3HB       ALA  23   0.038   0.403  -2.083
  167    H    LYS  24           H        LYS  24  -0.843   2.614  -1.202
  168    HA   LYS  24           HA       LYS  24  -3.417   1.909  -0.110
  169   1HB   LYS  24          1HB       LYS  24  -1.381   4.001   0.716
  170   2HB   LYS  24          2HB       LYS  24  -2.812   3.588   1.664
  171   1HG   LYS  24          1HG       LYS  24  -2.050   1.246   1.803
  172   2HG   LYS  24          2HG       LYS  24  -0.616   1.656   0.861
  173   1HD   LYS  24          1HD       LYS  24   0.074   3.262   2.601
  174   2HD   LYS  24          2HD       LYS  24  -1.357   2.851   3.547
  175   1HE   LYS  24          1HE       LYS  24  -0.600   0.588   3.857
  176   2HE   LYS  24          2HE       LYS  24   0.712   0.810   2.698
  177   1HZ   LYS  24          1HZ       LYS  24   1.032   2.822   4.530
  178   2HZ   LYS  24          2HZ       LYS  24   0.622   1.466   5.468
  179   3HZ   LYS  24          3HZ       LYS  24   1.956   1.404   4.419
  180    H    VAL  25           H        VAL  25  -2.103   4.816  -1.668
  181    HA   VAL  25           HA       VAL  25  -4.413   6.468  -1.275
  182    HB   VAL  25           HB       VAL  25  -2.235   6.511  -3.377
  183   1HG1  VAL  25          1HG1      VAL  25  -4.526   8.414  -2.863
  184   2HG1  VAL  25          2HG1      VAL  25  -3.053   8.915  -3.695
  185   3HG1  VAL  25          3HG1      VAL  25  -4.070   7.649  -4.387
  186   1HG2  VAL  25          1HG2      VAL  25  -1.554   6.948  -1.025
  187   2HG2  VAL  25          2HG2      VAL  25  -1.375   8.381  -2.038
  188   3HG2  VAL  25          3HG2      VAL  25  -2.748   8.242  -0.939
  189    H    LEU  26           H        LEU  26  -3.388   4.482  -4.074
  190    HA   LEU  26           HA       LEU  26  -5.719   4.994  -5.648
  191   1HB   LEU  26          1HB       LEU  26  -3.783   2.666  -5.611
  192   2HB   LEU  26          2HB       LEU  26  -5.061   2.835  -6.811
  193    HG   LEU  26           HG       LEU  26  -2.932   4.926  -6.285
  194   1HD1  LEU  26          1HD1      LEU  26  -2.002   2.785  -7.167
  195   2HD1  LEU  26          2HD1      LEU  26  -3.103   2.906  -8.540
  196   3HD1  LEU  26          3HD1      LEU  26  -1.840   4.117  -8.314
  197   1HD2  LEU  26          1HD2      LEU  26  -5.250   4.688  -8.193
  198   2HD2  LEU  26          2HD2      LEU  26  -4.631   6.108  -7.354
  199   3HD2  LEU  26          3HD2      LEU  26  -3.784   5.481  -8.762
  200    H    ALA  27           H        ALA  27  -4.987   2.475  -3.258
  201    HA   ALA  27           HA       ALA  27  -7.395   0.969  -3.661
  202   1HB   ALA  27          1HB       ALA  27  -5.274   0.277  -2.378
  203   2HB   ALA  27          2HB       ALA  27  -5.927   1.206  -1.029
  204   3HB   ALA  27          3HB       ALA  27  -6.818  -0.180  -1.660
  205    H    ASN  28           H        ASN  28  -6.589   3.726  -1.590
  206    HA   ASN  28           HA       ASN  28  -8.957   3.770  -0.014
  207   1HB   ASN  28          1HB       ASN  28  -6.829   5.181   0.249
  208   2HB   ASN  28          2HB       ASN  28  -7.507   6.238  -0.989
  209   2HD2  ASN  28          2HD2      ASN  28  -7.698   5.328   2.370
  210   1HD2  ASN  28          1HD2      ASN  28  -8.955   6.385   2.795
  211    H    ARG  29           H        ARG  29  -8.267   5.160  -3.205
  212    HA   ARG  29           HA       ARG  29 -10.668   6.643  -3.526
  213   1HB   ARG  29          1HB       ARG  29  -8.876   5.279  -5.549
  214   2HB   ARG  29          2HB       ARG  29 -10.220   6.328  -6.001
  215   1HG   ARG  29          1HG       ARG  29  -9.222   8.174  -4.700
  216   2HG   ARG  29          2HG       ARG  29  -7.875   7.128  -4.250
  217   1HD   ARG  29          1HD       ARG  29  -7.279   6.867  -6.632
  218   2HD   ARG  29          2HD       ARG  29  -8.622   7.919  -7.082
  219    HE   ARG  29           HE       ARG  29  -7.153   9.451  -5.302
  220   1HH1  ARG  29          1HH1      ARG  29  -5.474  10.813  -5.961
  221   2HH1  ARG  29          2HH1      ARG  29  -4.638  10.480  -7.441
  222   1HH2  ARG  29          1HH2      ARG  29  -6.513   7.660  -8.180
  223   2HH2  ARG  29          2HH2      ARG  29  -5.225   8.697  -8.696
  224    H    GLU  30           H        GLU  30  -9.966   3.224  -4.224
  225    HA   GLU  30           HA       GLU  30 -12.398   2.617  -5.559
  226   1HB   GLU  30          1HB       GLU  30 -10.605   0.912  -3.812
  227   2HB   GLU  30          2HB       GLU  30 -11.970   0.263  -4.723
  228   1HG   GLU  30          1HG       GLU  30 -10.981   1.093  -6.819
  229   2HG   GLU  30          2HG       GLU  30  -9.622   1.766  -5.919
  230    H    LEU  31           H        LEU  31 -11.632   2.664  -2.081
  231    HA   LEU  31           HA       LEU  31 -14.093   1.556  -1.156
  232   1HB   LEU  31          1HB       LEU  31 -12.679   3.796   0.308
  233   2HB   LEU  31          2HB       LEU  31 -13.519   2.396   0.977
  234    HG   LEU  31           HG       LEU  31 -10.888   2.413  -0.507
  235   1HD1  LEU  31          1HD1      LEU  31 -11.717   1.865   2.350
  236   2HD1  LEU  31          2HD1      LEU  31 -10.165   1.341   1.704
  237   3HD1  LEU  31          3HD1      LEU  31 -10.558   3.057   1.763
  238   1HD2  LEU  31          1HD2      LEU  31 -12.679   0.143   0.400
  239   2HD2  LEU  31          2HD2      LEU  31 -12.007   0.418  -1.207
  240   3HD2  LEU  31          3HD2      LEU  31 -10.953  -0.085   0.115
  241    H    ASP  32           H        ASP  32 -13.107   4.927  -1.637
  242    HA   ASP  32           HA       ASP  32 -15.610   6.129  -1.017
  243   1HB   ASP  32          1HB       ASP  32 -13.229   6.902  -2.698
  244   2HB   ASP  32          2HB       ASP  32 -14.647   7.956  -2.623
  245    H    LYS  33           H        LYS  33 -14.273   4.836  -4.034
  246    HA   LYS  33           HA       LYS  33 -16.383   5.630  -5.780
  247   1HB   LYS  33          1HB       LYS  33 -14.220   4.702  -6.544
  248   2HB   LYS  33          2HB       LYS  33 -14.645   3.144  -5.848
  249   1HG   LYS  33          1HG       LYS  33 -16.577   2.982  -7.367
  250   2HG   LYS  33          2HG       LYS  33 -16.152   4.546  -8.070
  251   1HD   LYS  33          1HD       LYS  33 -14.015   3.676  -8.839
  252   2HD   LYS  33          2HD       LYS  33 -14.307   2.140  -8.022
  253   1HE   LYS  33          1HE       LYS  33 -16.284   1.767  -9.462
  254   2HE   LYS  33          2HE       LYS  33 -15.946   3.279 -10.301
  255   1HZ   LYS  33          1HZ       LYS  33 -13.673   1.528 -10.128
  256   2HZ   LYS  33          2HZ       LYS  33 -14.970   0.853 -10.994
  257   3HZ   LYS  33          3HZ       LYS  33 -14.316   2.342 -11.474
  258    H    TYR  34           H        TYR  34 -15.913   2.579  -3.957
  259    HA   TYR  34           HA       TYR  34 -18.512   1.529  -4.674
  260   1HB   TYR  34          1HB       TYR  34 -16.565   0.786  -2.475
  261   2HB   TYR  34          2HB       TYR  34 -18.072  -0.080  -2.770
  262    HD1  TYR  34           HD1      TYR  34 -18.470  -0.699  -5.360
  263    HD2  TYR  34           HD2      TYR  34 -14.642  -0.047  -3.520
  264    HE1  TYR  34           HE1      TYR  34 -17.380  -2.011  -7.157
  265    HE2  TYR  34           HE2      TYR  34 -13.556  -1.355  -5.319
  266    HH   TYR  34           HH       TYR  34 -14.989  -2.078  -8.194
  267    H    GLY  35           H        GLY  35 -17.243   3.294  -1.872
  268   1HA   GLY  35          1HA       GLY  35 -20.021   4.038  -1.137
  269   2HA   GLY  35          2HA       GLY  35 -18.550   4.786  -0.512
  270    H    VAL  36           H        VAL  36 -17.342   2.080  -0.022
  271    HA   VAL  36           HA       VAL  36 -19.019   0.654   1.832
  272    HB   VAL  36           HB       VAL  36 -16.913  -0.482   2.485
  273   1HG1  VAL  36          1HG1      VAL  36 -17.478  -0.052  -0.454
  274   2HG1  VAL  36          2HG1      VAL  36 -16.323  -1.254   0.123
  275   3HG1  VAL  36          3HG1      VAL  36 -18.025  -1.380   0.570
  276   1HG2  VAL  36          1HG2      VAL  36 -15.423   1.484   2.336
  277   2HG2  VAL  36          2HG2      VAL  36 -14.822   0.159   1.342
  278   3HG2  VAL  36          3HG2      VAL  36 -15.651   1.518   0.588
  279    H    SER  37           H        SER  37 -17.876   0.314   4.177
  280    HA   SER  37           HA       SER  37 -18.430   2.682   5.647
  281   1HB   SER  37          1HB       SER  37 -18.491   0.439   6.663
  282   2HB   SER  37          2HB       SER  37 -16.748   0.296   6.466
  283    HG   SER  37           HG       SER  37 -16.459   1.587   8.115
  284    H    ASP  38           H        ASP  38 -17.129   4.319   6.410
  285    HA   ASP  38           HA       ASP  38 -14.656   4.857   5.025
  286   1HB   ASP  38          1HB       ASP  38 -16.096   6.680   5.774
  287   2HB   ASP  38          2HB       ASP  38 -15.905   6.176   7.453
  288    H    TYR  39           H        TYR  39 -15.407   3.130   7.919
  289    HA   TYR  39           HA       TYR  39 -13.032   3.534   9.421
  290   1HB   TYR  39          1HB       TYR  39 -14.926   2.382  10.394
  291   2HB   TYR  39          2HB       TYR  39 -14.825   1.102   9.186
  292    HD1  TYR  39           HD1      TYR  39 -13.295   2.528  12.223
  293    HD2  TYR  39           HD2      TYR  39 -13.055  -0.568   9.257
  294    HE1  TYR  39           HE1      TYR  39 -11.681   1.291  13.644
  295    HE2  TYR  39           HE2      TYR  39 -11.445  -1.805  10.673
  296    HH   TYR  39           HH       TYR  39 -10.879  -1.928  13.136
  297    H    TYR  40           H        TYR  40 -13.730   1.038   6.952
  298    HA   TYR  40           HA       TYR  40 -11.302  -0.369   7.116
  299   1HB   TYR  40          1HB       TYR  40 -12.938   0.206   4.631
  300   2HB   TYR  40          2HB       TYR  40 -11.724  -1.061   4.783
  301    HD1  TYR  40           HD1      TYR  40 -12.064  -2.558   7.039
  302    HD2  TYR  40           HD2      TYR  40 -15.160  -0.467   4.910
  303    HE1  TYR  40           HE1      TYR  40 -13.761  -4.083   8.006
  304    HE2  TYR  40           HE2      TYR  40 -16.853  -1.996   5.879
  305    HH   TYR  40           HH       TYR  40 -16.831  -3.513   8.230
  306    H    LYS  41           H        LYS  41 -11.796   2.848   5.833
  307    HA   LYS  41           HA       LYS  41  -9.510   2.802   4.074
  308   1HB   LYS  41          1HB       LYS  41  -9.984   5.034   3.652
  309   2HB   LYS  41          2HB       LYS  41 -11.543   4.511   4.273
  310   1HG   LYS  41          1HG       LYS  41 -10.728   5.277   6.579
  311   2HG   LYS  41          2HG       LYS  41  -9.374   6.031   5.750
  312   1HD   LYS  41          1HD       LYS  41 -12.216   6.610   4.905
  313   2HD   LYS  41          2HD       LYS  41 -11.470   7.485   6.239
  314   1HE   LYS  41          1HE       LYS  41 -10.375   7.309   3.417
  315   2HE   LYS  41          2HE       LYS  41 -11.178   8.709   4.124
  316   1HZ   LYS  41          1HZ       LYS  41  -9.423   8.665   5.874
  317   2HZ   LYS  41          2HZ       LYS  41  -8.604   7.494   4.955
  318   3HZ   LYS  41          3HZ       LYS  41  -8.859   9.051   4.322
  319    H    ASN  42           H        ASN  42  -9.981   3.719   7.459
  320    HA   ASN  42           HA       ASN  42  -7.286   4.655   7.806
  321   1HB   ASN  42          1HB       ASN  42  -7.785   4.538  10.228
  322   2HB   ASN  42          2HB       ASN  42  -9.081   5.335   9.337
  323   2HD2  ASN  42          2HD2      ASN  42 -10.880   4.737  10.630
  324   1HD2  ASN  42          1HD2      ASN  42 -11.337   3.126  10.911
  325    H    LEU  43           H        LEU  43  -8.791   1.508   7.908
  326    HA   LEU  43           HA       LEU  43  -6.745   0.142   9.377
  327   1HB   LEU  43          1HB       LEU  43  -8.972  -0.831   8.967
  328   2HB   LEU  43          2HB       LEU  43  -8.628  -0.905   7.242
  329    HG   LEU  43           HG       LEU  43  -6.758  -2.457   7.673
  330   1HD1  LEU  43          1HD1      LEU  43  -7.535  -1.930  10.541
  331   2HD1  LEU  43          2HD1      LEU  43  -6.795  -3.468  10.097
  332   3HD1  LEU  43          3HD1      LEU  43  -5.926  -1.964   9.816
  333   1HD2  LEU  43          1HD2      LEU  43  -9.224  -3.185   7.413
  334   2HD2  LEU  43          2HD2      LEU  43  -8.104  -4.370   8.087
  335   3HD2  LEU  43          3HD2      LEU  43  -9.190  -3.478   9.151
  336    H    ILE  44           H        ILE  44  -7.158   0.824   5.906
  337    HA   ILE  44           HA       ILE  44  -4.909  -0.701   4.999
  338    HB   ILE  44           HB       ILE  44  -6.260   1.769   3.887
  339   1HG1  ILE  44          1HG1      ILE  44  -6.275  -1.101   2.940
  340   2HG1  ILE  44          2HG1      ILE  44  -7.481  -0.460   4.056
  341   1HG2  ILE  44          1HG2      ILE  44  -4.031   0.064   2.761
  342   2HG2  ILE  44          2HG2      ILE  44  -5.068   1.058   1.740
  343   3HG2  ILE  44          3HG2      ILE  44  -4.050   1.814   2.967
  344   1HD1  ILE  44          1HD1      ILE  44  -7.864   1.375   2.270
  345   2HD1  ILE  44          2HD1      ILE  44  -6.983   0.301   1.181
  346   3HD1  ILE  44          3HD1      ILE  44  -8.480  -0.241   1.935
  347    H    ASN  45           H        ASN  45  -5.227   2.616   6.170
  348    HA   ASN  45           HA       ASN  45  -2.561   3.467   5.655
  349   1HB   ASN  45          1HB       ASN  45  -4.567   4.232   7.793
  350   2HB   ASN  45          2HB       ASN  45  -3.003   5.030   7.628
  351   2HD2  ASN  45          2HD2      ASN  45  -3.807   4.147   4.528
  352   1HD2  ASN  45          1HD2      ASN  45  -4.606   5.559   4.030
  353    H    ASN  46           H        ASN  46  -4.008   1.642   8.323
  354    HA   ASN  46           HA       ASN  46  -1.632   1.629   9.968
  355   1HB   ASN  46          1HB       ASN  46  -4.076  -0.159   9.889
  356   2HB   ASN  46          2HB       ASN  46  -2.796  -0.320  11.094
  357   2HD2  ASN  46          2HD2      ASN  46  -5.524   0.421  11.768
  358   1HD2  ASN  46          1HD2      ASN  46  -5.487   2.004  12.381
  359    H    ALA  47           H        ALA  47  -2.612  -0.151   7.160
  360    HA   ALA  47           HA       ALA  47  -1.048  -2.524   7.585
  361   1HB   ALA  47          1HB       ALA  47  -2.855  -2.122   5.802
  362   2HB   ALA  47          2HB       ALA  47  -1.412  -2.988   5.276
  363   3HB   ALA  47          3HB       ALA  47  -1.607  -1.279   4.886
  364    H    LYS  48           H        LYS  48   1.126  -2.853   7.355
  365    HA   LYS  48           HA       LYS  48   2.794  -0.550   6.400
  366   1HB   LYS  48          1HB       LYS  48   3.396  -2.810   8.324
  367   2HB   LYS  48          2HB       LYS  48   4.620  -1.696   7.712
  368   1HG   LYS  48          1HG       LYS  48   3.348   0.213   8.624
  369   2HG   LYS  48          2HG       LYS  48   2.125  -0.899   9.238
  370   1HD   LYS  48          1HD       LYS  48   3.823  -1.993  10.655
  371   2HD   LYS  48          2HD       LYS  48   5.049  -0.880  10.045
  372   1HE   LYS  48          1HE       LYS  48   3.784   1.028  10.951
  373   2HE   LYS  48          2HE       LYS  48   2.540  -0.071  11.545
  374   1HZ   LYS  48          1HZ       LYS  48   5.368  -0.403  12.326
  375   2HZ   LYS  48          2HZ       LYS  48   4.352   0.674  13.157
  376   3HZ   LYS  48          3HZ       LYS  48   3.973  -0.978  13.108
  377    H    THR  49           H        THR  49   1.514  -3.126   5.033
  378    HA   THR  49           HA       THR  49   3.905  -3.565   3.328
  379    HB   THR  49           HB       THR  49   2.319  -5.969   4.237
  380    HG1  THR  49           HG1      THR  49   4.028  -6.242   5.789
  381   1HG2  THR  49          1HG2      THR  49   3.856  -6.090   2.276
  382   2HG2  THR  49          2HG2      THR  49   5.183  -5.597   3.327
  383   3HG2  THR  49          3HG2      THR  49   4.366  -7.136   3.602
  384    H    VAL  50           H        VAL  50   3.374  -4.018   1.193
  385    HA   VAL  50           HA       VAL  50   0.727  -3.273   0.323
  386    HB   VAL  50           HB       VAL  50   2.687  -2.801  -1.034
  387   1HG1  VAL  50          1HG1      VAL  50   3.917  -4.894  -0.336
  388   2HG1  VAL  50          2HG1      VAL  50   2.896  -5.791  -1.459
  389   3HG1  VAL  50          3HG1      VAL  50   3.995  -4.553  -2.065
  390   1HG2  VAL  50          1HG2      VAL  50   0.426  -3.236  -2.095
  391   2HG2  VAL  50          2HG2      VAL  50   1.804  -3.478  -3.170
  392   3HG2  VAL  50          3HG2      VAL  50   0.991  -4.869  -2.454
  393    H    GLU  51           H        GLU  51   2.359  -6.412   0.715
  394    HA   GLU  51           HA       GLU  51   0.498  -7.980  -0.737
  395   1HB   GLU  51          1HB       GLU  51   1.256  -9.871   0.562
  396   2HB   GLU  51          2HB       GLU  51   2.648  -8.822   0.305
  397   1HG   GLU  51          1HG       GLU  51   2.183  -7.791   2.565
  398   2HG   GLU  51          2HG       GLU  51   0.963  -9.039   2.817
  399    H    GLY  52           H        GLY  52   0.401  -6.689   2.536
  400   1HA   GLY  52          1HA       GLY  52  -1.352  -6.604   4.096
  401   2HA   GLY  52          2HA       GLY  52  -2.091  -7.968   3.255
  402    H    VAL  53           H        VAL  53  -1.208  -4.859   1.751
  403    HA   VAL  53           HA       VAL  53  -3.806  -3.666   1.935
  404    HB   VAL  53           HB       VAL  53  -1.604  -3.286  -0.117
  405   1HG1  VAL  53          1HG1      VAL  53  -4.191  -1.791   0.364
  406   2HG1  VAL  53          2HG1      VAL  53  -2.828  -1.075  -0.492
  407   3HG1  VAL  53          3HG1      VAL  53  -3.622  -2.508  -1.143
  408   1HG2  VAL  53          1HG2      VAL  53  -1.151  -2.730   2.318
  409   2HG2  VAL  53          2HG2      VAL  53  -0.997  -1.367   1.209
  410   3HG2  VAL  53          3HG2      VAL  53  -2.439  -1.534   2.208
  411    H    LYS  54           H        LYS  54  -2.309  -5.582  -0.685
  412    HA   LYS  54           HA       LYS  54  -4.611  -5.540  -2.391
  413   1HB   LYS  54          1HB       LYS  54  -2.257  -6.171  -3.056
  414   2HB   LYS  54          2HB       LYS  54  -2.506  -7.711  -2.235
  415   1HG   LYS  54          1HG       LYS  54  -4.436  -8.185  -3.693
  416   2HG   LYS  54          2HG       LYS  54  -4.192  -6.643  -4.518
  417   1HD   LYS  54          1HD       LYS  54  -1.907  -7.381  -5.166
  418   2HD   LYS  54          2HD       LYS  54  -2.221  -8.944  -4.412
  419   1HE   LYS  54          1HE       LYS  54  -2.621  -8.976  -6.872
  420   2HE   LYS  54          2HE       LYS  54  -4.075  -9.353  -5.947
  421   1HZ   LYS  54          1HZ       LYS  54  -3.449  -6.598  -6.819
  422   2HZ   LYS  54          2HZ       LYS  54  -4.297  -7.681  -7.817
  423   3HZ   LYS  54          3HZ       LYS  54  -4.939  -7.229  -6.310
  424    H    ALA  55           H        ALA  55  -3.555  -7.801   0.139
  425    HA   ALA  55           HA       ALA  55  -5.711  -9.687  -0.294
  426   1HB   ALA  55          1HB       ALA  55  -3.883  -9.183   2.063
  427   2HB   ALA  55          2HB       ALA  55  -3.747 -10.466   0.862
  428   3HB   ALA  55          3HB       ALA  55  -5.075 -10.482   2.023
  429    H    LEU  56           H        LEU  56  -5.582  -6.589   1.180
  430    HA   LEU  56           HA       LEU  56  -7.819  -7.123   2.965
  431   1HB   LEU  56          1HB       LEU  56  -6.073  -5.331   3.364
  432   2HB   LEU  56          2HB       LEU  56  -6.801  -4.432   2.036
  433    HG   LEU  56           HG       LEU  56  -9.032  -4.731   3.331
  434   1HD1  LEU  56          1HD1      LEU  56  -7.003  -5.396   5.475
  435   2HD1  LEU  56          2HD1      LEU  56  -8.612  -4.786   5.842
  436   3HD1  LEU  56          3HD1      LEU  56  -8.429  -6.323   5.011
  437   1HD2  LEU  56          1HD2      LEU  56  -6.785  -2.942   4.286
  438   2HD2  LEU  56          2HD2      LEU  56  -8.048  -2.558   3.113
  439   3HD2  LEU  56          3HD2      LEU  56  -8.458  -2.760   4.814
  440    H    ILE  57           H        ILE  57  -7.558  -4.760   0.274
  441    HA   ILE  57           HA       ILE  57 -10.266  -4.378  -0.198
  442    HB   ILE  57           HB       ILE  57  -8.358  -4.797  -2.508
  443   1HG1  ILE  57          1HG1      ILE  57  -7.089  -3.488  -0.919
  444   2HG1  ILE  57          2HG1      ILE  57  -7.714  -2.374  -2.134
  445   1HG2  ILE  57          1HG2      ILE  57 -10.839  -4.226  -2.793
  446   2HG2  ILE  57          2HG2      ILE  57 -10.445  -2.652  -2.107
  447   3HG2  ILE  57          3HG2      ILE  57  -9.686  -3.173  -3.611
  448   1HD1  ILE  57          1HD1      ILE  57  -9.718  -2.063  -0.507
  449   2HD1  ILE  57          2HD1      ILE  57  -8.652  -2.783   0.699
  450   3HD1  ILE  57          3HD1      ILE  57  -8.188  -1.285  -0.107
  451    H    ASP  58           H        ASP  58  -8.260  -7.058  -1.384
  452    HA   ASP  58           HA       ASP  58 -10.249  -8.299  -2.994
  453   1HB   ASP  58          1HB       ASP  58  -7.932  -9.465  -1.422
  454   2HB   ASP  58          2HB       ASP  58  -8.923 -10.409  -2.536
  455    H    GLU  59           H        GLU  59  -9.523  -8.549   0.485
  456    HA   GLU  59           HA       GLU  59 -11.667 -10.492   0.851
  457   1HB   GLU  59          1HB       GLU  59 -10.820 -10.859   2.964
  458   2HB   GLU  59          2HB       GLU  59  -9.388 -10.207   2.181
  459   1HG   GLU  59          1HG       GLU  59  -9.922  -7.986   3.089
  460   2HG   GLU  59          2HG       GLU  59 -11.322  -8.660   3.914
  461    H    ILE  60           H        ILE  60 -11.324  -6.993   1.174
  462    HA   ILE  60           HA       ILE  60 -13.750  -6.633   2.712
  463    HB   ILE  60           HB       ILE  60 -12.738  -4.664   0.635
  464   1HG1  ILE  60          1HG1      ILE  60 -10.823  -5.153   1.948
  465   2HG1  ILE  60          2HG1      ILE  60 -11.458  -3.641   2.554
  466   1HG2  ILE  60          1HG2      ILE  60 -14.945  -4.263   1.717
  467   2HG2  ILE  60          2HG2      ILE  60 -14.150  -4.283   3.291
  468   3HG2  ILE  60          3HG2      ILE  60 -13.759  -3.022   2.122
  469   1HD1  ILE  60          1HD1      ILE  60 -12.744  -5.173   4.242
  470   2HD1  ILE  60          2HD1      ILE  60 -11.519  -6.361   3.803
  471   3HD1  ILE  60          3HD1      ILE  60 -11.037  -4.828   4.517
  472    H    LEU  61           H        LEU  61 -13.013  -6.452  -0.743
  473    HA   LEU  61           HA       LEU  61 -15.677  -6.048  -1.657
  474   1HB   LEU  61          1HB       LEU  61 -13.243  -7.261  -3.004
  475   2HB   LEU  61          2HB       LEU  61 -14.737  -6.861  -3.857
  476    HG   LEU  61           HG       LEU  61 -13.050  -4.892  -2.279
  477   1HD1  LEU  61          1HD1      LEU  61 -13.320  -5.323  -5.271
  478   2HD1  LEU  61          2HD1      LEU  61 -12.419  -4.012  -4.507
  479   3HD1  LEU  61          3HD1      LEU  61 -11.893  -5.683  -4.298
  480   1HD2  LEU  61          1HD2      LEU  61 -15.654  -4.698  -3.774
  481   2HD2  LEU  61          2HD2      LEU  61 -15.155  -3.898  -2.283
  482   3HD2  LEU  61          3HD2      LEU  61 -14.554  -3.324  -3.832
  483    H    ALA  62           H        ALA  62 -13.822  -9.028  -1.097
  484    HA   ALA  62           HA       ALA  62 -15.749 -10.829  -2.199
  485   1HB   ALA  62          1HB       ALA  62 -13.757 -11.233   0.052
  486   2HB   ALA  62          2HB       ALA  62 -13.487 -11.572  -1.657
  487   3HB   ALA  62          3HB       ALA  62 -14.649 -12.531  -0.741
  488    H    ALA  63           H        ALA  63 -15.654  -9.049   0.782
  489    HA   ALA  63           HA       ALA  63 -17.390 -10.629   2.382
  490   1HB   ALA  63          1HB       ALA  63 -16.046  -8.552   3.055
  491   2HB   ALA  63          2HB       ALA  63 -17.370  -7.607   2.373
  492   3HB   ALA  63          3HB       ALA  63 -17.667  -8.690   3.733
  493    H    LEU  64           H        LEU  64 -18.109  -8.188  -0.100
  494    HA   LEU  64           HA       LEU  64 -20.896  -7.985   0.357
  495   1HB   LEU  64          1HB       LEU  64 -19.426  -7.844  -2.292
  496   2HB   LEU  64          2HB       LEU  64 -21.026  -7.184  -1.975
  497    HG   LEU  64           HG       LEU  64 -18.581  -6.351  -0.398
  498   1HD1  LEU  64          1HD1      LEU  64 -18.217  -5.853  -2.786
  499   2HD1  LEU  64          2HD1      LEU  64 -19.776  -5.031  -2.851
  500   3HD1  LEU  64          3HD1      LEU  64 -18.473  -4.372  -1.863
  501   1HD2  LEU  64          1HD2      LEU  64 -21.392  -5.274  -0.741
  502   2HD2  LEU  64          2HD2      LEU  64 -20.572  -5.727   0.753
  503   3HD2  LEU  64          3HD2      LEU  64 -20.084  -4.275  -0.113
  504    HA   PRO  65           HA       PRO  65 -22.341 -12.025  -0.898
  505   1HB   PRO  65          1HB       PRO  65 -24.760 -11.221  -2.136
  506   2HB   PRO  65          2HB       PRO  65 -24.538 -11.612  -0.426
  507   1HG   PRO  65          1HG       PRO  65 -24.814  -8.961  -1.718
  508   2HG   PRO  65          2HG       PRO  65 -25.143  -9.434  -0.046
  509   1HD   PRO  65          1HD       PRO  65 -22.926  -7.939  -0.878
  510   2HD   PRO  65          2HD       PRO  65 -23.024  -8.847   0.652

  No H/Q in entry =         510
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1  27.654  14.829  -0.892
    2    H2   MET   1           H2       MET   1  26.833  16.252  -1.324
    3    H3   MET   1           H3       MET   1  27.865  15.492  -2.440
    4    HA   MET   1           HA       MET   1  29.338  17.028  -1.757
    5   1HB   MET   1          1HB       MET   1  29.168  18.120   0.479
    6   2HB   MET   1          2HB       MET   1  27.674  18.251  -0.449
    7   1HG   MET   1          1HG       MET   1  26.855  16.178   0.760
    8   2HG   MET   1          2HG       MET   1  28.269  16.316   1.804
    9   1HE   MET   1          1HE       MET   1  25.435  18.430   0.192
   10   2HE   MET   1          2HE       MET   1  24.682  17.231   1.239
   11   3HE   MET   1          3HE       MET   1  24.545  18.953   1.618
   12    H    LYS   2           H        LYS   2  31.164  17.101   0.033
   13    HA   LYS   2           HA       LYS   2  31.858  14.264   0.661
   14   1HB   LYS   2          1HB       LYS   2  33.540  16.786   0.515
   15   2HB   LYS   2          2HB       LYS   2  34.160  15.210   1.007
   16   1HG   LYS   2          1HG       LYS   2  33.634  14.247  -1.144
   17   2HG   LYS   2          2HG       LYS   2  32.765  15.700  -1.634
   18   1HD   LYS   2          1HD       LYS   2  35.028  15.629  -2.637
   19   2HD   LYS   2          2HD       LYS   2  34.847  17.003  -1.548
   20   1HE   LYS   2          1HE       LYS   2  36.999  15.553  -1.358
   21   2HE   LYS   2          2HE       LYS   2  36.166  16.009   0.127
   22   1HZ   LYS   2          1HZ       LYS   2  35.775  13.445  -1.322
   23   2HZ   LYS   2          2HZ       LYS   2  36.751  13.642   0.054
   24   3HZ   LYS   2          3HZ       LYS   2  35.075  13.880   0.163
   25    H    ALA   3           H        ALA   3  31.533  13.613   2.723
   26    HA   ALA   3           HA       ALA   3  32.317  15.271   4.987
   27   1HB   ALA   3          1HB       ALA   3  29.863  15.023   5.949
   28   2HB   ALA   3          2HB       ALA   3  30.251  16.360   4.866
   29   3HB   ALA   3          3HB       ALA   3  29.421  14.934   4.245
   30    H    ILE   4           H        ILE   4  30.643  12.391   3.774
   31    HA   ILE   4           HA       ILE   4  31.843  10.827   6.030
   32    HB   ILE   4           HB       ILE   4  29.630   9.395   5.758
   33   1HG1  ILE   4          1HG1      ILE   4  27.661  10.816   5.288
   34   2HG1  ILE   4          2HG1      ILE   4  28.719  12.161   4.880
   35   1HG2  ILE   4          1HG2      ILE   4  29.765  12.051   7.214
   36   2HG2  ILE   4          2HG2      ILE   4  28.553  10.807   7.523
   37   3HG2  ILE   4          3HG2      ILE   4  30.256  10.477   7.841
   38   1HD1  ILE   4          1HD1      ILE   4  29.050   9.539   3.443
   39   2HD1  ILE   4          2HD1      ILE   4  27.751  10.635   2.971
   40   3HD1  ILE   4          3HD1      ILE   4  29.425  11.172   2.892
   41    H    PHE   5           H        PHE   5  32.136   8.537   5.516
   42    HA   PHE   5           HA       PHE   5  32.605   8.105   2.582
   43   1HB   PHE   5          1HB       PHE   5  34.579   8.024   4.161
   44   2HB   PHE   5          2HB       PHE   5  33.837   6.614   4.917
   45    HD1  PHE   5           HD1      PHE   5  33.681   4.475   3.728
   46    HD2  PHE   5           HD2      PHE   5  35.446   7.924   1.877
   47    HE1  PHE   5           HE1      PHE   5  34.626   3.033   1.949
   48    HE2  PHE   5           HE2      PHE   5  36.393   6.483   0.096
   49    HZ   PHE   5           HZ       PHE   5  35.983   4.037   0.132
   50    H    VAL   6           H        VAL   6  31.071   6.816   5.464
   51    HA   VAL   6           HA       VAL   6  29.965   4.534   3.852
   52    HB   VAL   6           HB       VAL   6  30.301   4.807   6.851
   53   1HG1  VAL   6          1HG1      VAL   6  29.184   2.627   5.073
   54   2HG1  VAL   6          2HG1      VAL   6  29.707   2.326   6.730
   55   3HG1  VAL   6          3HG1      VAL   6  28.380   3.445   6.413
   56   1HG2  VAL   6          1HG2      VAL   6  31.760   3.124   4.787
   57   2HG2  VAL   6          2HG2      VAL   6  32.438   4.481   5.687
   58   3HG2  VAL   6          3HG2      VAL   6  31.983   3.003   6.531
   59    H    LEU   7           H        LEU   7  27.861   4.766   3.337
   60    HA   LEU   7           HA       LEU   7  25.981   5.912   5.318
   61   1HB   LEU   7          1HB       LEU   7  26.922   7.698   3.596
   62   2HB   LEU   7          2HB       LEU   7  25.800   6.927   2.478
   63    HG   LEU   7           HG       LEU   7  25.078   8.108   5.180
   64   1HD1  LEU   7          1HD1      LEU   7  25.606   9.799   3.455
   65   2HD1  LEU   7          2HD1      LEU   7  24.448   9.040   2.362
   66   3HD1  LEU   7          3HD1      LEU   7  23.888   9.800   3.851
   67   1HD2  LEU   7          1HD2      LEU   7  23.524   6.564   3.103
   68   2HD2  LEU   7          2HD2      LEU   7  23.526   6.373   4.856
   69   3HD2  LEU   7          3HD2      LEU   7  22.703   7.747   4.121
   70    H    ASN   8           H        ASN   8  24.349   4.410   5.416
   71    HA   ASN   8           HA       ASN   8  23.962   2.557   3.146
   72   1HB   ASN   8          1HB       ASN   8  22.585   2.686   5.849
   73   2HB   ASN   8          2HB       ASN   8  22.364   1.410   4.653
   74   2HD2  ASN   8          2HD2      ASN   8  23.878   1.792   7.485
   75   1HD2  ASN   8          1HD2      ASN   8  25.304   0.912   7.215
   76    H    ALA   9           H        ALA   9  22.218   2.606   1.768
   77    HA   ALA   9           HA       ALA   9  20.751   5.042   1.463
   78   1HB   ALA   9          1HB       ALA   9  20.094   2.307   0.331
   79   2HB   ALA   9          2HB       ALA   9  19.504   3.856  -0.274
   80   3HB   ALA   9          3HB       ALA   9  21.218   3.457  -0.395
   81    H    GLN  10           H        GLN  10  19.881   1.932   2.937
   82    HA   GLN  10           HA       GLN  10  17.118   2.609   3.381
   83   1HB   GLN  10          1HB       GLN  10  17.427   0.766   5.255
   84   2HB   GLN  10          2HB       GLN  10  17.482   0.311   3.555
   85   1HG   GLN  10          1HG       GLN  10  20.032   1.116   4.952
   86   2HG   GLN  10          2HG       GLN  10  19.386  -0.508   5.186
   87   2HE2  GLN  10          2HE2      GLN  10  18.418  -1.215   2.709
   88   1HE2  GLN  10          1HE2      GLN  10  19.651  -1.173   1.543
   89    H    HIS  11           H        HIS  11  20.038   3.543   4.981
   90    HA   HIS  11           HA       HIS  11  18.644   4.260   7.489
   91   1HB   HIS  11          1HB       HIS  11  21.497   4.615   6.538
   92   2HB   HIS  11          2HB       HIS  11  20.916   5.189   8.098
   93    HD1  HIS  11           HD1      HIS  11  19.648   1.959   6.666
   94    HD2  HIS  11           HD2      HIS  11  22.393   3.221   9.540
   95    HE1  HIS  11           HE1      HIS  11  20.317  -0.105   7.973
   96    H    ASP  12           H        ASP  12  18.797   5.606   4.471
   97    HA   ASP  12           HA       ASP  12  18.073   8.258   5.538
   98   1HB   ASP  12          1HB       ASP  12  20.604   8.210   5.216
   99   2HB   ASP  12          2HB       ASP  12  20.290   8.055   3.487
  100    H    GLU  13           H        GLU  13  19.019   8.754   2.429
  101    HA   GLU  13           HA       GLU  13  16.375   8.939   1.409
  102   1HB   GLU  13          1HB       GLU  13  18.391  10.125   0.485
  103   2HB   GLU  13          2HB       GLU  13  18.916   8.590  -0.208
  104   1HG   GLU  13          1HG       GLU  13  17.728   9.837  -1.920
  105   2HG   GLU  13          2HG       GLU  13  16.728   8.467  -1.438
  106    H    ALA  14           H        ALA  14  15.109   7.529   0.239
  107    HA   ALA  14           HA       ALA  14  16.104   4.710  -0.038
  108   1HB   ALA  14          1HB       ALA  14  13.280   5.797   0.208
  109   2HB   ALA  14          2HB       ALA  14  13.689   4.100  -0.041
  110   3HB   ALA  14          3HB       ALA  14  14.169   4.912   1.449
  111    H    VAL  15           H        VAL  15  15.637   3.622  -2.035
  112    HA   VAL  15           HA       VAL  15  15.896   5.211  -4.379
  113    HB   VAL  15           HB       VAL  15  14.961   2.355  -3.988
  114   1HG1  VAL  15          1HG1      VAL  15  15.483   3.936  -6.512
  115   2HG1  VAL  15          2HG1      VAL  15  15.574   2.175  -6.472
  116   3HG1  VAL  15          3HG1      VAL  15  14.054   2.988  -6.098
  117   1HG2  VAL  15          1HG2      VAL  15  17.294   2.853  -3.348
  118   2HG2  VAL  15          2HG2      VAL  15  17.238   1.836  -4.788
  119   3HG2  VAL  15          3HG2      VAL  15  17.580   3.560  -4.938
  120    H    ASP  16           H        ASP  16  13.008   3.526  -3.082
  121    HA   ASP  16           HA       ASP  16  11.294   5.646  -4.200
  122   1HB   ASP  16          1HB       ASP  16  11.166   2.775  -5.157
  123   2HB   ASP  16          2HB       ASP  16   9.842   3.922  -5.366
  124    H    ALA  17           H        ALA  17  10.876   5.911  -1.894
  125    HA   ALA  17           HA       ALA  17   9.546   3.677  -0.484
  126   1HB   ALA  17          1HB       ALA  17  10.221   6.515   0.347
  127   2HB   ALA  17          2HB       ALA  17  11.070   5.043   0.823
  128   3HB   ALA  17          3HB       ALA  17   9.429   5.341   1.397
  129    H    ASN  18           H        ASN  18   8.702   6.418  -2.387
  130    HA   ASN  18           HA       ASN  18   6.096   6.923  -1.250
  131   1HB   ASN  18          1HB       ASN  18   5.690   8.233  -3.258
  132   2HB   ASN  18          2HB       ASN  18   7.339   8.534  -2.712
  133   2HD2  ASN  18          2HD2      ASN  18   5.651   8.019  -5.497
  134   1HD2  ASN  18          1HD2      ASN  18   6.847   7.252  -6.428
  135    H    SER  19           H        SER  19   7.338   4.457  -3.332
  136    HA   SER  19           HA       SER  19   5.003   3.804  -4.817
  137   1HB   SER  19          1HB       SER  19   7.248   2.063  -3.773
  138   2HB   SER  19          2HB       SER  19   5.999   1.477  -4.867
  139    HG   SER  19           HG       SER  19   7.764   2.185  -6.060
  140    H    LEU  20           H        LEU  20   6.015   2.827  -1.547
  141    HA   LEU  20           HA       LEU  20   3.923   0.944  -1.081
  142   1HB   LEU  20          1HB       LEU  20   6.050   1.567   0.344
  143   2HB   LEU  20          2HB       LEU  20   4.977   2.733   1.113
  144    HG   LEU  20           HG       LEU  20   4.401  -0.239   0.876
  145   1HD1  LEU  20          1HD1      LEU  20   6.355   0.305   2.338
  146   2HD1  LEU  20          2HD1      LEU  20   5.301   1.346   3.296
  147   3HD1  LEU  20          3HD1      LEU  20   4.998  -0.390   3.225
  148   1HD2  LEU  20          1HD2      LEU  20   2.959   2.104   2.111
  149   2HD2  LEU  20          2HD2      LEU  20   2.310   0.786   1.137
  150   3HD2  LEU  20          3HD2      LEU  20   2.772   0.494   2.809
  151    H    ALA  21           H        ALA  21   4.108   4.432  -0.357
  152    HA   ALA  21           HA       ALA  21   1.519   4.703   0.748
  153   1HB   ALA  21          1HB       ALA  21   3.016   6.779  -0.870
  154   2HB   ALA  21          2HB       ALA  21   3.327   6.435   0.831
  155   3HB   ALA  21          3HB       ALA  21   1.763   7.079   0.335
  156    H    GLU  22           H        GLU  22   2.598   4.861  -2.644
  157    HA   GLU  22           HA       GLU  22   0.157   5.799  -3.754
  158   1HB   GLU  22          1HB       GLU  22   2.354   5.538  -4.979
  159   2HB   GLU  22          2HB       GLU  22   2.020   3.808  -5.061
  160   1HG   GLU  22          1HG       GLU  22  -0.091   4.261  -6.246
  161   2HG   GLU  22          2HG       GLU  22   0.233   5.993  -6.167
  162    H    ALA  23           H        ALA  23   1.206   2.472  -2.996
  163    HA   ALA  23           HA       ALA  23  -1.037   1.155  -4.164
  164   1HB   ALA  23          1HB       ALA  23  -0.533  -0.679  -2.536
  165   2HB   ALA  23          2HB       ALA  23   0.900  -0.121  -3.398
  166   3HB   ALA  23          3HB       ALA  23   0.615   0.393  -1.734
  167    H    LYS  24           H        LYS  24  -0.541   2.569  -0.948
  168    HA   LYS  24           HA       LYS  24  -3.131   1.804   0.071
  169   1HB   LYS  24          1HB       LYS  24  -1.147   3.941   0.893
  170   2HB   LYS  24          2HB       LYS  24  -2.634   3.607   1.783
  171   1HG   LYS  24          1HG       LYS  24  -1.947   1.326   2.204
  172   2HG   LYS  24          2HG       LYS  24  -0.542   1.509   1.152
  173   1HD   LYS  24          1HD       LYS  24   0.478   3.086   2.655
  174   2HD   LYS  24          2HD       LYS  24  -0.991   3.192   3.629
  175   1HE   LYS  24          1HE       LYS  24   0.992   1.633   4.411
  176   2HE   LYS  24          2HE       LYS  24  -0.678   1.088   4.579
  177   1HZ   LYS  24          1HZ       LYS  24   0.680   0.530   2.053
  178   2HZ   LYS  24          2HZ       LYS  24   1.152  -0.377   3.410
  179   3HZ   LYS  24          3HZ       LYS  24  -0.466  -0.393   2.895
  180    H    VAL  25           H        VAL  25  -1.869   4.717  -1.545
  181    HA   VAL  25           HA       VAL  25  -4.272   6.261  -1.265
  182    HB   VAL  25           HB       VAL  25  -2.028   6.385  -3.289
  183   1HG1  VAL  25          1HG1      VAL  25  -4.424   8.183  -2.887
  184   2HG1  VAL  25          2HG1      VAL  25  -2.958   8.722  -3.706
  185   3HG1  VAL  25          3HG1      VAL  25  -3.904   7.392  -4.375
  186   1HG2  VAL  25          1HG2      VAL  25  -1.549   6.895  -0.862
  187   2HG2  VAL  25          2HG2      VAL  25  -1.249   8.245  -1.956
  188   3HG2  VAL  25          3HG2      VAL  25  -2.714   8.214  -0.975
  189    H    LEU  26           H        LEU  26  -3.088   4.114  -3.855
  190    HA   LEU  26           HA       LEU  26  -5.273   4.500  -5.645
  191   1HB   LEU  26          1HB       LEU  26  -3.420   2.154  -5.175
  192   2HB   LEU  26          2HB       LEU  26  -4.625   2.159  -6.459
  193    HG   LEU  26           HG       LEU  26  -2.575   4.368  -6.147
  194   1HD1  LEU  26          1HD1      LEU  26  -2.395   1.802  -7.754
  195   2HD1  LEU  26          2HD1      LEU  26  -1.306   3.176  -7.949
  196   3HD1  LEU  26          3HD1      LEU  26  -1.342   2.287  -6.426
  197   1HD2  LEU  26          1HD2      LEU  26  -4.504   3.488  -8.311
  198   2HD2  LEU  26          2HD2      LEU  26  -4.290   5.092  -7.618
  199   3HD2  LEU  26          3HD2      LEU  26  -3.076   4.440  -8.711
  200    H    ALA  27           H        ALA  27  -4.828   2.230  -2.955
  201    HA   ALA  27           HA       ALA  27  -7.353   0.881  -3.380
  202   1HB   ALA  27          1HB       ALA  27  -5.442  -0.102  -2.107
  203   2HB   ALA  27          2HB       ALA  27  -5.707   1.098  -0.843
  204   3HB   ALA  27          3HB       ALA  27  -6.946  -0.110  -1.187
  205    H    ASN  28           H        ASN  28  -6.341   3.763  -1.686
  206    HA   ASN  28           HA       ASN  28  -8.537   4.103   0.084
  207   1HB   ASN  28          1HB       ASN  28  -6.371   5.459  -0.050
  208   2HB   ASN  28          2HB       ASN  28  -7.129   6.351  -1.367
  209   2HD2  ASN  28          2HD2      ASN  28  -7.278   5.717   2.115
  210   1HD2  ASN  28          1HD2      ASN  28  -8.363   6.973   2.475
  211    H    ARG  29           H        ARG  29  -8.133   5.296  -3.284
  212    HA   ARG  29           HA       ARG  29 -10.761   6.476  -3.335
  213   1HB   ARG  29          1HB       ARG  29 -10.383   6.428  -5.878
  214   2HB   ARG  29          2HB       ARG  29  -9.265   7.378  -4.906
  215   1HG   ARG  29          1HG       ARG  29  -7.568   5.700  -5.038
  216   2HG   ARG  29          2HG       ARG  29  -8.704   4.504  -5.645
  217   1HD   ARG  29          1HD       ARG  29  -8.303   5.138  -7.790
  218   2HD   ARG  29          2HD       ARG  29  -8.694   6.812  -7.432
  219    HE   ARG  29           HE       ARG  29  -6.088   5.759  -7.916
  220   1HH1  ARG  29          1HH1      ARG  29  -4.217   6.842  -7.295
  221   2HH1  ARG  29          2HH1      ARG  29  -4.299   8.044  -6.053
  222   1HH2  ARG  29          1HH2      ARG  29  -7.708   7.710  -5.581
  223   2HH2  ARG  29          2HH2      ARG  29  -6.272   8.534  -5.085
  224    H    GLU  30           H        GLU  30  -9.594   3.227  -4.026
  225    HA   GLU  30           HA       GLU  30 -11.815   2.344  -5.577
  226   1HB   GLU  30          1HB       GLU  30 -10.035   0.844  -3.642
  227   2HB   GLU  30          2HB       GLU  30 -11.251   0.054  -4.648
  228   1HG   GLU  30          1HG       GLU  30 -10.177   0.790  -6.663
  229   2HG   GLU  30          2HG       GLU  30  -9.075   1.833  -5.765
  230    H    LEU  31           H        LEU  31 -11.377   2.353  -2.035
  231    HA   LEU  31           HA       LEU  31 -13.998   1.221  -1.529
  232   1HB   LEU  31          1HB       LEU  31 -12.399   3.005   0.330
  233   2HB   LEU  31          2HB       LEU  31 -13.593   1.790   0.775
  234    HG   LEU  31           HG       LEU  31 -10.883   1.326  -0.472
  235   1HD1  LEU  31          1HD1      LEU  31 -12.132   0.714   2.215
  236   2HD1  LEU  31          2HD1      LEU  31 -10.707  -0.152   1.646
  237   3HD1  LEU  31          3HD1      LEU  31 -10.642   1.591   1.881
  238   1HD2  LEU  31          1HD2      LEU  31 -13.249  -0.521  -0.091
  239   2HD2  LEU  31          2HD2      LEU  31 -12.243  -0.307  -1.524
  240   3HD2  LEU  31          3HD2      LEU  31 -11.606  -1.159  -0.121
  241    H    ASP  32           H        ASP  32 -12.697   4.415  -1.992
  242    HA   ASP  32           HA       ASP  32 -14.855   5.974  -1.026
  243   1HB   ASP  32          1HB       ASP  32 -12.568   6.763  -1.713
  244   2HB   ASP  32          2HB       ASP  32 -13.079   6.588  -3.390
  245    H    LYS  33           H        LYS  33 -14.325   4.553  -4.291
  246    HA   LYS  33           HA       LYS  33 -16.726   5.752  -5.376
  247   1HB   LYS  33          1HB       LYS  33 -16.468   3.939  -7.163
  248   2HB   LYS  33          2HB       LYS  33 -15.122   5.061  -6.990
  249   1HG   LYS  33          1HG       LYS  33 -13.887   3.458  -5.664
  250   2HG   LYS  33          2HG       LYS  33 -15.255   2.344  -5.658
  251   1HD   LYS  33          1HD       LYS  33 -13.903   3.288  -8.203
  252   2HD   LYS  33          2HD       LYS  33 -13.405   1.830  -7.349
  253   1HE   LYS  33          1HE       LYS  33 -15.950   1.182  -7.512
  254   2HE   LYS  33          2HE       LYS  33 -15.982   2.381  -8.804
  255   1HZ   LYS  33          1HZ       LYS  33 -13.810   0.434  -8.833
  256   2HZ   LYS  33          2HZ       LYS  33 -15.361  -0.128  -9.238
  257   3HZ   LYS  33          3HZ       LYS  33 -14.656   1.137 -10.125
  258    H    TYR  34           H        TYR  34 -16.047   2.607  -3.848
  259    HA   TYR  34           HA       TYR  34 -18.688   1.568  -4.381
  260   1HB   TYR  34          1HB       TYR  34 -16.571   0.768  -2.366
  261   2HB   TYR  34          2HB       TYR  34 -18.101  -0.091  -2.545
  262    HD1  TYR  34           HD1      TYR  34 -14.747  -0.088  -3.588
  263    HD2  TYR  34           HD2      TYR  34 -18.728  -0.608  -5.129
  264    HE1  TYR  34           HE1      TYR  34 -13.838  -1.327  -5.528
  265    HE2  TYR  34           HE2      TYR  34 -17.812  -1.848  -7.064
  266    HH   TYR  34           HH       TYR  34 -15.987  -2.556  -8.096
  267    H    GLY  35           H        GLY  35 -17.328   3.576  -1.845
  268   1HA   GLY  35          1HA       GLY  35 -20.029   4.253  -0.965
  269   2HA   GLY  35          2HA       GLY  35 -18.534   4.941  -0.337
  270    H    VAL  36           H        VAL  36 -17.336   2.345   0.340
  271    HA   VAL  36           HA       VAL  36 -19.198   1.092   2.232
  272    HB   VAL  36           HB       VAL  36 -17.101  -0.205   2.884
  273   1HG1  VAL  36          1HG1      VAL  36 -18.156  -0.168   0.049
  274   2HG1  VAL  36          2HG1      VAL  36 -17.055  -1.413   0.635
  275   3HG1  VAL  36          3HG1      VAL  36 -18.646  -1.228   1.370
  276   1HG2  VAL  36          1HG2      VAL  36 -15.597   1.675   1.987
  277   2HG2  VAL  36          2HG2      VAL  36 -15.136   0.026   1.566
  278   3HG2  VAL  36          3HG2      VAL  36 -15.957   1.042   0.380
  279    H    SER  37           H        SER  37 -17.919   0.713   4.540
  280    HA   SER  37           HA       SER  37 -18.085   3.210   5.881
  281   1HB   SER  37          1HB       SER  37 -16.740   0.620   6.679
  282   2HB   SER  37          2HB       SER  37 -16.885   2.002   7.759
  283    HG   SER  37           HG       SER  37 -18.607   0.370   7.856
  284    H    ASP  38           H        ASP  38 -16.558   4.743   6.433
  285    HA   ASP  38           HA       ASP  38 -14.158   4.914   4.834
  286   1HB   ASP  38          1HB       ASP  38 -15.149   6.518   7.205
  287   2HB   ASP  38          2HB       ASP  38 -13.675   6.911   6.319
  288    H    TYR  39           H        TYR  39 -14.888   3.384   7.794
  289    HA   TYR  39           HA       TYR  39 -12.414   3.567   9.179
  290   1HB   TYR  39          1HB       TYR  39 -14.338   2.585  10.267
  291   2HB   TYR  39          2HB       TYR  39 -14.461   1.333   9.029
  292    HD1  TYR  39           HD1      TYR  39 -12.627   2.473  12.005
  293    HD2  TYR  39           HD2      TYR  39 -12.840  -0.483   8.900
  294    HE1  TYR  39           HE1      TYR  39 -11.051   1.032  13.267
  295    HE2  TYR  39           HE2      TYR  39 -11.273  -1.920  10.153
  296    HH   TYR  39           HH       TYR  39 -10.049  -0.949  13.362
  297    H    TYR  40           H        TYR  40 -13.485   1.390   6.595
  298    HA   TYR  40           HA       TYR  40 -11.270  -0.363   6.570
  299   1HB   TYR  40          1HB       TYR  40 -13.078   0.613   4.350
  300   2HB   TYR  40          2HB       TYR  40 -11.855  -0.636   4.107
  301    HD1  TYR  40           HD1      TYR  40 -11.875  -2.590   5.893
  302    HD2  TYR  40           HD2      TYR  40 -15.225  -0.046   5.023
  303    HE1  TYR  40           HE1      TYR  40 -13.414  -4.300   6.817
  304    HE2  TYR  40           HE2      TYR  40 -16.764  -1.755   5.951
  305    HH   TYR  40           HH       TYR  40 -16.625  -3.658   7.588
  306    H    LYS  41           H        LYS  41 -11.661   2.833   4.989
  307    HA   LYS  41           HA       LYS  41  -9.227   2.749   3.509
  308   1HB   LYS  41          1HB       LYS  41 -10.720   5.086   4.734
  309   2HB   LYS  41          2HB       LYS  41  -9.307   5.277   3.694
  310   1HG   LYS  41          1HG       LYS  41 -10.570   3.890   1.964
  311   2HG   LYS  41          2HG       LYS  41 -12.000   4.103   2.975
  312   1HD   LYS  41          1HD       LYS  41 -10.308   6.340   1.833
  313   2HD   LYS  41          2HD       LYS  41 -11.868   5.826   1.199
  314   1HE   LYS  41          1HE       LYS  41 -12.754   6.276   3.588
  315   2HE   LYS  41          2HE       LYS  41 -11.255   7.173   3.821
  316   1HZ   LYS  41          1HZ       LYS  41 -13.033   7.661   1.509
  317   2HZ   LYS  41          2HZ       LYS  41 -13.245   8.467   2.989
  318   3HZ   LYS  41          3HZ       LYS  41 -11.801   8.659   2.120
  319    H    ASN  42           H        ASN  42  -9.984   3.880   6.767
  320    HA   ASN  42           HA       ASN  42  -7.371   4.720   7.467
  321   1HB   ASN  42          1HB       ASN  42  -9.362   5.248   8.829
  322   2HB   ASN  42          2HB       ASN  42  -9.519   3.542   9.253
  323   2HD2  ASN  42          2HD2      ASN  42  -9.230   4.438  11.554
  324   1HD2  ASN  42          1HD2      ASN  42  -7.645   4.663  12.119
  325    H    LEU  43           H        LEU  43  -8.939   1.548   7.703
  326    HA   LEU  43           HA       LEU  43  -6.864   0.222   9.121
  327   1HB   LEU  43          1HB       LEU  43  -9.105  -0.746   8.772
  328   2HB   LEU  43          2HB       LEU  43  -8.779  -0.888   7.047
  329    HG   LEU  43           HG       LEU  43  -6.920  -2.442   7.517
  330   1HD1  LEU  43          1HD1      LEU  43  -7.657  -1.778  10.368
  331   2HD1  LEU  43          2HD1      LEU  43  -6.954  -3.350   9.989
  332   3HD1  LEU  43          3HD1      LEU  43  -6.056  -1.879   9.631
  333   1HD2  LEU  43          1HD2      LEU  43  -9.308  -3.217   7.241
  334   2HD2  LEU  43          2HD2      LEU  43  -8.297  -4.325   8.170
  335   3HD2  LEU  43          3HD2      LEU  43  -9.435  -3.261   8.997
  336    H    ILE  44           H        ILE  44  -7.326   0.785   5.640
  337    HA   ILE  44           HA       ILE  44  -5.126  -0.780   4.722
  338    HB   ILE  44           HB       ILE  44  -6.400   1.725   3.589
  339   1HG1  ILE  44          1HG1      ILE  44  -6.546  -1.168   2.696
  340   2HG1  ILE  44          2HG1      ILE  44  -7.730  -0.414   3.765
  341   1HG2  ILE  44          1HG2      ILE  44  -4.205  -0.051   2.513
  342   2HG2  ILE  44          2HG2      ILE  44  -5.230   0.902   1.442
  343   3HG2  ILE  44          3HG2      ILE  44  -4.219   1.706   2.641
  344   1HD1  ILE  44          1HD1      ILE  44  -7.028   0.654   1.021
  345   2HD1  ILE  44          2HD1      ILE  44  -8.399  -0.406   1.337
  346   3HD1  ILE  44          3HD1      ILE  44  -8.336   1.195   2.065
  347    H    ASN  45           H        ASN  45  -5.326   2.564   5.874
  348    HA   ASN  45           HA       ASN  45  -2.677   3.372   5.282
  349   1HB   ASN  45          1HB       ASN  45  -4.411   4.928   6.102
  350   2HB   ASN  45          2HB       ASN  45  -4.391   4.129   7.672
  351   2HD2  ASN  45          2HD2      ASN  45  -3.724   6.920   7.364
  352   1HD2  ASN  45          1HD2      ASN  45  -2.084   7.111   7.756
  353    H    ASN  46           H        ASN  46  -3.979   1.527   8.013
  354    HA   ASN  46           HA       ASN  46  -1.509   1.475   9.507
  355   1HB   ASN  46          1HB       ASN  46  -3.966  -0.297   9.558
  356   2HB   ASN  46          2HB       ASN  46  -2.616  -0.480  10.679
  357   2HD2  ASN  46          2HD2      ASN  46  -1.965   2.166  11.289
  358   1HD2  ASN  46          1HD2      ASN  46  -3.288   2.936  12.022
  359    H    ALA  47           H        ALA  47  -2.642  -0.264   6.731
  360    HA   ALA  47           HA       ALA  47  -1.258  -2.718   6.996
  361   1HB   ALA  47          1HB       ALA  47  -2.875  -2.053   5.151
  362   2HB   ALA  47          2HB       ALA  47  -1.436  -2.917   4.607
  363   3HB   ALA  47          3HB       ALA  47  -1.541  -1.167   4.410
  364    H    LYS  48           H        LYS  48   0.890  -3.203   7.026
  365    HA   LYS  48           HA       LYS  48   2.840  -1.027   6.392
  366   1HB   LYS  48          1HB       LYS  48   3.157  -3.614   7.941
  367   2HB   LYS  48          2HB       LYS  48   4.456  -2.461   7.638
  368   1HG   LYS  48          1HG       LYS  48   3.173  -0.702   8.797
  369   2HG   LYS  48          2HG       LYS  48   1.874  -1.855   9.105
  370   1HD   LYS  48          1HD       LYS  48   3.429  -3.266  10.403
  371   2HD   LYS  48          2HD       LYS  48   4.728  -2.112  10.098
  372   1HE   LYS  48          1HE       LYS  48   2.133  -1.446  11.520
  373   2HE   LYS  48          2HE       LYS  48   3.662  -1.782  12.331
  374   1HZ   LYS  48          1HZ       LYS  48   4.591   0.059  10.863
  375   2HZ   LYS  48          2HZ       LYS  48   2.973   0.490  10.570
  376   3HZ   LYS  48          3HZ       LYS  48   3.586   0.525  12.152
  377    H    THR  49           H        THR  49   1.443  -3.577   4.832
  378    HA   THR  49           HA       THR  49   3.886  -4.029   3.140
  379    HB   THR  49           HB       THR  49   3.169  -6.356   2.841
  380    HG1  THR  49           HG1      THR  49   1.200  -6.843   3.313
  381   1HG2  THR  49          1HG2      THR  49   3.319  -5.497   5.743
  382   2HG2  THR  49          2HG2      THR  49   3.562  -7.146   5.165
  383   3HG2  THR  49          3HG2      THR  49   4.687  -5.871   4.694
  384    H    VAL  50           H        VAL  50   3.508  -3.969   0.928
  385    HA   VAL  50           HA       VAL  50   1.066  -2.711   0.037
  386    HB   VAL  50           HB       VAL  50   2.008  -2.990  -2.231
  387   1HG1  VAL  50          1HG1      VAL  50   2.814  -1.218  -0.547
  388   2HG1  VAL  50          2HG1      VAL  50   4.243  -2.232  -0.343
  389   3HG1  VAL  50          3HG1      VAL  50   3.869  -1.542  -1.922
  390   1HG2  VAL  50          1HG2      VAL  50   4.112  -4.625  -0.775
  391   2HG2  VAL  50          2HG2      VAL  50   2.985  -5.220  -1.995
  392   3HG2  VAL  50          3HG2      VAL  50   4.250  -4.079  -2.446
  393    H    GLU  51           H        GLU  51   2.294  -6.031  -0.036
  394    HA   GLU  51           HA       GLU  51   0.318  -7.137  -1.754
  395   1HB   GLU  51          1HB       GLU  51   2.460  -8.219  -0.751
  396   2HB   GLU  51          2HB       GLU  51   1.440  -8.615   0.630
  397   1HG   GLU  51          1HG       GLU  51   0.793  -9.368  -2.236
  398   2HG   GLU  51          2HG       GLU  51   1.551 -10.451  -1.070
  399    H    GLY  52           H        GLY  52   0.302  -6.569   1.744
  400   1HA   GLY  52          1HA       GLY  52  -1.450  -6.632   3.300
  401   2HA   GLY  52          2HA       GLY  52  -2.203  -7.853   2.276
  402    H    VAL  53           H        VAL  53  -1.388  -4.622   1.119
  403    HA   VAL  53           HA       VAL  53  -3.866  -3.347   1.660
  404    HB   VAL  53           HB       VAL  53  -1.843  -2.927  -0.550
  405   1HG1  VAL  53          1HG1      VAL  53  -4.369  -1.417   0.124
  406   2HG1  VAL  53          2HG1      VAL  53  -3.009  -0.623  -0.669
  407   3HG1  VAL  53          3HG1      VAL  53  -3.815  -1.981  -1.452
  408   1HG2  VAL  53          1HG2      VAL  53  -2.446  -1.523   2.068
  409   2HG2  VAL  53          2HG2      VAL  53  -1.008  -2.465   1.684
  410   3HG2  VAL  53          3HG2      VAL  53  -1.297  -0.929   0.868
  411    H    LYS  54           H        LYS  54  -2.857  -5.088  -1.323
  412    HA   LYS  54           HA       LYS  54  -5.440  -4.760  -2.578
  413   1HB   LYS  54          1HB       LYS  54  -3.174  -6.706  -3.102
  414   2HB   LYS  54          2HB       LYS  54  -4.624  -6.617  -4.096
  415   1HG   LYS  54          1HG       LYS  54  -3.359  -5.122  -5.315
  416   2HG   LYS  54          2HG       LYS  54  -3.935  -3.980  -4.110
  417   1HD   LYS  54          1HD       LYS  54  -1.656  -3.567  -3.968
  418   2HD   LYS  54          2HD       LYS  54  -1.788  -4.845  -2.763
  419   1HE   LYS  54          1HE       LYS  54  -0.756  -5.016  -5.589
  420   2HE   LYS  54          2HE       LYS  54   0.015  -5.556  -4.098
  421   1HZ   LYS  54          1HZ       LYS  54  -2.538  -6.759  -4.914
  422   2HZ   LYS  54          2HZ       LYS  54  -1.111  -7.260  -5.682
  423   3HZ   LYS  54          3HZ       LYS  54  -1.274  -7.429  -3.998
  424    H    ALA  55           H        ALA  55  -4.003  -7.374  -0.650
  425    HA   ALA  55           HA       ALA  55  -6.130  -9.246  -1.032
  426   1HB   ALA  55          1HB       ALA  55  -5.233 -10.363   0.970
  427   2HB   ALA  55          2HB       ALA  55  -4.273  -8.931   1.345
  428   3HB   ALA  55          3HB       ALA  55  -3.927  -9.870  -0.108
  429    H    LEU  56           H        LEU  56  -5.898  -6.406   0.974
  430    HA   LEU  56           HA       LEU  56  -7.918  -7.163   2.886
  431   1HB   LEU  56          1HB       LEU  56  -6.269  -5.275   3.193
  432   2HB   LEU  56          2HB       LEU  56  -7.176  -4.364   1.990
  433    HG   LEU  56           HG       LEU  56  -9.247  -4.810   3.492
  434   1HD1  LEU  56          1HD1      LEU  56  -6.978  -5.509   5.375
  435   2HD1  LEU  56          2HD1      LEU  56  -8.560  -4.988   5.939
  436   3HD1  LEU  56          3HD1      LEU  56  -8.409  -6.469   5.006
  437   1HD2  LEU  56          1HD2      LEU  56  -6.964  -2.997   4.309
  438   2HD2  LEU  56          2HD2      LEU  56  -8.343  -2.597   3.286
  439   3HD2  LEU  56          3HD2      LEU  56  -8.580  -2.893   5.008
  440    H    ILE  57           H        ILE  57  -7.996  -5.326  -0.157
  441    HA   ILE  57           HA       ILE  57 -10.788  -4.732  -0.122
  442    HB   ILE  57           HB       ILE  57  -8.771  -5.075  -2.339
  443   1HG1  ILE  57          1HG1      ILE  57  -8.976  -2.682  -2.560
  444   2HG1  ILE  57          2HG1      ILE  57 -10.399  -2.653  -1.523
  445   1HG2  ILE  57          1HG2      ILE  57 -11.735  -4.606  -2.575
  446   2HG2  ILE  57          2HG2      ILE  57 -10.612  -4.065  -3.823
  447   3HG2  ILE  57          3HG2      ILE  57 -10.738  -5.779  -3.433
  448   1HD1  ILE  57          1HD1      ILE  57  -7.700  -3.594  -0.553
  449   2HD1  ILE  57          2HD1      ILE  57  -8.219  -1.919  -0.430
  450   3HD1  ILE  57          3HD1      ILE  57  -9.109  -3.181   0.420
  451    H    ASP  58           H        ASP  58  -8.928  -7.535  -1.224
  452    HA   ASP  58           HA       ASP  58 -11.082  -8.950  -2.443
  453   1HB   ASP  58          1HB       ASP  58  -8.601  -9.941  -1.008
  454   2HB   ASP  58          2HB       ASP  58  -9.708 -11.004  -1.877
  455    H    GLU  59           H        GLU  59  -9.984  -8.800   0.937
  456    HA   GLU  59           HA       GLU  59 -11.929 -10.736   1.871
  457   1HB   GLU  59          1HB       GLU  59 -10.298  -8.622   3.304
  458   2HB   GLU  59          2HB       GLU  59 -11.369  -9.752   4.136
  459   1HG   GLU  59          1HG       GLU  59 -10.108 -11.650   3.189
  460   2HG   GLU  59          2HG       GLU  59  -9.035 -10.524   2.359
  461    H    ILE  60           H        ILE  60 -11.799  -7.200   1.657
  462    HA   ILE  60           HA       ILE  60 -14.302  -6.781   3.000
  463    HB   ILE  60           HB       ILE  60 -12.782  -5.022   1.063
  464   1HG1  ILE  60          1HG1      ILE  60 -13.024  -4.865   4.080
  465   2HG1  ILE  60          2HG1      ILE  60 -11.686  -5.668   3.258
  466   1HG2  ILE  60          1HG2      ILE  60 -15.201  -4.501   2.805
  467   2HG2  ILE  60          2HG2      ILE  60 -14.185  -3.206   2.173
  468   3HG2  ILE  60          3HG2      ILE  60 -15.055  -4.264   1.065
  469   1HD1  ILE  60          1HD1      ILE  60 -11.152  -3.556   2.081
  470   2HD1  ILE  60          2HD1      ILE  60 -12.471  -2.756   2.935
  471   3HD1  ILE  60          3HD1      ILE  60 -11.075  -3.356   3.831
  472    H    LEU  61           H        LEU  61 -13.443  -6.829  -0.476
  473    HA   LEU  61           HA       LEU  61 -16.182  -6.500  -1.320
  474   1HB   LEU  61          1HB       LEU  61 -13.665  -7.406  -2.724
  475   2HB   LEU  61          2HB       LEU  61 -15.226  -7.413  -3.550
  476    HG   LEU  61           HG       LEU  61 -14.000  -4.980  -2.207
  477   1HD1  LEU  61          1HD1      LEU  61 -12.851  -5.962  -4.339
  478   2HD1  LEU  61          2HD1      LEU  61 -14.279  -5.378  -5.187
  479   3HD1  LEU  61          3HD1      LEU  61 -13.246  -4.245  -4.318
  480   1HD2  LEU  61          1HD2      LEU  61 -16.590  -5.514  -3.622
  481   2HD2  LEU  61          2HD2      LEU  61 -16.244  -4.416  -2.288
  482   3HD2  LEU  61          3HD2      LEU  61 -15.812  -3.964  -3.933
  483    H    ALA  62           H        ALA  62 -14.112  -9.341  -0.810
  484    HA   ALA  62           HA       ALA  62 -15.972 -11.269  -1.820
  485   1HB   ALA  62          1HB       ALA  62 -13.900 -11.561   0.379
  486   2HB   ALA  62          2HB       ALA  62 -13.635 -11.862  -1.340
  487   3HB   ALA  62          3HB       ALA  62 -14.725 -12.898  -0.420
  488    H    ALA  63           H        ALA  63 -15.602  -9.731   1.344
  489    HA   ALA  63           HA       ALA  63 -17.434 -11.340   2.804
  490   1HB   ALA  63          1HB       ALA  63 -17.577  -9.462   4.359
  491   2HB   ALA  63          2HB       ALA  63 -15.908  -9.646   3.819
  492   3HB   ALA  63          3HB       ALA  63 -16.919  -8.370   3.140
  493    H    LEU  64           H        LEU  64 -17.985  -8.473   0.761
  494    HA   LEU  64           HA       LEU  64 -20.789  -8.280   1.381
  495   1HB   LEU  64          1HB       LEU  64 -19.321  -7.346  -1.105
  496   2HB   LEU  64          2HB       LEU  64 -20.897  -6.779  -0.566
  497    HG   LEU  64           HG       LEU  64 -18.335  -6.501   1.032
  498   1HD1  LEU  64          1HD1      LEU  64 -18.292  -5.134  -1.020
  499   2HD1  LEU  64          2HD1      LEU  64 -19.865  -4.454  -0.605
  500   3HD1  LEU  64          3HD1      LEU  64 -18.463  -4.114   0.407
  501   1HD2  LEU  64          1HD2      LEU  64 -21.206  -5.666   1.465
  502   2HD2  LEU  64          2HD2      LEU  64 -20.093  -6.434   2.597
  503   3HD2  LEU  64          3HD2      LEU  64 -19.896  -4.733   2.186
  504    HA   PRO  65           HA       PRO  65 -22.246 -11.714  -1.080
  505   1HB   PRO  65          1HB       PRO  65 -24.678 -10.588  -1.978
  506   2HB   PRO  65          2HB       PRO  65 -24.433 -11.469  -0.467
  507   1HG   PRO  65          1HG       PRO  65 -24.728  -8.554  -0.906
  508   2HG   PRO  65          2HG       PRO  65 -25.044  -9.507   0.550
  509   1HD   PRO  65          1HD       PRO  65 -22.831  -7.826   0.182
  510   2HD   PRO  65          2HD       PRO  65 -22.925  -9.139   1.380

  No H/Q in entry =         510
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1  24.171   1.014 -18.909
    2    H2   MET   1           H2       MET   1  24.279   0.177 -20.384
    3    H3   MET   1           H3       MET   1  25.680   0.481 -19.479
    4    HA   MET   1           HA       MET   1  25.805   2.660 -20.087
    5   1HB   MET   1          1HB       MET   1  24.256   1.369 -22.357
    6   2HB   MET   1          2HB       MET   1  25.267   2.809 -22.494
    7   1HG   MET   1          1HG       MET   1  26.292   0.127 -21.529
    8   2HG   MET   1          2HG       MET   1  26.413   0.675 -23.201
    9   1HE   MET   1          1HE       MET   1  28.773  -0.275 -21.637
   10   2HE   MET   1          2HE       MET   1  29.808   0.899 -20.828
   11   3HE   MET   1          3HE       MET   1  28.338   0.339 -20.036
   12    H    LYS   2           H        LYS   2  23.863   3.853 -22.063
   13    HA   LYS   2           HA       LYS   2  22.014   4.975 -20.050
   14   1HB   LYS   2          1HB       LYS   2  22.553   5.642 -22.960
   15   2HB   LYS   2          2HB       LYS   2  21.340   6.469 -21.982
   16   1HG   LYS   2          1HG       LYS   2  23.107   7.093 -20.352
   17   2HG   LYS   2          2HG       LYS   2  24.311   6.324 -21.384
   18   1HD   LYS   2          1HD       LYS   2  22.494   8.575 -22.302
   19   2HD   LYS   2          2HD       LYS   2  24.128   8.825 -21.693
   20   1HE   LYS   2          1HE       LYS   2  24.809   7.071 -23.521
   21   2HE   LYS   2          2HE       LYS   2  23.247   7.475 -24.235
   22   1HZ   LYS   2          1HZ       LYS   2  24.251   9.900 -23.664
   23   2HZ   LYS   2          2HZ       LYS   2  25.660   9.047 -24.071
   24   3HZ   LYS   2          3HZ       LYS   2  24.375   9.139 -25.178
   25    H    ALA   3           H        ALA   3  19.992   4.132 -19.785
   26    HA   ALA   3           HA       ALA   3  18.353   3.335 -22.029
   27   1HB   ALA   3          1HB       ALA   3  18.172   0.918 -21.381
   28   2HB   ALA   3          2HB       ALA   3  19.532   1.153 -20.285
   29   3HB   ALA   3          3HB       ALA   3  19.756   1.349 -22.022
   30    H    ILE   4           H        ILE   4  16.470   1.800 -20.910
   31    HA   ILE   4           HA       ILE   4  15.115   3.558 -19.107
   32    HB   ILE   4           HB       ILE   4  14.595   0.645 -19.770
   33   1HG1  ILE   4          1HG1      ILE   4  13.267   3.159 -20.834
   34   2HG1  ILE   4          2HG1      ILE   4  14.580   2.328 -21.667
   35   1HG2  ILE   4          1HG2      ILE   4  12.869   2.739 -18.408
   36   2HG2  ILE   4          2HG2      ILE   4  12.263   1.195 -19.012
   37   3HG2  ILE   4          3HG2      ILE   4  13.446   1.226 -17.705
   38   1HD1  ILE   4          1HD1      ILE   4  13.137   0.218 -21.534
   39   2HD1  ILE   4          2HD1      ILE   4  11.813   1.278 -21.051
   40   3HD1  ILE   4          3HD1      ILE   4  12.572   1.478 -22.630
   41    H    PHE   5           H        PHE   5  17.424   1.027 -18.575
   42    HA   PHE   5           HA       PHE   5  16.659   0.272 -15.920
   43   1HB   PHE   5          1HB       PHE   5  19.369   0.301 -17.281
   44   2HB   PHE   5          2HB       PHE   5  19.073  -0.421 -15.699
   45    HD1  PHE   5           HD1      PHE   5  17.710  -2.441 -15.462
   46    HD2  PHE   5           HD2      PHE   5  18.452  -0.691 -19.315
   47    HE1  PHE   5           HE1      PHE   5  16.900  -4.512 -16.560
   48    HE2  PHE   5           HE2      PHE   5  17.640  -2.761 -20.411
   49    HZ   PHE   5           HZ       PHE   5  16.865  -4.672 -19.035
   50    H    VAL   6           H        VAL   6  16.061   2.572 -15.288
   51    HA   VAL   6           HA       VAL   6  18.418   4.156 -14.338
   52    HB   VAL   6           HB       VAL   6  15.499   4.910 -14.714
   53   1HG1  VAL   6          1HG1      VAL   6  17.861   6.436 -13.594
   54   2HG1  VAL   6          2HG1      VAL   6  16.464   7.259 -14.288
   55   3HG1  VAL   6          3HG1      VAL   6  16.264   6.225 -12.877
   56   1HG2  VAL   6          1HG2      VAL   6  18.048   5.689 -16.162
   57   2HG2  VAL   6          2HG2      VAL   6  16.742   4.696 -16.810
   58   3HG2  VAL   6          3HG2      VAL   6  16.465   6.404 -16.467
   59    H    LEU   7           H        LEU   7  17.976   5.223 -12.121
   60    HA   LEU   7           HA       LEU   7  17.605   3.190 -10.167
   61   1HB   LEU   7          1HB       LEU   7  17.354   6.203  -9.881
   62   2HB   LEU   7          2HB       LEU   7  17.532   5.070  -8.541
   63    HG   LEU   7           HG       LEU   7  19.519   5.392 -10.808
   64   1HD1  LEU   7          1HD1      LEU   7  19.593   6.396  -7.945
   65   2HD1  LEU   7          2HD1      LEU   7  20.949   6.463  -9.071
   66   3HD1  LEU   7          3HD1      LEU   7  19.485   7.390  -9.398
   67   1HD2  LEU   7          1HD2      LEU   7  19.321   3.574  -8.419
   68   2HD2  LEU   7          2HD2      LEU   7  19.931   3.238 -10.040
   69   3HD2  LEU   7          3HD2      LEU   7  20.923   4.141  -8.897
   70    H    ASN   8           H        ASN   8  15.376   5.641 -11.431
   71    HA   ASN   8           HA       ASN   8  13.094   3.973 -10.691
   72   1HB   ASN   8          1HB       ASN   8  13.499   6.693  -9.404
   73   2HB   ASN   8          2HB       ASN   8  12.007   5.757  -9.323
   74   2HD2  ASN   8          2HD2      ASN   8  12.682   3.238  -8.666
   75   1HD2  ASN   8          1HD2      ASN   8  13.642   3.166  -7.267
   76    H    ALA   9           H        ALA   9  11.968   4.110 -12.618
   77    HA   ALA   9           HA       ALA   9  10.951   6.636 -13.563
   78   1HB   ALA   9          1HB       ALA   9  13.065   5.367 -15.325
   79   2HB   ALA   9          2HB       ALA   9  13.343   6.800 -14.337
   80   3HB   ALA   9          3HB       ALA   9  12.168   6.849 -15.648
   81    H    GLN  10           H        GLN  10   9.783   4.128 -12.962
   82    HA   GLN  10           HA       GLN  10   9.099   2.965 -15.633
   83   1HB   GLN  10          1HB       GLN  10   7.883   1.255 -14.090
   84   2HB   GLN  10          2HB       GLN  10   9.643   1.211 -14.166
   85   1HG   GLN  10          1HG       GLN  10   8.202   2.843 -12.071
   86   2HG   GLN  10          2HG       GLN  10   8.563   1.138 -11.824
   87   2HE2  GLN  10          2HE2      GLN  10   9.727   3.877 -10.744
   88   1HE2  GLN  10          1HE2      GLN  10  11.398   3.618 -10.836
   89    H    HIS  11           H        HIS  11   7.418   4.074 -16.557
   90    HA   HIS  11           HA       HIS  11   5.467   5.542 -15.017
   91   1HB   HIS  11          1HB       HIS  11   5.538   4.681 -17.919
   92   2HB   HIS  11          2HB       HIS  11   4.257   5.683 -17.240
   93    HD1  HIS  11           HD1      HIS  11   7.928   5.729 -18.067
   94    HD2  HIS  11           HD2      HIS  11   5.012   8.357 -16.667
   95    HE1  HIS  11           HE1      HIS  11   8.951   8.043 -18.152
   96    H    ASP  12           H        ASP  12   5.407   2.373 -16.643
   97    HA   ASP  12           HA       ASP  12   3.475   1.306 -14.797
   98   1HB   ASP  12          1HB       ASP  12   1.565   1.068 -16.353
   99   2HB   ASP  12          2HB       ASP  12   1.926   2.767 -16.054
  100    H    GLU  13           H        GLU  13   5.996   0.808 -16.529
  101    HA   GLU  13           HA       GLU  13   5.461  -1.323 -18.332
  102   1HB   GLU  13          1HB       GLU  13   7.905  -0.692 -16.660
  103   2HB   GLU  13          2HB       GLU  13   7.866  -1.975 -17.872
  104   1HG   GLU  13          1HG       GLU  13   7.244  -0.327 -19.601
  105   2HG   GLU  13          2HG       GLU  13   7.286   0.957 -18.391
  106    H    ALA  14           H        ALA  14   6.056  -1.360 -14.817
  107    HA   ALA  14           HA       ALA  14   4.590  -3.855 -14.566
  108   1HB   ALA  14          1HB       ALA  14   6.817  -4.646 -15.413
  109   2HB   ALA  14          2HB       ALA  14   6.403  -5.275 -13.818
  110   3HB   ALA  14          3HB       ALA  14   7.559  -3.951 -13.971
  111    H    VAL  15           H        VAL  15   6.330  -4.502 -12.154
  112    HA   VAL  15           HA       VAL  15   4.812  -2.987 -10.225
  113    HB   VAL  15           HB       VAL  15   6.196  -4.154  -8.555
  114   1HG1  VAL  15          1HG1      VAL  15   5.366  -5.880 -10.910
  115   2HG1  VAL  15          2HG1      VAL  15   5.693  -6.485  -9.288
  116   3HG1  VAL  15          3HG1      VAL  15   4.339  -5.390  -9.564
  117   1HG2  VAL  15          1HG2      VAL  15   7.837  -4.838 -11.004
  118   2HG2  VAL  15          2HG2      VAL  15   8.381  -4.086  -9.504
  119   3HG2  VAL  15          3HG2      VAL  15   7.931  -5.792  -9.523
  120    H    ASP  16           H        ASP  16   5.597  -1.394  -8.751
  121    HA   ASP  16           HA       ASP  16   8.253  -0.167  -9.372
  122   1HB   ASP  16          1HB       ASP  16   7.210   2.073  -9.364
  123   2HB   ASP  16          2HB       ASP  16   6.535   1.072 -10.652
  124    H    ALA  17           H        ALA  17   8.998   1.257  -7.600
  125    HA   ALA  17           HA       ALA  17   8.487   0.113  -5.010
  126   1HB   ALA  17          1HB       ALA  17   9.931   2.625  -5.882
  127   2HB   ALA  17          2HB       ALA  17  10.641   1.094  -5.373
  128   3HB   ALA  17          3HB       ALA  17   9.829   2.123  -4.195
  129    H    ASN  18           H        ASN  18   7.363   3.059  -6.623
  130    HA   ASN  18           HA       ASN  18   6.046   4.209  -4.360
  131   1HB   ASN  18          1HB       ASN  18   5.374   4.457  -7.308
  132   2HB   ASN  18          2HB       ASN  18   4.783   5.521  -6.031
  133   2HD2  ASN  18          2HD2      ASN  18   6.899   6.178  -4.517
  134   1HD2  ASN  18          1HD2      ASN  18   8.174   6.828  -5.429
  135    H    SER  19           H        SER  19   5.462   1.286  -5.766
  136    HA   SER  19           HA       SER  19   2.635   1.189  -6.061
  137   1HB   SER  19          1HB       SER  19   4.627  -0.924  -5.193
  138   2HB   SER  19          2HB       SER  19   2.931  -1.272  -5.521
  139    HG   SER  19           HG       SER  19   4.355   0.184  -7.424
  140    H    LEU  20           H        LEU  20   4.692   0.772  -3.175
  141    HA   LEU  20           HA       LEU  20   2.623  -0.014  -1.383
  142   1HB   LEU  20          1HB       LEU  20   4.934  -0.222  -0.713
  143   2HB   LEU  20          2HB       LEU  20   5.200   1.509  -0.903
  144    HG   LEU  20           HG       LEU  20   3.682   1.989   0.955
  145   1HD1  LEU  20          1HD1      LEU  20   3.128  -0.970   0.742
  146   2HD1  LEU  20          2HD1      LEU  20   2.929  -0.153   2.292
  147   3HD1  LEU  20          3HD1      LEU  20   1.987   0.363   0.894
  148   1HD2  LEU  20          1HD2      LEU  20   6.064   1.438   1.442
  149   2HD2  LEU  20          2HD2      LEU  20   4.988   1.002   2.770
  150   3HD2  LEU  20          3HD2      LEU  20   5.600  -0.247   1.684
  151    H    ALA  21           H        ALA  21   3.914   3.263  -2.067
  152    HA   ALA  21           HA       ALA  21   1.942   4.539  -0.395
  153   1HB   ALA  21          1HB       ALA  21   3.798   5.584  -2.542
  154   2HB   ALA  21          2HB       ALA  21   3.974   5.744  -0.794
  155   3HB   ALA  21          3HB       ALA  21   2.703   6.630  -1.638
  156    H    GLU  22           H        GLU  22   2.261   4.046  -3.894
  157    HA   GLU  22           HA       GLU  22  -0.141   5.417  -4.633
  158   1HB   GLU  22          1HB       GLU  22   1.682   4.728  -6.220
  159   2HB   GLU  22          2HB       GLU  22   1.149   3.056  -6.033
  160   1HG   GLU  22          1HG       GLU  22  -1.084   3.658  -6.868
  161   2HG   GLU  22          2HG       GLU  22  -0.572   5.339  -7.043
  162    H    ALA  23           H        ALA  23   0.513   2.038  -3.749
  163    HA   ALA  23           HA       ALA  23  -2.046   0.994  -4.371
  164   1HB   ALA  23          1HB       ALA  23  -1.519  -0.690  -2.536
  165   2HB   ALA  23          2HB       ALA  23  -0.295  -0.542  -3.797
  166   3HB   ALA  23          3HB       ALA  23  -0.046   0.228  -2.230
  167    H    LYS  24           H        LYS  24  -0.871   2.617  -1.408
  168    HA   LYS  24           HA       LYS  24  -3.386   2.292  -0.016
  169   1HB   LYS  24          1HB       LYS  24  -1.099   4.238   0.379
  170   2HB   LYS  24          2HB       LYS  24  -2.507   4.160   1.442
  171   1HG   LYS  24          1HG       LYS  24  -2.024   1.791   1.919
  172   2HG   LYS  24          2HG       LYS  24  -0.615   1.865   0.859
  173   1HD   LYS  24          1HD       LYS  24   0.377   3.612   2.290
  174   2HD   LYS  24          2HD       LYS  24  -1.029   3.539   3.354
  175   1HE   LYS  24          1HE       LYS  24  -0.551   1.206   3.887
  176   2HE   LYS  24          2HE       LYS  24   0.799   1.197   2.753
  177   1HZ   LYS  24          1HZ       LYS  24   0.927   3.336   4.664
  178   2HZ   LYS  24          2HZ       LYS  24   0.964   1.798   5.386
  179   3HZ   LYS  24          3HZ       LYS  24   2.117   2.217   4.211
  180    H    VAL  25           H        VAL  25  -1.995   4.859  -2.056
  181    HA   VAL  25           HA       VAL  25  -4.106   6.740  -1.656
  182    HB   VAL  25           HB       VAL  25  -2.171   6.362  -3.953
  183   1HG1  VAL  25          1HG1      VAL  25  -4.317   8.437  -3.480
  184   2HG1  VAL  25          2HG1      VAL  25  -2.872   8.819  -4.419
  185   3HG1  VAL  25          3HG1      VAL  25  -3.962   7.541  -4.957
  186   1HG2  VAL  25          1HG2      VAL  25  -1.227   7.002  -1.747
  187   2HG2  VAL  25          2HG2      VAL  25  -1.065   8.304  -2.925
  188   3HG2  VAL  25          3HG2      VAL  25  -2.324   8.382  -1.690
  189    H    LEU  26           H        LEU  26  -3.609   4.342  -4.277
  190    HA   LEU  26           HA       LEU  26  -6.117   4.914  -5.566
  191   1HB   LEU  26          1HB       LEU  26  -4.387   2.421  -5.608
  192   2HB   LEU  26          2HB       LEU  26  -5.786   2.668  -6.652
  193    HG   LEU  26           HG       LEU  26  -3.354   4.483  -6.549
  194   1HD1  LEU  26          1HD1      LEU  26  -2.951   2.184  -7.485
  195   2HD1  LEU  26          2HD1      LEU  26  -4.190   2.512  -8.694
  196   3HD1  LEU  26          3HD1      LEU  26  -2.715   3.478  -8.659
  197   1HD2  LEU  26          1HD2      LEU  26  -5.961   4.539  -8.060
  198   2HD2  LEU  26          2HD2      LEU  26  -5.046   5.876  -7.362
  199   3HD2  LEU  26          3HD2      LEU  26  -4.509   5.135  -8.864
  200    H    ALA  27           H        ALA  27  -5.164   2.573  -3.081
  201    HA   ALA  27           HA       ALA  27  -7.602   1.120  -2.973
  202   1HB   ALA  27          1HB       ALA  27  -5.390   1.667  -1.023
  203   2HB   ALA  27          2HB       ALA  27  -5.895   0.131  -1.722
  204   3HB   ALA  27          3HB       ALA  27  -6.850   0.882  -0.442
  205    H    ASN  28           H        ASN  28  -6.590   3.996  -1.092
  206    HA   ASN  28           HA       ASN  28  -8.962   4.223   0.450
  207   1HB   ASN  28          1HB       ASN  28  -6.776   5.498   0.748
  208   2HB   ASN  28          2HB       ASN  28  -7.318   6.556  -0.556
  209   2HD2  ASN  28          2HD2      ASN  28  -6.972   7.050   2.456
  210   1HD2  ASN  28          1HD2      ASN  28  -8.466   7.697   2.942
  211    H    ARG  29           H        ARG  29  -8.180   5.542  -2.766
  212    HA   ARG  29           HA       ARG  29 -10.658   7.004  -3.029
  213   1HB   ARG  29          1HB       ARG  29  -8.678   5.963  -5.074
  214   2HB   ARG  29          2HB       ARG  29 -10.079   6.949  -5.495
  215   1HG   ARG  29          1HG       ARG  29  -9.277   8.728  -3.995
  216   2HG   ARG  29          2HG       ARG  29  -7.870   7.753  -3.582
  217   1HD   ARG  29          1HD       ARG  29  -7.271   7.700  -6.014
  218   2HD   ARG  29          2HD       ARG  29  -8.583   8.828  -6.332
  219    HE   ARG  29           HE       ARG  29  -5.946   9.473  -5.369
  220   1HH1  ARG  29          1HH1      ARG  29  -5.469  11.383  -4.304
  221   2HH1  ARG  29          2HH1      ARG  29  -6.756  12.375  -3.707
  222   1HH2  ARG  29          1HH2      ARG  29  -9.264  10.277  -4.842
  223   2HH2  ARG  29          2HH2      ARG  29  -8.898  11.748  -4.007
  224    H    GLU  30           H        GLU  30  -9.622   3.733  -3.777
  225    HA   GLU  30           HA       GLU  30 -11.818   2.929  -5.375
  226   1HB   GLU  30          1HB       GLU  30  -9.683   1.649  -4.997
  227   2HB   GLU  30          2HB       GLU  30 -10.311   1.188  -3.415
  228   1HG   GLU  30          1HG       GLU  30 -12.176   0.033  -4.405
  229   2HG   GLU  30          2HG       GLU  30 -11.793   0.672  -6.005
  230    H    LEU  31           H        LEU  31 -11.476   2.991  -1.824
  231    HA   LEU  31           HA       LEU  31 -13.878   1.574  -1.214
  232   1HB   LEU  31          1HB       LEU  31 -12.915   3.956   0.392
  233   2HB   LEU  31          2HB       LEU  31 -13.723   2.499   0.971
  234    HG   LEU  31           HG       LEU  31 -10.925   2.729  -0.120
  235   1HD1  LEU  31          1HD1      LEU  31 -12.087   2.056   2.593
  236   2HD1  LEU  31          2HD1      LEU  31 -10.395   1.786   2.176
  237   3HD1  LEU  31          3HD1      LEU  31 -11.052   3.422   2.178
  238   1HD2  LEU  31          1HD2      LEU  31 -12.616   0.312   0.558
  239   2HD2  LEU  31          2HD2      LEU  31 -11.744   0.637  -0.939
  240   3HD2  LEU  31          3HD2      LEU  31 -10.855   0.240   0.531
  241    H    ASP  32           H        ASP  32 -13.259   4.974  -1.916
  242    HA   ASP  32           HA       ASP  32 -15.756   6.094  -1.346
  243   1HB   ASP  32          1HB       ASP  32 -13.683   7.288  -2.131
  244   2HB   ASP  32          2HB       ASP  32 -14.054   6.738  -3.764
  245    H    LYS  33           H        LYS  33 -14.808   4.041  -4.049
  246    HA   LYS  33           HA       LYS  33 -17.072   4.526  -5.731
  247   1HB   LYS  33          1HB       LYS  33 -15.428   1.998  -5.359
  248   2HB   LYS  33          2HB       LYS  33 -16.558   2.272  -6.678
  249   1HG   LYS  33          1HG       LYS  33 -14.367   4.277  -6.177
  250   2HG   LYS  33          2HG       LYS  33 -13.984   2.779  -7.019
  251   1HD   LYS  33          1HD       LYS  33 -16.373   4.369  -7.932
  252   2HD   LYS  33          2HD       LYS  33 -14.763   4.927  -8.378
  253   1HE   LYS  33          1HE       LYS  33 -14.266   2.740  -9.386
  254   2HE   LYS  33          2HE       LYS  33 -15.858   2.147  -8.910
  255   1HZ   LYS  33          1HZ       LYS  33 -16.225   4.554 -10.261
  256   2HZ   LYS  33          2HZ       LYS  33 -15.149   3.625 -11.193
  257   3HZ   LYS  33          3HZ       LYS  33 -16.669   2.998 -10.768
  258    H    TYR  34           H        TYR  34 -16.520   2.275  -3.046
  259    HA   TYR  34           HA       TYR  34 -19.334   1.317  -3.237
  260   1HB   TYR  34          1HB       TYR  34 -17.103   0.388  -1.408
  261   2HB   TYR  34          2HB       TYR  34 -18.634  -0.434  -1.714
  262    HD1  TYR  34           HD1      TYR  34 -15.511   0.766  -3.367
  263    HD2  TYR  34           HD2      TYR  34 -18.879  -1.892  -3.574
  264    HE1  TYR  34           HE1      TYR  34 -14.519  -0.331  -5.357
  265    HE2  TYR  34           HE2      TYR  34 -17.882  -2.998  -5.558
  266    HH   TYR  34           HH       TYR  34 -16.281  -2.827  -7.146
  267    H    GLY  35           H        GLY  35 -17.247   3.335  -1.283
  268   1HA   GLY  35          1HA       GLY  35 -19.509   4.466   0.106
  269   2HA   GLY  35          2HA       GLY  35 -17.816   4.812   0.455
  270    H    VAL  36           H        VAL  36 -17.082   2.028   0.990
  271    HA   VAL  36           HA       VAL  36 -18.749   0.777   2.902
  272    HB   VAL  36           HB       VAL  36 -16.837  -0.494   3.543
  273   1HG1  VAL  36          1HG1      VAL  36 -17.609  -0.581   1.093
  274   2HG1  VAL  36          2HG1      VAL  36 -16.168   0.368   0.728
  275   3HG1  VAL  36          3HG1      VAL  36 -16.010  -1.235   1.445
  276   1HG2  VAL  36          1HG2      VAL  36 -15.285   1.925   2.610
  277   2HG2  VAL  36          2HG2      VAL  36 -15.234   1.132   4.183
  278   3HG2  VAL  36          3HG2      VAL  36 -14.508   0.350   2.780
  279    H    SER  37           H        SER  37 -17.362   0.563   5.288
  280    HA   SER  37           HA       SER  37 -18.158   2.992   6.631
  281   1HB   SER  37          1HB       SER  37 -18.219   0.796   7.754
  282   2HB   SER  37          2HB       SER  37 -16.466   0.678   7.628
  283    HG   SER  37           HG       SER  37 -16.587   1.629   9.518
  284    H    ASP  38           H        ASP  38 -16.805   4.553   7.643
  285    HA   ASP  38           HA       ASP  38 -14.371   5.177   6.191
  286   1HB   ASP  38          1HB       ASP  38 -15.652   6.374   8.667
  287   2HB   ASP  38          2HB       ASP  38 -14.185   7.017   7.927
  288    H    TYR  39           H        TYR  39 -15.046   3.109   8.785
  289    HA   TYR  39           HA       TYR  39 -12.643   3.445  10.337
  290   1HB   TYR  39          1HB       TYR  39 -14.491   2.265  11.326
  291   2HB   TYR  39          2HB       TYR  39 -14.556   1.121   9.986
  292    HD1  TYR  39           HD1      TYR  39 -12.843  -0.600   9.705
  293    HD2  TYR  39           HD2      TYR  39 -12.796   2.058  13.077
  294    HE1  TYR  39           HE1      TYR  39 -11.227  -2.083  10.844
  295    HE2  TYR  39           HE2      TYR  39 -11.175   0.568  14.225
  296    HH   TYR  39           HH       TYR  39  -9.797  -2.255  12.583
  297    H    TYR  40           H        TYR  40 -13.461   1.360   7.576
  298    HA   TYR  40           HA       TYR  40 -11.020  -0.147   7.624
  299   1HB   TYR  40          1HB       TYR  40 -13.016   0.361   5.411
  300   2HB   TYR  40          2HB       TYR  40 -11.682  -0.785   5.290
  301    HD1  TYR  40           HD1      TYR  40 -11.469  -2.431   7.409
  302    HD2  TYR  40           HD2      TYR  40 -15.079  -0.475   6.133
  303    HE1  TYR  40           HE1      TYR  40 -12.817  -4.141   8.594
  304    HE2  TYR  40           HE2      TYR  40 -16.423  -2.187   7.319
  305    HH   TYR  40           HH       TYR  40 -16.125  -4.551   8.081
  306    H    LYS  41           H        LYS  41 -11.853   2.883   5.907
  307    HA   LYS  41           HA       LYS  41  -9.631   2.842   4.132
  308   1HB   LYS  41          1HB       LYS  41 -10.093   5.121   3.706
  309   2HB   LYS  41          2HB       LYS  41 -11.655   4.472   4.202
  310   1HG   LYS  41          1HG       LYS  41 -10.992   5.217   6.582
  311   2HG   LYS  41          2HG       LYS  41  -9.731   6.161   5.811
  312   1HD   LYS  41          1HD       LYS  41 -12.607   6.409   4.908
  313   2HD   LYS  41          2HD       LYS  41 -12.013   7.316   6.294
  314   1HE   LYS  41          1HE       LYS  41 -10.772   7.381   3.529
  315   2HE   LYS  41          2HE       LYS  41 -11.837   8.622   4.192
  316   1HZ   LYS  41          1HZ       LYS  41  -9.709   7.974   5.975
  317   2HZ   LYS  41          2HZ       LYS  41  -9.121   8.499   4.470
  318   3HZ   LYS  41          3HZ       LYS  41 -10.178   9.485   5.363
  319    H    ASN  42           H        ASN  42  -9.969   3.967   7.458
  320    HA   ASN  42           HA       ASN  42  -7.371   5.084   7.734
  321   1HB   ASN  42          1HB       ASN  42  -9.161   5.444   9.397
  322   2HB   ASN  42          2HB       ASN  42  -9.094   3.736   9.833
  323   2HD2  ASN  42          2HD2      ASN  42  -8.491   4.545  12.064
  324   1HD2  ASN  42          1HD2      ASN  42  -6.877   4.976  12.368
  325    H    LEU  43           H        LEU  43  -8.606   1.801   8.153
  326    HA   LEU  43           HA       LEU  43  -6.251   0.625   9.211
  327   1HB   LEU  43          1HB       LEU  43  -8.433  -0.529   9.162
  328   2HB   LEU  43          2HB       LEU  43  -8.355  -0.614   7.404
  329    HG   LEU  43           HG       LEU  43  -6.343  -2.013   7.540
  330   1HD1  LEU  43          1HD1      LEU  43  -6.607  -1.396  10.477
  331   2HD1  LEU  43          2HD1      LEU  43  -5.892  -2.932   9.983
  332   3HD1  LEU  43          3HD1      LEU  43  -5.161  -1.415   9.467
  333   1HD2  LEU  43          1HD2      LEU  43  -8.714  -2.969   7.714
  334   2HD2  LEU  43          2HD2      LEU  43  -7.419  -4.016   8.296
  335   3HD2  LEU  43          3HD2      LEU  43  -8.417  -3.126   9.444
  336    H    ILE  44           H        ILE  44  -7.232   1.281   5.863
  337    HA   ILE  44           HA       ILE  44  -5.109  -0.115   4.555
  338    HB   ILE  44           HB       ILE  44  -6.456   2.490   3.744
  339   1HG1  ILE  44          1HG1      ILE  44  -8.141   0.774   4.055
  340   2HG1  ILE  44          2HG1      ILE  44  -7.884   0.984   2.326
  341   1HG2  ILE  44          1HG2      ILE  44  -4.919   0.435   2.129
  342   2HG2  ILE  44          2HG2      ILE  44  -5.812   1.792   1.444
  343   3HG2  ILE  44          3HG2      ILE  44  -4.411   2.088   2.471
  344   1HD1  ILE  44          1HD1      ILE  44  -6.142  -0.970   2.635
  345   2HD1  ILE  44          2HD1      ILE  44  -7.068  -1.295   4.100
  346   3HD1  ILE  44          3HD1      ILE  44  -7.863  -1.338   2.531
  347    H    ASN  45           H        ASN  45  -5.330   3.216   5.783
  348    HA   ASN  45           HA       ASN  45  -2.653   3.953   5.010
  349   1HB   ASN  45          1HB       ASN  45  -4.598   5.101   7.036
  350   2HB   ASN  45          2HB       ASN  45  -3.033   5.836   6.672
  351   2HD2  ASN  45          2HD2      ASN  45  -5.555   7.154   6.122
  352   1HD2  ASN  45          1HD2      ASN  45  -5.696   7.317   4.438
  353    H    ASN  46           H        ASN  46  -3.945   2.116   7.647
  354    HA   ASN  46           HA       ASN  46  -1.457   2.455   9.259
  355   1HB   ASN  46          1HB       ASN  46  -4.030   0.971   9.873
  356   2HB   ASN  46          2HB       ASN  46  -2.686   1.204  10.990
  357   2HD2  ASN  46          2HD2      ASN  46  -5.673   2.365  10.551
  358   1HD2  ASN  46          1HD2      ASN  46  -5.452   3.998  10.958
  359    H    ALA  47           H        ALA  47  -2.299   0.599   6.699
  360    HA   ALA  47           HA       ALA  47  -1.789  -2.076   7.530
  361   1HB   ALA  47          1HB       ALA  47  -2.636  -1.263   5.254
  362   2HB   ALA  47          2HB       ALA  47  -1.465  -2.581   5.223
  363   3HB   ALA  47          3HB       ALA  47  -0.949  -0.935   4.858
  364    H    LYS  48           H        LYS  48   0.072  -3.071   8.164
  365    HA   LYS  48           HA       LYS  48   2.622  -1.523   8.001
  366   1HB   LYS  48          1HB       LYS  48   1.764  -3.897   9.672
  367   2HB   LYS  48          2HB       LYS  48   3.409  -3.262   9.660
  368   1HG   LYS  48          1HG       LYS  48   2.529  -1.036  10.336
  369   2HG   LYS  48          2HG       LYS  48   0.910  -1.724  10.428
  370   1HD   LYS  48          1HD       LYS  48   3.268  -2.785  12.011
  371   2HD   LYS  48          2HD       LYS  48   2.135  -1.593  12.643
  372   1HE   LYS  48          1HE       LYS  48   0.291  -3.305  12.006
  373   2HE   LYS  48          2HE       LYS  48   1.611  -4.470  11.901
  374   1HZ   LYS  48          1HZ       LYS  48   2.166  -3.316  14.222
  375   2HZ   LYS  48          2HZ       LYS  48   0.474  -3.162  14.227
  376   3HZ   LYS  48          3HZ       LYS  48   1.184  -4.696  14.079
  377    H    THR  49           H        THR  49   1.033  -3.818   6.222
  378    HA   THR  49           HA       THR  49   3.613  -4.981   5.216
  379    HB   THR  49           HB       THR  49   2.375  -7.089   4.753
  380    HG1  THR  49           HG1      THR  49   0.320  -5.516   5.703
  381   1HG2  THR  49          1HG2      THR  49   3.660  -6.651   6.907
  382   2HG2  THR  49          2HG2      THR  49   2.100  -6.330   7.667
  383   3HG2  THR  49          3HG2      THR  49   2.441  -7.923   6.990
  384    H    VAL  50           H        VAL  50   3.772  -5.065   2.977
  385    HA   VAL  50           HA       VAL  50   2.056  -3.314   1.457
  386    HB   VAL  50           HB       VAL  50   3.937  -5.415   0.387
  387   1HG1  VAL  50          1HG1      VAL  50   2.888  -2.796  -0.705
  388   2HG1  VAL  50          2HG1      VAL  50   4.171  -3.738  -1.465
  389   3HG1  VAL  50          3HG1      VAL  50   2.549  -4.414  -1.318
  390   1HG2  VAL  50          1HG2      VAL  50   4.472  -2.688   1.565
  391   2HG2  VAL  50          2HG2      VAL  50   5.298  -4.209   1.895
  392   3HG2  VAL  50          3HG2      VAL  50   5.557  -3.381   0.361
  393    H    GLU  51           H        GLU  51   2.513  -6.860   1.388
  394    HA   GLU  51           HA       GLU  51   0.480  -7.391  -0.530
  395   1HB   GLU  51          1HB       GLU  51   2.155  -9.075   0.173
  396   2HB   GLU  51          2HB       GLU  51   1.414  -9.140   1.771
  397   1HG   GLU  51          1HG       GLU  51  -0.704  -9.911   0.764
  398   2HG   GLU  51          2HG       GLU  51   0.030  -9.841  -0.837
  399    H    GLY  52           H        GLY  52   0.392  -7.084   2.986
  400   1HA   GLY  52          1HA       GLY  52  -1.417  -6.669   4.415
  401   2HA   GLY  52          2HA       GLY  52  -2.265  -7.881   3.456
  402    H    VAL  53           H        VAL  53  -1.015  -4.871   2.057
  403    HA   VAL  53           HA       VAL  53  -3.420  -3.338   2.350
  404    HB   VAL  53           HB       VAL  53  -1.259  -3.215   0.229
  405   1HG1  VAL  53          1HG1      VAL  53  -3.668  -1.464   0.741
  406   2HG1  VAL  53          2HG1      VAL  53  -2.233  -0.851  -0.083
  407   3HG1  VAL  53          3HG1      VAL  53  -3.148  -2.187  -0.782
  408   1HG2  VAL  53          1HG2      VAL  53  -1.837  -1.603   2.733
  409   2HG2  VAL  53          2HG2      VAL  53  -0.462  -2.672   2.464
  410   3HG2  VAL  53          3HG2      VAL  53  -0.608  -1.176   1.543
  411    H    LYS  54           H        LYS  54  -2.310  -5.367  -0.395
  412    HA   LYS  54           HA       LYS  54  -4.877  -5.046  -1.757
  413   1HB   LYS  54          1HB       LYS  54  -3.938  -6.637  -3.404
  414   2HB   LYS  54          2HB       LYS  54  -2.825  -5.314  -3.065
  415   1HG   LYS  54          1HG       LYS  54  -1.606  -6.764  -1.464
  416   2HG   LYS  54          2HG       LYS  54  -2.709  -8.085  -1.833
  417   1HD   LYS  54          1HD       LYS  54  -0.875  -8.540  -3.226
  418   2HD   LYS  54          2HD       LYS  54  -1.993  -7.712  -4.306
  419   1HE   LYS  54          1HE       LYS  54  -0.776  -5.629  -4.072
  420   2HE   LYS  54          2HE       LYS  54   0.240  -6.311  -2.802
  421   1HZ   LYS  54          1HZ       LYS  54   0.230  -7.856  -5.223
  422   2HZ   LYS  54          2HZ       LYS  54   0.829  -6.283  -5.441
  423   3HZ   LYS  54          3HZ       LYS  54   1.540  -7.309  -4.288
  424    H    ALA  55           H        ALA  55  -3.334  -7.556   0.217
  425    HA   ALA  55           HA       ALA  55  -5.351  -9.561  -0.286
  426   1HB   ALA  55          1HB       ALA  55  -3.597  -9.317   2.171
  427   2HB   ALA  55          2HB       ALA  55  -4.345 -10.781   1.534
  428   3HB   ALA  55          3HB       ALA  55  -3.039  -9.999   0.643
  429    H    LEU  56           H        LEU  56  -5.286  -6.732   1.639
  430    HA   LEU  56           HA       LEU  56  -7.290  -7.629   3.564
  431   1HB   LEU  56          1HB       LEU  56  -5.699  -5.988   4.308
  432   2HB   LEU  56          2HB       LEU  56  -6.042  -4.945   2.931
  433    HG   LEU  56           HG       LEU  56  -8.277  -4.483   3.771
  434   1HD1  LEU  56          1HD1      LEU  56  -7.559  -6.613   5.795
  435   2HD1  LEU  56          2HD1      LEU  56  -8.830  -5.430   6.111
  436   3HD1  LEU  56          3HD1      LEU  56  -8.975  -6.536   4.746
  437   1HD2  LEU  56          1HD2      LEU  56  -6.161  -3.335   4.745
  438   2HD2  LEU  56          2HD2      LEU  56  -7.674  -3.152   5.631
  439   3HD2  LEU  56          3HD2      LEU  56  -6.464  -4.310   6.182
  440    H    ILE  57           H        ILE  57  -7.215  -5.242   0.918
  441    HA   ILE  57           HA       ILE  57 -10.044  -4.745   0.974
  442    HB   ILE  57           HB       ILE  57  -8.035  -4.288  -1.236
  443   1HG1  ILE  57          1HG1      ILE  57  -9.111  -2.375   0.858
  444   2HG1  ILE  57          2HG1      ILE  57  -7.583  -3.232   1.037
  445   1HG2  ILE  57          1HG2      ILE  57 -10.855  -3.309  -0.754
  446   2HG2  ILE  57          2HG2      ILE  57  -9.738  -2.470  -1.830
  447   3HG2  ILE  57          3HG2      ILE  57 -10.216  -4.130  -2.176
  448   1HD1  ILE  57          1HD1      ILE  57  -7.233  -2.143  -1.443
  449   2HD1  ILE  57          2HD1      ILE  57  -8.271  -0.930  -0.694
  450   3HD1  ILE  57          3HD1      ILE  57  -6.737  -1.361   0.054
  451    H    ASP  58           H        ASP  58  -8.023  -6.900  -1.042
  452    HA   ASP  58           HA       ASP  58 -10.031  -7.641  -2.894
  453   1HB   ASP  58          1HB       ASP  58  -8.774  -9.714  -3.236
  454   2HB   ASP  58          2HB       ASP  58  -7.650  -8.366  -3.061
  455    H    GLU  59           H        GLU  59  -9.477  -8.687   0.424
  456    HA   GLU  59           HA       GLU  59 -11.454 -10.798   0.398
  457   1HB   GLU  59          1HB       GLU  59 -10.206  -9.167   2.635
  458   2HB   GLU  59          2HB       GLU  59 -11.326 -10.501   2.915
  459   1HG   GLU  59          1HG       GLU  59  -8.756 -10.765   1.330
  460   2HG   GLU  59          2HG       GLU  59  -8.897 -11.164   3.042
  461    H    ILE  60           H        ILE  60 -11.422  -7.357   1.219
  462    HA   ILE  60           HA       ILE  60 -14.153  -7.250   2.123
  463    HB   ILE  60           HB       ILE  60 -12.362  -5.060   1.037
  464   1HG1  ILE  60          1HG1      ILE  60 -12.983  -5.807   3.912
  465   2HG1  ILE  60          2HG1      ILE  60 -11.549  -6.368   3.063
  466   1HG2  ILE  60          1HG2      ILE  60 -14.965  -4.999   2.586
  467   2HG2  ILE  60          2HG2      ILE  60 -13.903  -3.600   2.420
  468   3HG2  ILE  60          3HG2      ILE  60 -14.653  -4.313   0.992
  469   1HD1  ILE  60          1HD1      ILE  60 -11.360  -3.684   2.586
  470   2HD1  ILE  60          2HD1      ILE  60 -12.173  -3.679   4.150
  471   3HD1  ILE  60          3HD1      ILE  60 -10.617  -4.484   3.967
  472    H    LEU  61           H        LEU  61 -12.570  -6.654  -1.000
  473    HA   LEU  61           HA       LEU  61 -14.982  -5.802  -2.340
  474   1HB   LEU  61          1HB       LEU  61 -12.302  -6.792  -3.321
  475   2HB   LEU  61          2HB       LEU  61 -13.608  -6.400  -4.439
  476    HG   LEU  61           HG       LEU  61 -12.512  -4.489  -2.354
  477   1HD1  LEU  61          1HD1      LEU  61 -10.877  -5.148  -4.174
  478   2HD1  LEU  61          2HD1      LEU  61 -12.014  -4.478  -5.344
  479   3HD1  LEU  61          3HD1      LEU  61 -11.275  -3.430  -4.134
  480   1HD2  LEU  61          1HD2      LEU  61 -14.675  -4.334  -4.433
  481   2HD2  LEU  61          2HD2      LEU  61 -14.593  -3.587  -2.839
  482   3HD2  LEU  61          3HD2      LEU  61 -13.690  -2.895  -4.181
  483    H    ALA  62           H        ALA  62 -13.567  -8.911  -1.622
  484    HA   ALA  62           HA       ALA  62 -14.919 -10.492  -3.561
  485   1HB   ALA  62          1HB       ALA  62 -14.354 -11.333  -0.707
  486   2HB   ALA  62          2HB       ALA  62 -14.460 -12.368  -2.131
  487   3HB   ALA  62          3HB       ALA  62 -13.103 -11.256  -1.947
  488    H    ALA  63           H        ALA  63 -15.949  -9.317  -0.370
  489    HA   ALA  63           HA       ALA  63 -18.445 -10.729  -0.305
  490   1HB   ALA  63          1HB       ALA  63 -17.548  -9.725   1.720
  491   2HB   ALA  63          2HB       ALA  63 -19.102  -8.973   1.362
  492   3HB   ALA  63          3HB       ALA  63 -17.603  -8.120   0.991
  493    H    LEU  64           H        LEU  64 -17.374  -7.914  -2.027
  494    HA   LEU  64           HA       LEU  64 -20.157  -7.504  -3.082
  495   1HB   LEU  64          1HB       LEU  64 -18.081  -5.358  -2.554
  496   2HB   LEU  64          2HB       LEU  64 -19.693  -5.101  -3.215
  497    HG   LEU  64           HG       LEU  64 -19.283  -6.427  -0.528
  498   1HD1  LEU  64          1HD1      LEU  64 -19.421  -3.480  -1.194
  499   2HD1  LEU  64          2HD1      LEU  64 -19.811  -4.112   0.406
  500   3HD1  LEU  64          3HD1      LEU  64 -18.189  -4.322  -0.255
  501   1HD2  LEU  64          1HD2      LEU  64 -21.584  -4.999  -1.898
  502   2HD2  LEU  64          2HD2      LEU  64 -21.515  -6.686  -1.390
  503   3HD2  LEU  64          3HD2      LEU  64 -21.590  -5.406  -0.184
  504    HA   PRO  65           HA       PRO  65 -17.052  -8.483  -6.458
  505   1HB   PRO  65          1HB       PRO  65 -19.415  -9.652  -7.776
  506   2HB   PRO  65          2HB       PRO  65 -17.873 -10.416  -7.372
  507   1HG   PRO  65          1HG       PRO  65 -20.286 -10.932  -6.083
  508   2HG   PRO  65          2HG       PRO  65 -18.687 -11.277  -5.411
  509   1HD   PRO  65          1HD       PRO  65 -20.606  -9.157  -4.643
  510   2HD   PRO  65          2HD       PRO  65 -19.215  -9.797  -3.732

  No H/Q in entry =         510
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1  15.454   0.644 -35.459
    2    H2   MET   1           H2       MET   1  14.873   0.785 -33.869
    3    H3   MET   1           H3       MET   1  14.474   1.961 -35.024
    4    HA   MET   1           HA       MET   1  16.619   2.847 -35.071
    5   1HB   MET   1          1HB       MET   1  15.851   2.024 -32.257
    6   2HB   MET   1          2HB       MET   1  17.138   3.177 -32.612
    7   1HG   MET   1          1HG       MET   1  15.531   4.609 -33.816
    8   2HG   MET   1          2HG       MET   1  14.241   3.460 -33.463
    9   1HE   MET   1          1HE       MET   1  13.693   2.605 -31.357
   10   2HE   MET   1          2HE       MET   1  14.987   2.681 -30.165
   11   3HE   MET   1          3HE       MET   1  13.487   3.581 -29.905
   12    H    LYS   2           H        LYS   2  18.745   2.521 -33.333
   13    HA   LYS   2           HA       LYS   2  20.129   0.277 -34.517
   14   1HB   LYS   2          1HB       LYS   2  20.807   2.269 -32.351
   15   2HB   LYS   2          2HB       LYS   2  21.878   0.910 -32.682
   16   1HG   LYS   2          1HG       LYS   2  22.675   2.758 -33.990
   17   2HG   LYS   2          2HG       LYS   2  21.897   1.645 -35.111
   18   1HD   LYS   2          1HD       LYS   2  19.914   3.008 -35.206
   19   2HD   LYS   2          2HD       LYS   2  20.480   4.022 -33.878
   20   1HE   LYS   2          1HE       LYS   2  20.843   5.144 -36.042
   21   2HE   LYS   2          2HE       LYS   2  22.384   4.770 -35.269
   22   1HZ   LYS   2          1HZ       LYS   2  21.106   2.976 -37.249
   23   2HZ   LYS   2          2HZ       LYS   2  22.203   4.192 -37.691
   24   3HZ   LYS   2          3HZ       LYS   2  22.703   2.926 -36.673
   25    H    ALA   3           H        ALA   3  20.836  -1.652 -33.467
   26    HA   ALA   3           HA       ALA   3  18.949  -2.774 -31.593
   27   1HB   ALA   3          1HB       ALA   3  20.223  -4.133 -33.252
   28   2HB   ALA   3          2HB       ALA   3  20.416  -4.734 -31.606
   29   3HB   ALA   3          3HB       ALA   3  21.703  -3.793 -32.357
   30    H    ILE   4           H        ILE   4  19.288  -3.285 -29.383
   31    HA   ILE   4           HA       ILE   4  21.641  -1.980 -28.064
   32    HB   ILE   4           HB       ILE   4  20.247  -1.101 -26.325
   33   1HG1  ILE   4          1HG1      ILE   4  18.598  -2.905 -26.115
   34   2HG1  ILE   4          2HG1      ILE   4  17.774  -1.372 -26.350
   35   1HG2  ILE   4          1HG2      ILE   4  19.024  -0.567 -29.042
   36   2HG2  ILE   4          2HG2      ILE   4  18.790   0.441 -27.613
   37   3HG2  ILE   4          3HG2      ILE   4  20.396   0.279 -28.324
   38   1HD1  ILE   4          1HD1      ILE   4  17.855  -2.063 -28.909
   39   2HD1  ILE   4          2HD1      ILE   4  18.035  -3.685 -28.239
   40   3HD1  ILE   4          3HD1      ILE   4  16.619  -2.720 -27.843
   41    H    PHE   5           H        PHE   5  22.198  -2.909 -25.983
   42    HA   PHE   5           HA       PHE   5  20.941  -5.483 -25.255
   43   1HB   PHE   5          1HB       PHE   5  22.647  -6.035 -27.007
   44   2HB   PHE   5          2HB       PHE   5  23.884  -5.315 -25.977
   45    HD1  PHE   5           HD1      PHE   5  24.570  -6.385 -23.883
   46    HD2  PHE   5           HD2      PHE   5  21.560  -8.133 -26.399
   47    HE1  PHE   5           HE1      PHE   5  24.765  -8.519 -22.635
   48    HE2  PHE   5           HE2      PHE   5  21.754 -10.266 -25.152
   49    HZ   PHE   5           HZ       PHE   5  23.357 -10.461 -23.270
   50    H    VAL   6           H        VAL   6  23.478  -3.072 -24.679
   51    HA   VAL   6           HA       VAL   6  22.837  -3.014 -21.842
   52    HB   VAL   6           HB       VAL   6  24.274  -4.976 -21.816
   53   1HG1  VAL   6          1HG1      VAL   6  25.487  -4.109 -24.027
   54   2HG1  VAL   6          2HG1      VAL   6  26.633  -3.435 -22.871
   55   3HG1  VAL   6          3HG1      VAL   6  26.324  -5.168 -22.896
   56   1HG2  VAL   6          1HG2      VAL   6  24.483  -3.210 -20.023
   57   2HG2  VAL   6          2HG2      VAL   6  25.913  -4.224 -20.212
   58   3HG2  VAL   6          3HG2      VAL   6  25.895  -2.593 -20.880
   59    H    LEU   7           H        LEU   7  22.468  -0.792 -22.440
   60    HA   LEU   7           HA       LEU   7  24.527   0.837 -23.638
   61   1HB   LEU   7          1HB       LEU   7  21.979   1.286 -23.483
   62   2HB   LEU   7          2HB       LEU   7  22.315   1.890 -21.864
   63    HG   LEU   7           HG       LEU   7  23.711   2.893 -24.367
   64   1HD1  LEU   7          1HD1      LEU   7  21.258   3.363 -24.376
   65   2HD1  LEU   7          2HD1      LEU   7  21.440   4.178 -22.824
   66   3HD1  LEU   7          3HD1      LEU   7  22.235   4.827 -24.258
   67   1HD2  LEU   7          1HD2      LEU   7  23.752   3.658 -21.447
   68   2HD2  LEU   7          2HD2      LEU   7  25.101   3.465 -22.566
   69   3HD2  LEU   7          3HD2      LEU   7  24.065   4.883 -22.676
   70    H    ASN   8           H        ASN   8  23.278   0.807 -20.266
   71    HA   ASN   8           HA       ASN   8  25.998   0.972 -19.206
   72   1HB   ASN   8          1HB       ASN   8  24.152   3.365 -19.146
   73   2HB   ASN   8          2HB       ASN   8  25.443   3.154 -17.963
   74   2HD2  ASN   8          2HD2      ASN   8  27.442   2.009 -19.659
   75   1HD2  ASN   8          1HD2      ASN   8  27.911   3.177 -20.798
   76    H    ALA   9           H        ALA   9  22.532   0.891 -18.779
   77    HA   ALA   9           HA       ALA   9  22.867  -0.668 -16.312
   78   1HB   ALA   9          1HB       ALA   9  21.209   0.889 -15.107
   79   2HB   ALA   9          2HB       ALA   9  22.868   1.467 -15.261
   80   3HB   ALA   9          3HB       ALA   9  21.616   2.084 -16.338
   81    H    GLN  10           H        GLN  10  20.625  -1.368 -15.509
   82    HA   GLN  10           HA       GLN  10  19.086  -2.290 -17.813
   83   1HB   GLN  10          1HB       GLN  10  18.715  -2.624 -14.824
   84   2HB   GLN  10          2HB       GLN  10  17.633  -3.336 -16.021
   85   1HG   GLN  10          1HG       GLN  10  19.535  -4.542 -17.029
   86   2HG   GLN  10          2HG       GLN  10  20.618  -3.834 -15.831
   87   2HE2  GLN  10          2HE2      GLN  10  18.027  -4.148 -13.962
   88   1HE2  GLN  10          1HE2      GLN  10  18.187  -5.750 -13.424
   89    H    HIS  11           H        HIS  11  16.727  -1.917 -17.988
   90    HA   HIS  11           HA       HIS  11  16.060   0.861 -17.867
   91   1HB   HIS  11          1HB       HIS  11  15.018  -0.809 -19.425
   92   2HB   HIS  11          2HB       HIS  11  14.143  -1.483 -18.050
   93    HD1  HIS  11           HD1      HIS  11  12.221  -0.070 -17.036
   94    HD2  HIS  11           HD2      HIS  11  14.097   1.756 -20.281
   95    HE1  HIS  11           HE1      HIS  11  10.763   1.893 -17.696
   96    H    ASP  12           H        ASP  12  14.366   1.855 -16.551
   97    HA   ASP  12           HA       ASP  12  14.639   1.237 -13.747
   98   1HB   ASP  12          1HB       ASP  12  12.770   3.079 -15.266
   99   2HB   ASP  12          2HB       ASP  12  12.816   2.981 -13.504
  100    H    GLU  13           H        GLU  13  13.689  -1.078 -15.070
  101    HA   GLU  13           HA       GLU  13  10.861  -1.401 -15.011
  102   1HB   GLU  13          1HB       GLU  13  12.453  -3.048 -16.012
  103   2HB   GLU  13          2HB       GLU  13  12.967  -3.496 -14.386
  104   1HG   GLU  13          1HG       GLU  13  10.653  -4.166 -13.835
  105   2HG   GLU  13          2HG       GLU  13  10.139  -3.721 -15.462
  106    H    ALA  14           H        ALA  14  13.320  -1.787 -12.478
  107    HA   ALA  14           HA       ALA  14  11.597  -2.824 -10.461
  108   1HB   ALA  14          1HB       ALA  14  14.113  -1.145 -10.298
  109   2HB   ALA  14          2HB       ALA  14  13.969  -2.889 -10.090
  110   3HB   ALA  14          3HB       ALA  14  13.305  -1.798  -8.874
  111    H    VAL  15           H        VAL  15  10.679  -1.643  -8.611
  112    HA   VAL  15           HA       VAL  15   9.746   1.120  -9.356
  113    HB   VAL  15           HB       VAL  15   7.794   0.596  -7.882
  114   1HG1  VAL  15          1HG1      VAL  15   8.394  -1.152 -10.269
  115   2HG1  VAL  15          2HG1      VAL  15   6.834  -1.212  -9.446
  116   3HG1  VAL  15          3HG1      VAL  15   7.380   0.289 -10.193
  117   1HG2  VAL  15          1HG2      VAL  15   9.121  -2.132  -7.821
  118   2HG2  VAL  15          2HG2      VAL  15   8.816  -1.075  -6.445
  119   3HG2  VAL  15          3HG2      VAL  15   7.467  -1.827  -7.293
  120    H    ASP  16           H        ASP  16   9.732   2.705  -7.703
  121    HA   ASP  16           HA       ASP  16  11.750   2.362  -5.637
  122   1HB   ASP  16          1HB       ASP  16   9.807   4.598  -6.264
  123   2HB   ASP  16          2HB       ASP  16  10.992   4.684  -4.959
  124    H    ALA  17           H        ALA  17  11.327   2.679  -3.320
  125    HA   ALA  17           HA       ALA  17   9.266   0.984  -2.316
  126   1HB   ALA  17          1HB       ALA  17  10.894   3.130  -0.918
  127   2HB   ALA  17          2HB       ALA  17  11.275   1.410  -1.009
  128   3HB   ALA  17          3HB       ALA  17   9.874   1.954  -0.086
  129    H    ASN  18           H        ASN  18   9.267   4.353  -3.169
  130    HA   ASN  18           HA       ASN  18   7.172   5.364  -1.579
  131   1HB   ASN  18          1HB       ASN  18   8.561   6.656  -3.255
  132   2HB   ASN  18          2HB       ASN  18   7.559   5.956  -4.527
  133   2HD2  ASN  18          2HD2      ASN  18   6.199   7.648  -5.179
  134   1HD2  ASN  18          1HD2      ASN  18   5.265   8.593  -4.121
  135    H    SER  19           H        SER  19   7.069   3.179  -4.329
  136    HA   SER  19           HA       SER  19   4.365   3.330  -5.077
  137   1HB   SER  19          1HB       SER  19   6.113   0.862  -4.838
  138   2HB   SER  19          2HB       SER  19   4.585   0.929  -5.713
  139    HG   SER  19           HG       SER  19   6.140   1.351  -7.203
  140    H    LEU  20           H        LEU  20   5.810   1.943  -2.206
  141    HA   LEU  20           HA       LEU  20   3.637   0.347  -1.299
  142   1HB   LEU  20          1HB       LEU  20   5.882   0.308  -0.273
  143   2HB   LEU  20          2HB       LEU  20   5.658   1.959   0.294
  144    HG   LEU  20           HG       LEU  20   3.766   1.235   1.698
  145   1HD1  LEU  20          1HD1      LEU  20   4.316  -1.396   0.335
  146   2HD1  LEU  20          2HD1      LEU  20   3.629  -1.381   1.959
  147   3HD1  LEU  20          3HD1      LEU  20   2.769  -0.602   0.634
  148   1HD2  LEU  20          1HD2      LEU  20   6.294  -0.413   2.023
  149   2HD2  LEU  20          2HD2      LEU  20   6.017   1.207   2.663
  150   3HD2  LEU  20          3HD2      LEU  20   5.092  -0.158   3.289
  151    H    ALA  21           H        ALA  21   4.414   3.770  -0.603
  152    HA   ALA  21           HA       ALA  21   2.034   4.236   0.923
  153   1HB   ALA  21          1HB       ALA  21   3.979   6.073  -0.480
  154   2HB   ALA  21          2HB       ALA  21   3.837   5.760   1.249
  155   3HB   ALA  21          3HB       ALA  21   2.589   6.687   0.415
  156    H    GLU  22           H        GLU  22   2.853   4.680  -2.496
  157    HA   GLU  22           HA       GLU  22   0.469   6.027  -3.296
  158   1HB   GLU  22          1HB       GLU  22   2.545   5.728  -4.702
  159   2HB   GLU  22          2HB       GLU  22   2.065   4.050  -4.949
  160   1HG   GLU  22          1HG       GLU  22   1.282   5.339  -6.841
  161   2HG   GLU  22          2HG       GLU  22  -0.118   4.877  -5.876
  162    H    ALA  23           H        ALA  23   1.214   2.578  -2.937
  163    HA   ALA  23           HA       ALA  23  -1.116   1.522  -4.146
  164   1HB   ALA  23          1HB       ALA  23  -0.729  -0.467  -2.769
  165   2HB   ALA  23          2HB       ALA  23   0.813   0.152  -3.360
  166   3HB   ALA  23          3HB       ALA  23   0.321   0.457  -1.694
  167    H    LYS  24           H        LYS  24  -0.574   2.513  -0.748
  168    HA   LYS  24           HA       LYS  24  -3.245   1.914   0.108
  169   1HB   LYS  24          1HB       LYS  24  -1.169   3.855   1.158
  170   2HB   LYS  24          2HB       LYS  24  -2.706   3.557   1.970
  171   1HG   LYS  24          1HG       LYS  24  -2.112   1.093   1.973
  172   2HG   LYS  24          2HG       LYS  24  -0.507   1.547   1.407
  173   1HD   LYS  24          1HD       LYS  24  -1.768   2.659   3.929
  174   2HD   LYS  24          2HD       LYS  24  -0.707   1.255   3.917
  175   1HE   LYS  24          1HE       LYS  24   0.764   3.010   4.397
  176   2HE   LYS  24          2HE       LYS  24   0.962   2.816   2.657
  177   1HZ   LYS  24          1HZ       LYS  24  -1.191   4.576   3.344
  178   2HZ   LYS  24          2HZ       LYS  24   0.300   5.120   3.941
  179   3HZ   LYS  24          3HZ       LYS  24   0.109   4.821   2.279
  180    H    VAL  25           H        VAL  25  -1.758   4.847  -1.248
  181    HA   VAL  25           HA       VAL  25  -4.020   6.558  -0.924
  182    HB   VAL  25           HB       VAL  25  -1.792   6.538  -2.974
  183   1HG1  VAL  25          1HG1      VAL  25  -4.038   8.513  -2.515
  184   2HG1  VAL  25          2HG1      VAL  25  -2.530   8.969  -3.307
  185   3HG1  VAL  25          3HG1      VAL  25  -3.566   7.738  -4.028
  186   1HG2  VAL  25          1HG2      VAL  25  -1.213   6.941  -0.571
  187   2HG2  VAL  25          2HG2      VAL  25  -0.882   8.333  -1.602
  188   3HG2  VAL  25          3HG2      VAL  25  -2.315   8.318  -0.574
  189    H    LEU  26           H        LEU  26  -3.016   4.505  -3.658
  190    HA   LEU  26           HA       LEU  26  -5.276   5.112  -5.311
  191   1HB   LEU  26          1HB       LEU  26  -3.386   2.748  -5.224
  192   2HB   LEU  26          2HB       LEU  26  -4.612   2.952  -6.473
  193    HG   LEU  26           HG       LEU  26  -2.488   5.022  -5.840
  194   1HD1  LEU  26          1HD1      LEU  26  -2.549   2.814  -7.915
  195   2HD1  LEU  26          2HD1      LEU  26  -1.437   4.181  -7.980
  196   3HD1  LEU  26          3HD1      LEU  26  -1.360   3.043  -6.634
  197   1HD2  LEU  26          1HD2      LEU  26  -4.665   4.759  -7.913
  198   2HD2  LEU  26          2HD2      LEU  26  -4.151   6.180  -7.007
  199   3HD2  LEU  26          3HD2      LEU  26  -3.172   5.594  -8.345
  200    H    ALA  27           H        ALA  27  -4.682   2.544  -2.929
  201    HA   ALA  27           HA       ALA  27  -7.118   1.107  -3.450
  202   1HB   ALA  27          1HB       ALA  27  -5.248   0.075  -2.246
  203   2HB   ALA  27          2HB       ALA  27  -5.427   1.241  -0.935
  204   3HB   ALA  27          3HB       ALA  27  -6.697   0.057  -1.241
  205    H    ASN  28           H        ASN  28  -6.299   3.721  -1.190
  206    HA   ASN  28           HA       ASN  28  -8.711   3.707   0.311
  207   1HB   ASN  28          1HB       ASN  28  -6.716   5.003   0.951
  208   2HB   ASN  28          2HB       ASN  28  -6.949   6.058  -0.441
  209   2HD2  ASN  28          2HD2      ASN  28  -7.069   6.719   2.507
  210   1HD2  ASN  28          1HD2      ASN  28  -8.600   7.416   2.741
  211    H    ARG  29           H        ARG  29  -7.927   5.363  -2.758
  212    HA   ARG  29           HA       ARG  29 -10.467   6.734  -2.905
  213   1HB   ARG  29          1HB       ARG  29  -8.409   6.059  -5.021
  214   2HB   ARG  29          2HB       ARG  29  -9.859   7.009  -5.348
  215   1HG   ARG  29          1HG       ARG  29  -9.144   8.564  -3.477
  216   2HG   ARG  29          2HG       ARG  29  -7.611   7.691  -3.437
  217   1HD   ARG  29          1HD       ARG  29  -8.777   9.191  -5.798
  218   2HD   ARG  29          2HD       ARG  29  -7.358   9.649  -4.857
  219    HE   ARG  29           HE       ARG  29  -6.728   7.123  -5.789
  220   1HH1  ARG  29          1HH1      ARG  29  -5.679   6.785  -7.766
  221   2HH1  ARG  29          2HH1      ARG  29  -5.822   7.972  -9.020
  222   1HH2  ARG  29          1HH2      ARG  29  -7.849  10.080  -7.158
  223   2HH2  ARG  29          2HH2      ARG  29  -7.052   9.838  -8.676
  224    H    GLU  30           H        GLU  30  -9.370   3.546  -3.894
  225    HA   GLU  30           HA       GLU  30 -11.466   2.913  -5.707
  226   1HB   GLU  30          1HB       GLU  30  -9.456   1.502  -5.396
  227   2HB   GLU  30          2HB       GLU  30 -10.017   1.069  -3.782
  228   1HG   GLU  30          1HG       GLU  30 -12.048   0.053  -4.758
  229   2HG   GLU  30          2HG       GLU  30 -11.486   0.487  -6.372
  230    H    LEU  31           H        LEU  31 -11.299   2.683  -2.184
  231    HA   LEU  31           HA       LEU  31 -13.762   1.333  -1.737
  232   1HB   LEU  31          1HB       LEU  31 -12.699   3.524   0.057
  233   2HB   LEU  31          2HB       LEU  31 -13.573   2.063   0.516
  234    HG   LEU  31           HG       LEU  31 -10.757   2.280  -0.541
  235   1HD1  LEU  31          1HD1      LEU  31 -11.207   2.695   1.897
  236   2HD1  LEU  31          2HD1      LEU  31 -11.850   1.056   2.009
  237   3HD1  LEU  31          3HD1      LEU  31 -10.156   1.311   1.599
  238   1HD2  LEU  31          1HD2      LEU  31 -12.573  -0.121  -0.216
  239   2HD2  LEU  31          2HD2      LEU  31 -11.607   0.333  -1.619
  240   3HD2  LEU  31          3HD2      LEU  31 -10.818  -0.282  -0.168
  241    H    ASP  32           H        ASP  32 -13.034   4.676  -2.470
  242    HA   ASP  32           HA       ASP  32 -15.477   5.875  -1.673
  243   1HB   ASP  32          1HB       ASP  32 -13.419   7.087  -2.379
  244   2HB   ASP  32          2HB       ASP  32 -13.742   6.599  -4.042
  245    H    LYS  33           H        LYS  33 -14.591   4.252  -4.733
  246    HA   LYS  33           HA       LYS  33 -17.027   4.844  -6.101
  247   1HB   LYS  33          1HB       LYS  33 -15.146   2.477  -6.310
  248   2HB   LYS  33          2HB       LYS  33 -16.508   2.729  -7.403
  249   1HG   LYS  33          1HG       LYS  33 -15.581   4.979  -7.974
  250   2HG   LYS  33          2HG       LYS  33 -14.176   4.622  -6.974
  251   1HD   LYS  33          1HD       LYS  33 -15.001   2.756  -9.201
  252   2HD   LYS  33          2HD       LYS  33 -14.011   4.175  -9.533
  253   1HE   LYS  33          1HE       LYS  33 -12.382   3.377  -7.803
  254   2HE   LYS  33          2HE       LYS  33 -13.335   1.902  -7.644
  255   1HZ   LYS  33          1HZ       LYS  33 -12.631   2.642 -10.353
  256   2HZ   LYS  33          2HZ       LYS  33 -11.320   2.200  -9.366
  257   3HZ   LYS  33          3HZ       LYS  33 -12.607   1.119  -9.599
  258    H    TYR  34           H        TYR  34 -16.108   2.035  -4.094
  259    HA   TYR  34           HA       TYR  34 -18.739   0.842  -4.189
  260   1HB   TYR  34          1HB       TYR  34 -16.384   0.448  -2.325
  261   2HB   TYR  34          2HB       TYR  34 -17.870  -0.498  -2.221
  262    HD1  TYR  34           HD1      TYR  34 -14.869   0.215  -4.229
  263    HD2  TYR  34           HD2      TYR  34 -18.495  -2.074  -3.986
  264    HE1  TYR  34           HE1      TYR  34 -14.065  -1.252  -6.058
  265    HE2  TYR  34           HE2      TYR  34 -17.691  -3.544  -5.814
  266    HH   TYR  34           HH       TYR  34 -15.931  -4.095  -7.089
  267    H    GLY  35           H        GLY  35 -17.168   3.181  -2.078
  268   1HA   GLY  35          1HA       GLY  35 -19.797   3.724  -0.793
  269   2HA   GLY  35          2HA       GLY  35 -18.390   4.788  -0.754
  270    H    VAL  36           H        VAL  36 -17.407   1.635  -0.225
  271    HA   VAL  36           HA       VAL  36 -18.007   1.418   2.609
  272    HB   VAL  36           HB       VAL  36 -17.586  -0.550   1.149
  273   1HG1  VAL  36          1HG1      VAL  36 -15.679   0.746  -0.082
  274   2HG1  VAL  36          2HG1      VAL  36 -14.651   0.120   1.206
  275   3HG1  VAL  36          3HG1      VAL  36 -15.514  -0.994   0.147
  276   1HG2  VAL  36          1HG2      VAL  36 -16.998  -0.386   3.729
  277   2HG2  VAL  36          2HG2      VAL  36 -16.552  -1.817   2.801
  278   3HG2  VAL  36          3HG2      VAL  36 -15.344  -0.582   3.141
  279    H    SER  37           H        SER  37 -16.503   3.785   1.396
  280    HA   SER  37           HA       SER  37 -13.875   3.701   2.665
  281   1HB   SER  37          1HB       SER  37 -15.238   6.201   1.668
  282   2HB   SER  37          2HB       SER  37 -13.515   5.834   1.730
  283    HG   SER  37           HG       SER  37 -15.434   4.480   0.135
  284    H    ASP  38           H        ASP  38 -14.064   3.553   4.860
  285    HA   ASP  38           HA       ASP  38 -14.747   5.929   6.342
  286   1HB   ASP  38          1HB       ASP  38 -16.641   3.571   6.381
  287   2HB   ASP  38          2HB       ASP  38 -16.473   4.602   7.801
  288    H    TYR  39           H        TYR  39 -15.416   3.072   8.075
  289    HA   TYR  39           HA       TYR  39 -13.045   3.255   9.661
  290   1HB   TYR  39          1HB       TYR  39 -14.972   2.095  10.553
  291   2HB   TYR  39          2HB       TYR  39 -15.001   0.981   9.186
  292    HD1  TYR  39           HD1      TYR  39 -13.336   1.842  12.354
  293    HD2  TYR  39           HD2      TYR  39 -13.329  -0.770   8.948
  294    HE1  TYR  39           HE1      TYR  39 -11.786   0.304  13.534
  295    HE2  TYR  39           HE2      TYR  39 -11.785  -2.303  10.119
  296    HH   TYR  39           HH       TYR  39 -11.351  -2.606  13.032
  297    H    TYR  40           H        TYR  40 -13.943   1.303   6.867
  298    HA   TYR  40           HA       TYR  40 -11.616  -0.318   6.692
  299   1HB   TYR  40          1HB       TYR  40 -13.375   0.716   4.442
  300   2HB   TYR  40          2HB       TYR  40 -12.287  -0.669   4.354
  301    HD1  TYR  40           HD1      TYR  40 -15.543   0.526   5.389
  302    HD2  TYR  40           HD2      TYR  40 -12.703  -2.670   5.851
  303    HE1  TYR  40           HE1      TYR  40 -17.330  -0.936   6.300
  304    HE2  TYR  40           HE2      TYR  40 -14.492  -4.130   6.757
  305    HH   TYR  40           HH       TYR  40 -17.720  -2.877   7.433
  306    H    LYS  41           H        LYS  41 -12.246   2.981   5.497
  307    HA   LYS  41           HA       LYS  41  -9.952   3.137   3.810
  308   1HB   LYS  41          1HB       LYS  41 -10.675   5.284   3.426
  309   2HB   LYS  41          2HB       LYS  41 -12.099   4.769   4.323
  310   1HG   LYS  41          1HG       LYS  41 -10.999   5.614   6.425
  311   2HG   LYS  41          2HG       LYS  41  -9.702   6.271   5.433
  312   1HD   LYS  41          1HD       LYS  41 -12.568   6.979   4.804
  313   2HD   LYS  41          2HD       LYS  41 -11.726   7.813   6.105
  314   1HE   LYS  41          1HE       LYS  41 -10.454   7.560   3.384
  315   2HE   LYS  41          2HE       LYS  41 -11.620   8.837   3.719
  316   1HZ   LYS  41          1HZ       LYS  41 -10.113   9.137   5.825
  317   2HZ   LYS  41          2HZ       LYS  41  -8.943   8.425   4.820
  318   3HZ   LYS  41          3HZ       LYS  41  -9.710   9.866   4.348
  319    H    ASN  42           H        ASN  42 -10.453   3.806   7.238
  320    HA   ASN  42           HA       ASN  42  -7.803   4.798   7.723
  321   1HB   ASN  42          1HB       ASN  42  -9.871   3.555   9.552
  322   2HB   ASN  42          2HB       ASN  42  -8.340   4.210  10.132
  323   2HD2  ASN  42          2HD2      ASN  42  -7.982   6.554   8.820
  324   1HD2  ASN  42          1HD2      ASN  42  -9.296   7.606   9.032
  325    H    LEU  43           H        LEU  43  -9.256   1.595   7.705
  326    HA   LEU  43           HA       LEU  43  -7.116   0.167   8.908
  327   1HB   LEU  43          1HB       LEU  43  -9.327  -0.838   8.454
  328   2HB   LEU  43          2HB       LEU  43  -9.018  -0.739   6.722
  329    HG   LEU  43           HG       LEU  43  -7.068  -2.240   6.989
  330   1HD1  LEU  43          1HD1      LEU  43  -7.822  -1.993   9.891
  331   2HD1  LEU  43          2HD1      LEU  43  -7.086  -3.489   9.317
  332   3HD1  LEU  43          3HD1      LEU  43  -6.225  -1.964   9.145
  333   1HD2  LEU  43          1HD2      LEU  43  -9.295  -3.182   6.490
  334   2HD2  LEU  43          2HD2      LEU  43  -8.362  -4.288   7.498
  335   3HD2  LEU  43          3HD2      LEU  43  -9.635  -3.300   8.216
  336    H    ILE  44           H        ILE  44  -7.662   1.185   5.534
  337    HA   ILE  44           HA       ILE  44  -5.429  -0.180   4.390
  338    HB   ILE  44           HB       ILE  44  -6.588   2.521   3.603
  339   1HG1  ILE  44          1HG1      ILE  44  -8.348   0.857   3.572
  340   2HG1  ILE  44          2HG1      ILE  44  -7.853   1.160   1.911
  341   1HG2  ILE  44          1HG2      ILE  44  -4.955   0.507   2.028
  342   2HG2  ILE  44          2HG2      ILE  44  -5.662   1.982   1.372
  343   3HG2  ILE  44          3HG2      ILE  44  -4.390   2.080   2.586
  344   1HD1  ILE  44          1HD1      ILE  44  -6.233  -0.872   2.306
  345   2HD1  ILE  44          2HD1      ILE  44  -7.342  -1.254   3.624
  346   3HD1  ILE  44          3HD1      ILE  44  -7.936  -1.168   1.971
  347    H    ASN  45           H        ASN  45  -5.695   2.980   5.989
  348    HA   ASN  45           HA       ASN  45  -3.021   3.842   5.516
  349   1HB   ASN  45          1HB       ASN  45  -4.974   4.420   7.760
  350   2HB   ASN  45          2HB       ASN  45  -3.380   5.173   7.677
  351   2HD2  ASN  45          2HD2      ASN  45  -3.205   5.526   4.831
  352   1HD2  ASN  45          1HD2      ASN  45  -4.381   6.657   4.364
  353    H    ASN  46           H        ASN  46  -4.436   1.764   8.002
  354    HA   ASN  46           HA       ASN  46  -2.025   1.488   9.567
  355   1HB   ASN  46          1HB       ASN  46  -4.525  -0.210   9.335
  356   2HB   ASN  46          2HB       ASN  46  -3.228  -0.546  10.483
  357   2HD2  ASN  46          2HD2      ASN  46  -6.168   0.574  10.716
  358   1HD2  ASN  46          1HD2      ASN  46  -5.976   1.901  11.758
  359    H    ALA  47           H        ALA  47  -3.101   0.090   6.585
  360    HA   ALA  47           HA       ALA  47  -1.763  -2.416   6.645
  361   1HB   ALA  47          1HB       ALA  47  -1.991  -0.653   4.196
  362   2HB   ALA  47          2HB       ALA  47  -3.367  -1.533   4.862
  363   3HB   ALA  47          3HB       ALA  47  -1.963  -2.416   4.262
  364    H    LYS  48           H        LYS  48   0.368  -2.979   6.450
  365    HA   LYS  48           HA       LYS  48   2.354  -0.822   5.804
  366   1HB   LYS  48          1HB       LYS  48   3.879  -2.396   7.312
  367   2HB   LYS  48          2HB       LYS  48   2.835  -1.185   8.049
  368   1HG   LYS  48          1HG       LYS  48   2.611  -3.358   9.189
  369   2HG   LYS  48          2HG       LYS  48   1.094  -2.893   8.422
  370   1HD   LYS  48          1HD       LYS  48   1.475  -4.400   6.583
  371   2HD   LYS  48          2HD       LYS  48   3.132  -4.706   7.107
  372   1HE   LYS  48          1HE       LYS  48   1.587  -6.554   7.737
  373   2HE   LYS  48          2HE       LYS  48   2.318  -5.785   9.146
  374   1HZ   LYS  48          1HZ       LYS  48  -0.333  -5.017   8.064
  375   2HZ   LYS  48          2HZ       LYS  48  -0.129  -6.166   9.297
  376   3HZ   LYS  48          3HZ       LYS  48   0.353  -4.560   9.549
  377    H    THR  49           H        THR  49   0.966  -3.356   4.428
  378    HA   THR  49           HA       THR  49   3.472  -4.107   2.986
  379    HB   THR  49           HB       THR  49   1.385  -6.191   3.647
  380    HG1  THR  49           HG1      THR  49   3.738  -6.037   5.118
  381   1HG2  THR  49          1HG2      THR  49   4.332  -6.280   2.962
  382   2HG2  THR  49          2HG2      THR  49   3.324  -7.690   3.286
  383   3HG2  THR  49          3HG2      THR  49   3.004  -6.683   1.875
  384    H    VAL  50           H        VAL  50   3.124  -3.557   0.912
  385    HA   VAL  50           HA       VAL  50   0.592  -2.897  -0.192
  386    HB   VAL  50           HB       VAL  50   2.662  -2.095  -1.166
  387   1HG1  VAL  50          1HG1      VAL  50   3.929  -4.246  -0.687
  388   2HG1  VAL  50          2HG1      VAL  50   3.155  -4.925  -2.118
  389   3HG1  VAL  50          3HG1      VAL  50   4.234  -3.540  -2.273
  390   1HG2  VAL  50          1HG2      VAL  50   0.585  -2.464  -2.580
  391   2HG2  VAL  50          2HG2      VAL  50   2.099  -2.382  -3.479
  392   3HG2  VAL  50          3HG2      VAL  50   1.344  -3.945  -3.162
  393    H    GLU  51           H        GLU  51   2.404  -5.951  -0.242
  394    HA   GLU  51           HA       GLU  51   0.731  -7.309  -2.111
  395   1HB   GLU  51          1HB       GLU  51   2.306  -8.338   0.272
  396   2HB   GLU  51          2HB       GLU  51   1.501  -9.393  -0.890
  397   1HG   GLU  51          1HG       GLU  51   3.525  -7.286  -1.687
  398   2HG   GLU  51          2HG       GLU  51   3.949  -8.971  -1.377
  399    H    GLY  52           H        GLY  52   0.514  -6.791   1.372
  400   1HA   GLY  52          1HA       GLY  52  -1.229  -7.235   2.884
  401   2HA   GLY  52          2HA       GLY  52  -1.912  -8.346   1.698
  402    H    VAL  53           H        VAL  53  -1.185  -4.962   0.906
  403    HA   VAL  53           HA       VAL  53  -3.740  -3.868   1.539
  404    HB   VAL  53           HB       VAL  53  -1.716  -3.098  -0.581
  405   1HG1  VAL  53          1HG1      VAL  53  -4.321  -1.787   0.232
  406   2HG1  VAL  53          2HG1      VAL  53  -3.013  -0.883  -0.530
  407   3HG1  VAL  53          3HG1      VAL  53  -3.784  -2.215  -1.392
  408   1HG2  VAL  53          1HG2      VAL  53  -1.275  -2.909   1.978
  409   2HG2  VAL  53          2HG2      VAL  53  -0.979  -1.486   0.986
  410   3HG2  VAL  53          3HG2      VAL  53  -2.456  -1.603   1.941
  411    H    LYS  54           H        LYS  54  -2.594  -5.230  -1.586
  412    HA   LYS  54           HA       LYS  54  -5.135  -4.905  -2.886
  413   1HB   LYS  54          1HB       LYS  54  -2.705  -6.609  -3.431
  414   2HB   LYS  54          2HB       LYS  54  -4.162  -6.806  -4.402
  415   1HG   LYS  54          1HG       LYS  54  -2.758  -5.231  -5.553
  416   2HG   LYS  54          2HG       LYS  54  -4.084  -4.309  -4.852
  417   1HD   LYS  54          1HD       LYS  54  -2.691  -3.555  -3.032
  418   2HD   LYS  54          2HD       LYS  54  -1.392  -4.652  -3.505
  419   1HE   LYS  54          1HE       LYS  54  -2.455  -2.433  -5.273
  420   2HE   LYS  54          2HE       LYS  54  -1.032  -2.272  -4.245
  421   1HZ   LYS  54          1HZ       LYS  54  -0.337  -4.452  -5.458
  422   2HZ   LYS  54          2HZ       LYS  54  -1.416  -3.906  -6.651
  423   3HZ   LYS  54          3HZ       LYS  54  -0.090  -2.946  -6.197
  424    H    ALA  55           H        ALA  55  -3.714  -7.605  -1.063
  425    HA   ALA  55           HA       ALA  55  -5.927  -9.399  -1.578
  426   1HB   ALA  55          1HB       ALA  55  -4.946 -10.747   0.262
  427   2HB   ALA  55          2HB       ALA  55  -3.842  -9.420   0.626
  428   3HB   ALA  55          3HB       ALA  55  -3.729 -10.262  -0.919
  429    H    LEU  56           H        LEU  56  -5.353  -6.846   0.714
  430    HA   LEU  56           HA       LEU  56  -7.282  -7.682   2.680
  431   1HB   LEU  56          1HB       LEU  56  -5.523  -6.041   3.204
  432   2HB   LEU  56          2HB       LEU  56  -6.212  -4.916   2.037
  433    HG   LEU  56           HG       LEU  56  -8.294  -4.805   3.350
  434   1HD1  LEU  56          1HD1      LEU  56  -6.898  -6.929   4.966
  435   2HD1  LEU  56          2HD1      LEU  56  -8.038  -5.845   5.764
  436   3HD1  LEU  56          3HD1      LEU  56  -8.576  -6.858   4.426
  437   1HD2  LEU  56          1HD2      LEU  56  -6.130  -3.413   3.865
  438   2HD2  LEU  56          2HD2      LEU  56  -7.465  -3.382   5.015
  439   3HD2  LEU  56          3HD2      LEU  56  -6.056  -4.395   5.329
  440    H    ILE  57           H        ILE  57  -7.438  -5.593  -0.183
  441    HA   ILE  57           HA       ILE  57 -10.149  -4.734   0.214
  442    HB   ILE  57           HB       ILE  57  -8.700  -5.174  -2.414
  443   1HG1  ILE  57          1HG1      ILE  57  -7.356  -3.691  -1.034
  444   2HG1  ILE  57          2HG1      ILE  57  -8.191  -2.708  -2.230
  445   1HG2  ILE  57          1HG2      ILE  57 -11.172  -3.649  -1.607
  446   2HG2  ILE  57          2HG2      ILE  57 -10.271  -3.231  -3.065
  447   3HG2  ILE  57          3HG2      ILE  57 -10.973  -4.836  -2.893
  448   1HD1  ILE  57          1HD1      ILE  57 -10.023  -2.465  -0.363
  449   2HD1  ILE  57          2HD1      ILE  57  -8.723  -2.955   0.719
  450   3HD1  ILE  57          3HD1      ILE  57  -8.555  -1.498  -0.258
  451    H    ASP  58           H        ASP  58  -8.673  -7.570  -1.286
  452    HA   ASP  58           HA       ASP  58 -11.033  -8.629  -2.495
  453   1HB   ASP  58          1HB       ASP  58  -8.602 -10.010  -1.325
  454   2HB   ASP  58          2HB       ASP  58  -9.865 -10.861  -2.215
  455    H    GLU  59           H        GLU  59  -9.751  -8.916   0.800
  456    HA   GLU  59           HA       GLU  59 -11.801 -10.739   1.706
  457   1HB   GLU  59          1HB       GLU  59  -9.925  -8.870   3.180
  458   2HB   GLU  59          2HB       GLU  59 -11.034  -9.974   3.996
  459   1HG   GLU  59          1HG       GLU  59  -9.995 -11.885   2.831
  460   2HG   GLU  59          2HG       GLU  59  -8.882 -10.784   2.017
  461    H    ILE  60           H        ILE  60 -11.393  -7.217   1.721
  462    HA   ILE  60           HA       ILE  60 -13.784  -6.688   3.222
  463    HB   ILE  60           HB       ILE  60 -12.251  -4.937   1.280
  464   1HG1  ILE  60          1HG1      ILE  60 -12.248  -4.950   4.311
  465   2HG1  ILE  60          2HG1      ILE  60 -11.050  -5.805   3.342
  466   1HG2  ILE  60          1HG2      ILE  60 -14.452  -4.320   3.272
  467   2HG2  ILE  60          2HG2      ILE  60 -13.411  -3.085   2.565
  468   3HG2  ILE  60          3HG2      ILE  60 -14.477  -4.037   1.532
  469   1HD1  ILE  60          1HD1      ILE  60 -11.609  -2.858   2.971
  470   2HD1  ILE  60          2HD1      ILE  60 -10.404  -3.450   4.113
  471   3HD1  ILE  60          3HD1      ILE  60 -10.224  -3.782   2.391
  472    H    LEU  61           H        LEU  61 -13.085  -6.893  -0.259
  473    HA   LEU  61           HA       LEU  61 -15.753  -6.142  -1.071
  474   1HB   LEU  61          1HB       LEU  61 -13.544  -7.649  -2.503
  475   2HB   LEU  61          2HB       LEU  61 -15.077  -7.233  -3.268
  476    HG   LEU  61           HG       LEU  61 -13.116  -5.254  -2.066
  477   1HD1  LEU  61          1HD1      LEU  61 -13.784  -5.937  -4.948
  478   2HD1  LEU  61          2HD1      LEU  61 -12.708  -4.637  -4.437
  479   3HD1  LEU  61          3HD1      LEU  61 -12.274  -6.319  -4.123
  480   1HD2  LEU  61          1HD2      LEU  61 -15.865  -4.998  -3.263
  481   2HD2  LEU  61          2HD2      LEU  61 -15.134  -4.094  -1.938
  482   3HD2  LEU  61          3HD2      LEU  61 -14.694  -3.722  -3.600
  483    H    ALA  62           H        ALA  62 -14.155  -9.237  -0.424
  484    HA   ALA  62           HA       ALA  62 -16.331 -10.903  -1.263
  485   1HB   ALA  62          1HB       ALA  62 -14.319 -11.484   0.931
  486   2HB   ALA  62          2HB       ALA  62 -13.984 -11.688  -0.789
  487   3HB   ALA  62          3HB       ALA  62 -15.230 -12.664  -0.011
  488    H    ALA  63           H        ALA  63 -15.885  -8.875   1.484
  489    HA   ALA  63           HA       ALA  63 -17.507 -10.195   3.411
  490   1HB   ALA  63          1HB       ALA  63 -16.082  -8.169   3.840
  491   2HB   ALA  63          2HB       ALA  63 -17.282  -7.202   2.981
  492   3HB   ALA  63          3HB       ALA  63 -17.719  -8.026   4.478
  493    H    LEU  64           H        LEU  64 -18.373  -7.993   0.754
  494    HA   LEU  64           HA       LEU  64 -21.139  -7.781   1.435
  495   1HB   LEU  64          1HB       LEU  64 -19.669  -7.523  -1.201
  496   2HB   LEU  64          2HB       LEU  64 -21.385  -7.174  -1.038
  497    HG   LEU  64           HG       LEU  64 -19.382  -5.853   0.801
  498   1HD1  LEU  64          1HD1      LEU  64 -20.203  -4.893  -1.958
  499   2HD1  LEU  64          2HD1      LEU  64 -19.282  -3.955  -0.784
  500   3HD1  LEU  64          3HD1      LEU  64 -18.588  -5.417  -1.484
  501   1HD2  LEU  64          1HD2      LEU  64 -22.147  -5.145  -0.241
  502   2HD2  LEU  64          2HD2      LEU  64 -21.703  -5.544   1.418
  503   3HD2  LEU  64          3HD2      LEU  64 -21.148  -4.038   0.697
  504    HA   PRO  65           HA       PRO  65 -22.615 -11.841   0.350
  505   1HB   PRO  65          1HB       PRO  65 -25.019 -11.048  -0.964
  506   2HB   PRO  65          2HB       PRO  65 -24.827 -11.447   0.747
  507   1HG   PRO  65          1HG       PRO  65 -25.107  -8.797  -0.527
  508   2HG   PRO  65          2HG       PRO  65 -25.394  -9.267   1.153
  509   1HD   PRO  65          1HD       PRO  65 -23.203  -7.767   0.258
  510   2HD   PRO  65          2HD       PRO  65 -23.266  -8.654   1.800

  No H/Q in entry =         510
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1  25.405  11.832 -21.404
    2    H2   MET   1           H2       MET   1  26.594  11.293 -22.486
    3    H3   MET   1           H3       MET   1  26.818  12.746 -21.635
    4    HA   MET   1           HA       MET   1  25.073  13.818 -22.818
    5   1HB   MET   1          1HB       MET   1  27.355  13.618 -23.877
    6   2HB   MET   1          2HB       MET   1  26.755  12.235 -24.788
    7   1HG   MET   1          1HG       MET   1  26.527  14.175 -26.202
    8   2HG   MET   1          2HG       MET   1  24.906  13.742 -25.658
    9   1HE   MET   1          1HE       MET   1  24.486  15.992 -26.676
   10   2HE   MET   1          2HE       MET   1  24.667  17.542 -25.844
   11   3HE   MET   1          3HE       MET   1  26.028  16.843 -26.718
   12    H    LYS   2           H        LYS   2  25.235  11.664 -25.451
   13    HA   LYS   2           HA       LYS   2  22.386  11.242 -25.435
   14   1HB   LYS   2          1HB       LYS   2  24.617   9.994 -27.055
   15   2HB   LYS   2          2HB       LYS   2  22.911   9.644 -27.333
   16   1HG   LYS   2          1HG       LYS   2  22.536  12.135 -27.587
   17   2HG   LYS   2          2HG       LYS   2  24.285  12.336 -27.554
   18   1HD   LYS   2          1HD       LYS   2  22.919  10.476 -29.510
   19   2HD   LYS   2          2HD       LYS   2  23.189  12.178 -29.872
   20   1HE   LYS   2          1HE       LYS   2  25.309  10.098 -29.254
   21   2HE   LYS   2          2HE       LYS   2  25.028  10.898 -30.796
   22   1HZ   LYS   2          1HZ       LYS   2  25.381  13.033 -29.398
   23   2HZ   LYS   2          2HZ       LYS   2  26.183  11.988 -28.324
   24   3HZ   LYS   2          3HZ       LYS   2  26.724  12.143 -29.927
   25    H    ALA   3           H        ALA   3  25.163   9.225 -24.540
   26    HA   ALA   3           HA       ALA   3  24.016   6.724 -24.243
   27   1HB   ALA   3          1HB       ALA   3  25.902   8.125 -22.327
   28   2HB   ALA   3          2HB       ALA   3  25.566   6.394 -22.306
   29   3HB   ALA   3          3HB       ALA   3  26.355   7.121 -23.704
   30    H    ILE   4           H        ILE   4  24.255   8.895 -21.399
   31    HA   ILE   4           HA       ILE   4  21.559   7.885 -20.519
   32    HB   ILE   4           HB       ILE   4  23.929   8.714 -18.814
   33   1HG1  ILE   4          1HG1      ILE   4  24.346   6.546 -19.841
   34   2HG1  ILE   4          2HG1      ILE   4  23.942   6.301 -18.146
   35   1HG2  ILE   4          1HG2      ILE   4  21.138   7.762 -18.149
   36   2HG2  ILE   4          2HG2      ILE   4  22.462   7.711 -16.985
   37   3HG2  ILE   4          3HG2      ILE   4  21.924   9.257 -17.642
   38   1HD1  ILE   4          1HD1      ILE   4  21.479   6.029 -19.092
   39   2HD1  ILE   4          2HD1      ILE   4  22.327   5.661 -20.591
   40   3HD1  ILE   4          3HD1      ILE   4  22.613   4.683 -19.155
   41    H    PHE   5           H        PHE   5  20.051   9.443 -20.338
   42    HA   PHE   5           HA       PHE   5  20.945  12.297 -20.056
   43   1HB   PHE   5          1HB       PHE   5  19.393  11.133 -22.087
   44   2HB   PHE   5          2HB       PHE   5  18.192  11.895 -21.054
   45    HD1  PHE   5           HD1      PHE   5  19.702  12.518 -23.961
   46    HD2  PHE   5           HD2      PHE   5  19.547  14.275 -20.041
   47    HE1  PHE   5           HE1      PHE   5  20.274  14.729 -24.928
   48    HE2  PHE   5           HE2      PHE   5  20.119  16.484 -21.011
   49    HZ   PHE   5           HZ       PHE   5  20.481  16.711 -23.453
   50    H    VAL   6           H        VAL   6  19.115   9.704 -18.705
   51    HA   VAL   6           HA       VAL   6  18.063  11.550 -16.580
   52    HB   VAL   6           HB       VAL   6  16.061  10.138 -16.422
   53   1HG1  VAL   6          1HG1      VAL   6  16.706  11.215 -19.176
   54   2HG1  VAL   6          2HG1      VAL   6  15.094  10.682 -18.702
   55   3HG1  VAL   6          3HG1      VAL   6  15.853  12.041 -17.873
   56   1HG2  VAL   6          1HG2      VAL   6  17.411   8.633 -18.676
   57   2HG2  VAL   6          2HG2      VAL   6  16.880   7.998 -17.119
   58   3HG2  VAL   6          3HG2      VAL   6  15.689   8.479 -18.328
   59    H    LEU   7           H        LEU   7  17.784  10.446 -14.479
   60    HA   LEU   7           HA       LEU   7  20.040   8.852 -13.767
   61   1HB   LEU   7          1HB       LEU   7  17.385   9.136 -12.320
   62   2HB   LEU   7          2HB       LEU   7  18.881   8.530 -11.610
   63    HG   LEU   7           HG       LEU   7  18.498  11.304 -12.779
   64   1HD1  LEU   7          1HD1      LEU   7  17.263  10.971 -10.670
   65   2HD1  LEU   7          2HD1      LEU   7  18.733  10.372  -9.900
   66   3HD1  LEU   7          3HD1      LEU   7  18.636  12.051 -10.430
   67   1HD2  LEU   7          1HD2      LEU   7  20.858   9.823 -11.622
   68   2HD2  LEU   7          2HD2      LEU   7  20.792  10.901 -13.018
   69   3HD2  LEU   7          3HD2      LEU   7  20.740  11.568 -11.391
   70    H    ASN   8           H        ASN   8  20.305   6.640 -13.587
   71    HA   ASN   8           HA       ASN   8  18.033   4.811 -13.796
   72   1HB   ASN   8          1HB       ASN   8  18.558   5.531 -16.189
   73   2HB   ASN   8          2HB       ASN   8  20.111   4.715 -15.995
   74   2HD2  ASN   8          2HD2      ASN   8  20.002   2.669 -16.923
   75   1HD2  ASN   8          1HD2      ASN   8  18.668   1.624 -16.830
   76    H    ALA   9           H        ALA   9  18.740   2.562 -13.454
   77    HA   ALA   9           HA       ALA   9  21.560   2.037 -12.914
   78   1HB   ALA   9          1HB       ALA   9  20.750   3.295 -10.867
   79   2HB   ALA   9          2HB       ALA   9  21.393   1.687 -10.540
   80   3HB   ALA   9          3HB       ALA   9  19.649   1.950 -10.565
   81    H    GLN  10           H        GLN  10  20.228   0.079 -10.781
   82    HA   GLN  10           HA       GLN  10  19.995  -2.132 -12.680
   83   1HB   GLN  10          1HB       GLN  10  19.706  -1.957  -9.669
   84   2HB   GLN  10          2HB       GLN  10  19.528  -3.462 -10.571
   85   1HG   GLN  10          1HG       GLN  10  21.807  -3.378  -9.819
   86   2HG   GLN  10          2HG       GLN  10  21.833  -3.021 -11.546
   87   2HE2  GLN  10          2HE2      GLN  10  21.081  -0.935  -8.694
   88   1HE2  GLN  10          1HE2      GLN  10  22.231   0.253  -9.079
   89    H    HIS  11           H        HIS  11  18.077  -3.560 -12.715
   90    HA   HIS  11           HA       HIS  11  15.658  -2.126 -13.189
   91   1HB   HIS  11          1HB       HIS  11  14.603  -4.336 -13.376
   92   2HB   HIS  11          2HB       HIS  11  16.167  -4.343 -14.189
   93    HD1  HIS  11           HD1      HIS  11  18.172  -5.510 -12.894
   94    HD2  HIS  11           HD2      HIS  11  14.411  -6.092 -11.192
   95    HE1  HIS  11           HE1      HIS  11  18.417  -7.421 -11.252
   96    H    ASP  12           H        ASP  12  17.114  -2.878 -10.268
   97    HA   ASP  12           HA       ASP  12  14.924  -3.645  -8.623
   98   1HB   ASP  12          1HB       ASP  12  17.401  -2.009  -8.013
   99   2HB   ASP  12          2HB       ASP  12  16.265  -2.547  -6.776
  100    H    GLU  13           H        GLU  13  13.459  -2.374  -7.389
  101    HA   GLU  13           HA       GLU  13  12.403  -0.061  -8.655
  102   1HB   GLU  13          1HB       GLU  13  11.130  -1.506  -7.073
  103   2HB   GLU  13          2HB       GLU  13  12.112  -0.883  -5.747
  104   1HG   GLU  13          1HG       GLU  13  11.318   1.402  -6.218
  105   2HG   GLU  13          2HG       GLU  13  10.344   0.791  -7.556
  106    H    ALA  14           H        ALA  14  12.919   2.077  -8.491
  107    HA   ALA  14           HA       ALA  14  14.245   3.222  -6.189
  108   1HB   ALA  14          1HB       ALA  14  15.864   2.584  -8.660
  109   2HB   ALA  14          2HB       ALA  14  16.317   3.902  -7.578
  110   3HB   ALA  14          3HB       ALA  14  16.260   2.244  -6.976
  111    H    VAL  15           H        VAL  15  12.526   3.389  -9.053
  112    HA   VAL  15           HA       VAL  15  13.081   6.048  -9.948
  113    HB   VAL  15           HB       VAL  15  11.763   4.363 -11.246
  114   1HG1  VAL  15          1HG1      VAL  15  10.418   3.598  -9.236
  115   2HG1  VAL  15          2HG1      VAL  15   9.485   5.087  -9.381
  116   3HG1  VAL  15          3HG1      VAL  15   9.465   3.904 -10.687
  117   1HG2  VAL  15          1HG2      VAL  15  11.653   6.831 -11.706
  118   2HG2  VAL  15          2HG2      VAL  15  10.191   5.964 -12.172
  119   3HG2  VAL  15          3HG2      VAL  15  10.217   6.912 -10.685
  120    H    ASP  16           H        ASP  16  10.770   4.794  -7.555
  121    HA   ASP  16           HA       ASP  16  10.762   7.392  -6.204
  122   1HB   ASP  16          1HB       ASP  16   9.070   7.637  -8.057
  123   2HB   ASP  16          2HB       ASP  16   8.158   6.317  -7.326
  124    H    ALA  17           H        ALA  17  10.199   7.147  -4.056
  125    HA   ALA  17           HA       ALA  17   9.781   4.368  -3.110
  126   1HB   ALA  17          1HB       ALA  17  10.150   6.860  -1.432
  127   2HB   ALA  17          2HB       ALA  17  10.447   5.186  -0.964
  128   3HB   ALA  17          3HB       ALA  17  11.511   5.980  -2.126
  129    H    ASN  18           H        ASN  18   7.847   6.815  -4.121
  130    HA   ASN  18           HA       ASN  18   5.845   6.725  -1.976
  131   1HB   ASN  18          1HB       ASN  18   5.839   7.978  -4.736
  132   2HB   ASN  18          2HB       ASN  18   4.505   8.116  -3.589
  133   2HD2  ASN  18          2HD2      ASN  18   5.719   8.583  -1.172
  134   1HD2  ASN  18          1HD2      ASN  18   6.680   9.980  -1.231
  135    H    SER  19           H        SER  19   6.703   4.544  -4.313
  136    HA   SER  19           HA       SER  19   4.224   3.817  -5.514
  137   1HB   SER  19          1HB       SER  19   6.485   2.901  -6.152
  138   2HB   SER  19          2HB       SER  19   6.443   1.920  -4.690
  139    HG   SER  19           HG       SER  19   4.170   1.802  -6.242
  140    H    LEU  20           H        LEU  20   5.726   2.741  -2.457
  141    HA   LEU  20           HA       LEU  20   3.686   0.889  -1.713
  142   1HB   LEU  20          1HB       LEU  20   6.027   1.406  -0.636
  143   2HB   LEU  20          2HB       LEU  20   5.143   2.597   0.312
  144    HG   LEU  20           HG       LEU  20   4.413  -0.345   0.135
  145   1HD1  LEU  20          1HD1      LEU  20   6.581   0.021   1.267
  146   2HD1  LEU  20          2HD1      LEU  20   5.815   1.187   2.346
  147   3HD1  LEU  20          3HD1      LEU  20   5.342  -0.511   2.404
  148   1HD2  LEU  20          1HD2      LEU  20   3.287   2.033   1.614
  149   2HD2  LEU  20          2HD2      LEU  20   2.436   0.754   0.748
  150   3HD2  LEU  20          3HD2      LEU  20   3.153   0.422   2.321
  151    H    ALA  21           H        ALA  21   4.093   4.340  -0.880
  152    HA   ALA  21           HA       ALA  21   1.660   4.611   0.566
  153   1HB   ALA  21          1HB       ALA  21   3.248   6.667  -0.994
  154   2HB   ALA  21          2HB       ALA  21   3.420   6.293   0.722
  155   3HB   ALA  21          3HB       ALA  21   1.942   7.052   0.129
  156    H    GLU  22           H        GLU  22   2.423   4.999  -2.869
  157    HA   GLU  22           HA       GLU  22  -0.068   6.086  -3.709
  158   1HB   GLU  22          1HB       GLU  22   1.948   5.954  -5.154
  159   2HB   GLU  22          2HB       GLU  22   1.771   4.201  -5.216
  160   1HG   GLU  22          1HG       GLU  22  -0.406   4.420  -6.297
  161   2HG   GLU  22          2HG       GLU  22  -0.316   6.179  -6.172
  162    H    ALA  23           H        ALA  23   0.954   2.703  -3.241
  163    HA   ALA  23           HA       ALA  23  -1.376   1.481  -4.322
  164   1HB   ALA  23          1HB       ALA  23  -0.816  -0.437  -2.838
  165   2HB   ALA  23          2HB       ALA  23   0.606   0.170  -3.688
  166   3HB   ALA  23          3HB       ALA  23   0.350   0.580  -1.991
  167    H    LYS  24           H        LYS  24  -0.679   2.746  -1.075
  168    HA   LYS  24           HA       LYS  24  -3.153   1.966   0.137
  169   1HB   LYS  24          1HB       LYS  24  -1.288   4.298   0.692
  170   2HB   LYS  24          2HB       LYS  24  -2.659   3.874   1.720
  171   1HG   LYS  24          1HG       LYS  24  -1.702   1.631   2.082
  172   2HG   LYS  24          2HG       LYS  24  -0.327   2.051   1.057
  173   1HD   LYS  24          1HD       LYS  24   0.262   3.891   2.594
  174   2HD   LYS  24          2HD       LYS  24  -1.108   3.472   3.621
  175   1HE   LYS  24          1HE       LYS  24   1.012   1.435   2.934
  176   2HE   LYS  24          2HE       LYS  24   1.206   2.542   4.293
  177   1HZ   LYS  24          1HZ       LYS  24  -1.301   1.042   4.016
  178   2HZ   LYS  24          2HZ       LYS  24   0.066   0.248   4.629
  179   3HZ   LYS  24          3HZ       LYS  24  -0.541   1.625   5.419
  180    H    VAL  25           H        VAL  25  -2.156   4.837  -1.696
  181    HA   VAL  25           HA       VAL  25  -4.634   6.262  -1.363
  182    HB   VAL  25           HB       VAL  25  -2.434   6.470  -3.433
  183   1HG1  VAL  25          1HG1      VAL  25  -4.932   8.127  -3.021
  184   2HG1  VAL  25          2HG1      VAL  25  -3.510   8.752  -3.860
  185   3HG1  VAL  25          3HG1      VAL  25  -4.374   7.357  -4.507
  186   1HG2  VAL  25          1HG2      VAL  25  -3.187   8.126  -1.004
  187   2HG2  VAL  25          2HG2      VAL  25  -1.772   7.084  -1.159
  188   3HG2  VAL  25          3HG2      VAL  25  -1.907   8.541  -2.145
  189    H    LEU  26           H        LEU  26  -3.347   4.249  -4.020
  190    HA   LEU  26           HA       LEU  26  -5.616   4.460  -5.722
  191   1HB   LEU  26          1HB       LEU  26  -3.588   2.233  -5.373
  192   2HB   LEU  26          2HB       LEU  26  -4.780   2.267  -6.672
  193    HG   LEU  26           HG       LEU  26  -2.738   4.447  -6.143
  194   1HD1  LEU  26          1HD1      LEU  26  -2.773   2.144  -8.112
  195   2HD1  LEU  26          2HD1      LEU  26  -1.696   3.533  -8.262
  196   3HD1  LEU  26          3HD1      LEU  26  -1.571   2.467  -6.862
  197   1HD2  LEU  26          1HD2      LEU  26  -4.959   4.076  -8.139
  198   2HD2  LEU  26          2HD2      LEU  26  -4.393   5.548  -7.351
  199   3HD2  LEU  26          3HD2      LEU  26  -3.478   4.858  -8.687
  200    H    ALA  27           H        ALA  27  -4.903   2.187  -3.081
  201    HA   ALA  27           HA       ALA  27  -7.258   0.573  -3.493
  202   1HB   ALA  27          1HB       ALA  27  -5.288  -0.161  -2.145
  203   2HB   ALA  27          2HB       ALA  27  -5.703   1.046  -0.928
  204   3HB   ALA  27          3HB       ALA  27  -6.801  -0.296  -1.249
  205    H    ASN  28           H        ASN  28  -6.533   3.418  -1.513
  206    HA   ASN  28           HA       ASN  28  -9.012   3.542  -0.107
  207   1HB   ASN  28          1HB       ASN  28  -6.834   4.893   0.266
  208   2HB   ASN  28          2HB       ASN  28  -7.447   5.975  -0.983
  209   2HD2  ASN  28          2HD2      ASN  28  -7.282   5.808   2.273
  210   1HD2  ASN  28          1HD2      ASN  28  -8.747   6.555   2.698
  211    H    ARG  29           H        ARG  29  -8.008   4.837  -3.260
  212    HA   ARG  29           HA       ARG  29 -10.352   6.347  -3.818
  213   1HB   ARG  29          1HB       ARG  29  -8.432   4.903  -5.661
  214   2HB   ARG  29          2HB       ARG  29  -9.725   5.951  -6.243
  215   1HG   ARG  29          1HG       ARG  29  -7.564   6.811  -4.303
  216   2HG   ARG  29          2HG       ARG  29  -7.514   7.122  -6.035
  217   1HD   ARG  29          1HD       ARG  29 -10.019   8.089  -5.365
  218   2HD   ARG  29          2HD       ARG  29  -9.088   8.486  -3.925
  219    HE   ARG  29           HE       ARG  29  -9.002   9.949  -6.313
  220   1HH1  ARG  29          1HH1      ARG  29  -7.246  11.155  -7.014
  221   2HH1  ARG  29          2HH1      ARG  29  -5.671  10.830  -6.371
  222   1HH2  ARG  29          1HH2      ARG  29  -6.745   8.290  -4.288
  223   2HH2  ARG  29          2HH2      ARG  29  -5.390   9.207  -4.839
  224    H    GLU  30           H        GLU  30  -9.619   2.909  -4.345
  225    HA   GLU  30           HA       GLU  30 -11.948   2.265  -5.841
  226   1HB   GLU  30          1HB       GLU  30 -10.041   0.717  -5.571
  227   2HB   GLU  30          2HB       GLU  30 -10.431   0.535  -3.860
  228   1HG   GLU  30          1HG       GLU  30 -12.628  -0.412  -4.446
  229   2HG   GLU  30          2HG       GLU  30 -12.267  -0.205  -6.160
  230    H    LEU  31           H        LEU  31 -11.415   2.134  -2.307
  231    HA   LEU  31           HA       LEU  31 -14.101   1.311  -1.679
  232   1HB   LEU  31          1HB       LEU  31 -12.303   2.994   0.085
  233   2HB   LEU  31          2HB       LEU  31 -13.560   1.863   0.591
  234    HG   LEU  31           HG       LEU  31 -10.972   1.187  -0.808
  235   1HD1  LEU  31          1HD1      LEU  31 -12.025   0.784   2.001
  236   2HD1  LEU  31          2HD1      LEU  31 -10.677  -0.156   1.363
  237   3HD1  LEU  31          3HD1      LEU  31 -10.540   1.596   1.502
  238   1HD2  LEU  31          1HD2      LEU  31 -13.425  -0.453  -0.137
  239   2HD2  LEU  31          2HD2      LEU  31 -12.514  -0.399  -1.647
  240   3HD2  LEU  31          3HD2      LEU  31 -11.840  -1.217  -0.241
  241    H    ASP  32           H        ASP  32 -12.520   4.415  -2.066
  242    HA   ASP  32           HA       ASP  32 -14.600   6.104  -1.137
  243   1HB   ASP  32          1HB       ASP  32 -12.281   6.829  -1.659
  244   2HB   ASP  32          2HB       ASP  32 -12.622   6.602  -3.372
  245    H    LYS  33           H        LYS  33 -14.023   4.626  -4.317
  246    HA   LYS  33           HA       LYS  33 -16.072   5.996  -5.742
  247   1HB   LYS  33          1HB       LYS  33 -14.369   4.577  -6.844
  248   2HB   LYS  33          2HB       LYS  33 -15.092   3.146  -6.106
  249   1HG   LYS  33          1HG       LYS  33 -17.145   3.462  -7.322
  250   2HG   LYS  33          2HG       LYS  33 -16.626   5.044  -7.894
  251   1HD   LYS  33          1HD       LYS  33 -16.352   3.353  -9.663
  252   2HD   LYS  33          2HD       LYS  33 -14.788   3.991  -9.161
  253   1HE   LYS  33          1HE       LYS  33 -15.022   1.422  -9.423
  254   2HE   LYS  33          2HE       LYS  33 -14.236   2.032  -7.969
  255   1HZ   LYS  33          1HZ       LYS  33 -16.385   1.867  -6.824
  256   2HZ   LYS  33          2HZ       LYS  33 -17.074   1.192  -8.219
  257   3HZ   LYS  33          3HZ       LYS  33 -15.845   0.360  -7.393
  258    H    TYR  34           H        TYR  34 -16.193   2.862  -3.995
  259    HA   TYR  34           HA       TYR  34 -19.038   2.547  -4.408
  260   1HB   TYR  34          1HB       TYR  34 -17.123   1.277  -2.435
  261   2HB   TYR  34          2HB       TYR  34 -18.826   0.837  -2.548
  262    HD1  TYR  34           HD1      TYR  34 -19.734  -0.079  -4.709
  263    HD2  TYR  34           HD2      TYR  34 -15.533   0.491  -4.037
  264    HE1  TYR  34           HE1      TYR  34 -19.225  -1.590  -6.609
  265    HE2  TYR  34           HE2      TYR  34 -15.022  -1.015  -5.939
  266    HH   TYR  34           HH       TYR  34 -17.639  -2.499  -7.858
  267    H    GLY  35           H        GLY  35 -17.052   4.103  -1.962
  268   1HA   GLY  35          1HA       GLY  35 -19.532   5.250  -0.751
  269   2HA   GLY  35          2HA       GLY  35 -17.920   5.954  -0.641
  270    H    VAL  36           H        VAL  36 -17.787   2.605  -0.205
  271    HA   VAL  36           HA       VAL  36 -18.436   2.559   2.630
  272    HB   VAL  36           HB       VAL  36 -17.557   0.266   2.557
  273   1HG1  VAL  36          1HG1      VAL  36 -19.849   0.739   1.702
  274   2HG1  VAL  36          2HG1      VAL  36 -19.178   0.916   0.079
  275   3HG1  VAL  36          3HG1      VAL  36 -19.105  -0.645   0.898
  276   1HG2  VAL  36          1HG2      VAL  36 -16.574   1.161  -0.157
  277   2HG2  VAL  36          2HG2      VAL  36 -15.638   0.460   1.162
  278   3HG2  VAL  36          3HG2      VAL  36 -16.765  -0.544   0.252
  279    H    SER  37           H        SER  37 -16.228   4.300   1.366
  280    HA   SER  37           HA       SER  37 -13.781   3.356   2.649
  281   1HB   SER  37          1HB       SER  37 -13.768   4.735   0.564
  282   2HB   SER  37          2HB       SER  37 -14.406   6.087   1.488
  283    HG   SER  37           HG       SER  37 -12.402   6.468   1.964
  284    H    ASP  38           H        ASP  38 -13.708   3.419   4.839
  285    HA   ASP  38           HA       ASP  38 -13.896   5.956   6.225
  286   1HB   ASP  38          1HB       ASP  38 -16.087   3.896   6.553
  287   2HB   ASP  38          2HB       ASP  38 -15.676   4.996   7.869
  288    H    TYR  39           H        TYR  39 -14.812   3.135   8.010
  289    HA   TYR  39           HA       TYR  39 -12.465   3.187   9.633
  290   1HB   TYR  39          1HB       TYR  39 -14.470   2.118  10.471
  291   2HB   TYR  39          2HB       TYR  39 -14.498   0.992   9.112
  292    HD1  TYR  39           HD1      TYR  39 -12.902  -0.837   8.953
  293    HD2  TYR  39           HD2      TYR  39 -12.875   1.839  12.310
  294    HE1  TYR  39           HE1      TYR  39 -11.451  -2.409  10.188
  295    HE2  TYR  39           HE2      TYR  39 -11.419   0.261  13.554
  296    HH   TYR  39           HH       TYR  39 -10.433  -2.850  12.112
  297    H    TYR  40           H        TYR  40 -13.368   1.208   6.839
  298    HA   TYR  40           HA       TYR  40 -11.099  -0.490   6.773
  299   1HB   TYR  40          1HB       TYR  40 -12.583   0.584   4.359
  300   2HB   TYR  40          2HB       TYR  40 -11.721  -0.948   4.491
  301    HD1  TYR  40           HD1      TYR  40 -12.570  -2.696   6.146
  302    HD2  TYR  40           HD2      TYR  40 -14.844   0.778   5.035
  303    HE1  TYR  40           HE1      TYR  40 -14.637  -3.778   6.988
  304    HE2  TYR  40           HE2      TYR  40 -16.910  -0.307   5.879
  305    HH   TYR  40           HH       TYR  40 -16.828  -3.597   7.260
  306    H    LYS  41           H        LYS  41 -11.535   2.831   5.593
  307    HA   LYS  41           HA       LYS  41  -9.144   2.879   4.012
  308   1HB   LYS  41          1HB       LYS  41  -9.782   5.027   3.513
  309   2HB   LYS  41          2HB       LYS  41 -11.276   4.588   4.332
  310   1HG   LYS  41          1HG       LYS  41 -10.248   5.467   6.473
  311   2HG   LYS  41          2HG       LYS  41  -8.916   6.087   5.506
  312   1HD   LYS  41          1HD       LYS  41 -11.824   6.771   4.980
  313   2HD   LYS  41          2HD       LYS  41 -10.758   7.766   5.971
  314   1HE   LYS  41          1HE       LYS  41  -9.168   7.799   3.949
  315   2HE   LYS  41          2HE       LYS  41 -10.522   7.158   3.019
  316   1HZ   LYS  41          1HZ       LYS  41 -10.736   9.602   4.673
  317   2HZ   LYS  41          2HZ       LYS  41 -10.286   9.637   3.035
  318   3HZ   LYS  41          3HZ       LYS  41 -11.814   9.047   3.487
  319    H    ASN  42           H        ASN  42  -9.835   3.641   7.395
  320    HA   ASN  42           HA       ASN  42  -7.202   4.625   7.974
  321   1HB   ASN  42          1HB       ASN  42  -9.234   5.027   9.404
  322   2HB   ASN  42          2HB       ASN  42  -9.145   3.339   9.909
  323   2HD2  ASN  42          2HD2      ASN  42  -8.715   4.147  12.152
  324   1HD2  ASN  42          1HD2      ASN  42  -7.159   4.686  12.564
  325    H    LEU  43           H        LEU  43  -8.710   1.428   8.185
  326    HA   LEU  43           HA       LEU  43  -6.555   0.095   9.473
  327   1HB   LEU  43          1HB       LEU  43  -8.797  -0.898   9.199
  328   2HB   LEU  43          2HB       LEU  43  -8.554  -0.983   7.458
  329    HG   LEU  43           HG       LEU  43  -6.700  -2.557   7.761
  330   1HD1  LEU  43          1HD1      LEU  43  -7.193  -1.963  10.684
  331   2HD1  LEU  43          2HD1      LEU  43  -6.485  -3.504  10.195
  332   3HD1  LEU  43          3HD1      LEU  43  -5.662  -1.997   9.808
  333   1HD2  LEU  43          1HD2      LEU  43  -9.068  -3.378   7.664
  334   2HD2  LEU  43          2HD2      LEU  43  -8.014  -4.452   8.584
  335   3HD2  LEU  43          3HD2      LEU  43  -9.111  -3.359   9.427
  336    H    ILE  44           H        ILE  44  -7.180   0.749   6.029
  337    HA   ILE  44           HA       ILE  44  -4.965  -0.750   5.003
  338    HB   ILE  44           HB       ILE  44  -6.364   1.718   3.926
  339   1HG1  ILE  44          1HG1      ILE  44  -6.568  -1.185   3.078
  340   2HG1  ILE  44          2HG1      ILE  44  -7.659  -0.451   4.251
  341   1HG2  ILE  44          1HG2      ILE  44  -4.304  -0.136   2.695
  342   2HG2  ILE  44          2HG2      ILE  44  -5.350   0.904   1.730
  343   3HG2  ILE  44          3HG2      ILE  44  -4.203   1.616   2.866
  344   1HD1  ILE  44          1HD1      ILE  44  -7.225   0.803   1.541
  345   2HD1  ILE  44          2HD1      ILE  44  -8.400  -0.490   1.773
  346   3HD1  ILE  44          3HD1      ILE  44  -8.575   1.024   2.655
  347    H    ASN  45           H        ASN  45  -5.257   2.626   6.093
  348    HA   ASN  45           HA       ASN  45  -2.645   3.494   5.412
  349   1HB   ASN  45          1HB       ASN  45  -4.545   4.929   6.321
  350   2HB   ASN  45          2HB       ASN  45  -4.148   4.301   7.921
  351   2HD2  ASN  45          2HD2      ASN  45  -3.509   6.549   8.553
  352   1HD2  ASN  45          1HD2      ASN  45  -2.008   7.168   8.057
  353    H    ASN  46           H        ASN  46  -3.801   1.403   7.959
  354    HA   ASN  46           HA       ASN  46  -1.238   1.502   9.429
  355   1HB   ASN  46          1HB       ASN  46  -3.476   1.295  10.580
  356   2HB   ASN  46          2HB       ASN  46  -3.614  -0.320   9.885
  357   2HD2  ASN  46          2HD2      ASN  46  -3.213  -1.723  11.622
  358   1HD2  ASN  46          1HD2      ASN  46  -1.866  -1.617  12.649
  359    H    ALA  47           H        ALA  47  -2.277  -0.040   6.663
  360    HA   ALA  47           HA       ALA  47  -1.413  -2.731   7.049
  361   1HB   ALA  47          1HB       ALA  47  -1.454  -0.979   4.579
  362   2HB   ALA  47          2HB       ALA  47  -1.033  -2.689   4.538
  363   3HB   ALA  47          3HB       ALA  47  -2.643  -2.190   5.056
  364    H    LYS  48           H        LYS  48   0.623  -3.640   7.096
  365    HA   LYS  48           HA       LYS  48   2.935  -1.761   7.056
  366   1HB   LYS  48          1HB       LYS  48   2.685  -4.624   8.024
  367   2HB   LYS  48          2HB       LYS  48   4.153  -3.649   8.121
  368   1HG   LYS  48          1HG       LYS  48   2.965  -1.990   9.509
  369   2HG   LYS  48          2HG       LYS  48   1.497  -2.964   9.417
  370   1HD   LYS  48          1HD       LYS  48   2.667  -4.839  10.516
  371   2HD   LYS  48          2HD       LYS  48   4.135  -3.866  10.614
  372   1HE   LYS  48          1HE       LYS  48   2.973  -3.750  12.751
  373   2HE   LYS  48          2HE       LYS  48   2.870  -2.177  11.959
  374   1HZ   LYS  48          1HZ       LYS  48   0.676  -3.002  11.044
  375   2HZ   LYS  48          2HZ       LYS  48   0.776  -4.253  12.189
  376   3HZ   LYS  48          3HZ       LYS  48   0.718  -2.638  12.703
  377    H    THR  49           H        THR  49   1.402  -3.749   4.865
  378    HA   THR  49           HA       THR  49   3.851  -3.845   3.211
  379    HB   THR  49           HB       THR  49   2.276  -6.404   3.526
  380    HG1  THR  49           HG1      THR  49   3.715  -7.010   5.115
  381   1HG2  THR  49          1HG2      THR  49   3.861  -6.083   1.621
  382   2HG2  THR  49          2HG2      THR  49   5.158  -5.828   2.789
  383   3HG2  THR  49          3HG2      THR  49   4.346  -7.392   2.700
  384    H    VAL  50           H        VAL  50   3.392  -4.070   0.971
  385    HA   VAL  50           HA       VAL  50   0.916  -2.933   0.099
  386    HB   VAL  50           HB       VAL  50   2.982  -4.498  -1.457
  387   1HG1  VAL  50          1HG1      VAL  50   0.665  -2.752  -2.304
  388   2HG1  VAL  50          2HG1      VAL  50   2.010  -3.129  -3.380
  389   3HG1  VAL  50          3HG1      VAL  50   0.983  -4.425  -2.764
  390   1HG2  VAL  50          1HG2      VAL  50   2.637  -1.561  -0.817
  391   2HG2  VAL  50          2HG2      VAL  50   4.032  -2.584  -0.475
  392   3HG2  VAL  50          3HG2      VAL  50   3.659  -2.126  -2.137
  393    H    GLU  51           H        GLU  51   2.096  -6.299   0.186
  394    HA   GLU  51           HA       GLU  51  -0.078  -7.459  -1.235
  395   1HB   GLU  51          1HB       GLU  51   0.545  -9.568  -0.131
  396   2HB   GLU  51          2HB       GLU  51   1.989  -8.706  -0.655
  397   1HG   GLU  51          1HG       GLU  51   2.288  -7.820   1.637
  398   2HG   GLU  51          2HG       GLU  51   0.854  -8.700   2.161
  399    H    GLY  52           H        GLY  52   0.282  -6.491   2.130
  400   1HA   GLY  52          1HA       GLY  52  -1.300  -6.393   3.864
  401   2HA   GLY  52          2HA       GLY  52  -2.201  -7.661   3.029
  402    H    VAL  53           H        VAL  53  -1.289  -4.603   1.500
  403    HA   VAL  53           HA       VAL  53  -3.746  -3.212   2.056
  404    HB   VAL  53           HB       VAL  53  -1.717  -2.916  -0.176
  405   1HG1  VAL  53          1HG1      VAL  53  -4.158  -1.269   0.515
  406   2HG1  VAL  53          2HG1      VAL  53  -2.804  -0.614  -0.407
  407   3HG1  VAL  53          3HG1      VAL  53  -3.730  -1.972  -1.046
  408   1HG2  VAL  53          1HG2      VAL  53  -0.978  -2.444   2.169
  409   2HG2  VAL  53          2HG2      VAL  53  -0.944  -1.015   1.137
  410   3HG2  VAL  53          3HG2      VAL  53  -2.258  -1.238   2.292
  411    H    LYS  54           H        LYS  54  -2.698  -5.043  -0.843
  412    HA   LYS  54           HA       LYS  54  -5.243  -4.774  -2.177
  413   1HB   LYS  54          1HB       LYS  54  -3.034  -6.808  -2.593
  414   2HB   LYS  54          2HB       LYS  54  -4.374  -6.526  -3.699
  415   1HG   LYS  54          1HG       LYS  54  -2.409  -4.369  -2.871
  416   2HG   LYS  54          2HG       LYS  54  -2.217  -5.352  -4.321
  417   1HD   LYS  54          1HD       LYS  54  -4.638  -4.565  -4.903
  418   2HD   LYS  54          2HD       LYS  54  -4.352  -3.309  -3.700
  419   1HE   LYS  54          1HE       LYS  54  -2.556  -3.846  -6.080
  420   2HE   LYS  54          2HE       LYS  54  -3.764  -2.564  -6.000
  421   1HZ   LYS  54          1HZ       LYS  54  -2.476  -2.063  -3.770
  422   2HZ   LYS  54          2HZ       LYS  54  -1.203  -2.797  -4.616
  423   3HZ   LYS  54          3HZ       LYS  54  -1.970  -1.425  -5.261
  424    H    ALA  55           H        ALA  55  -3.831  -7.321  -0.150
  425    HA   ALA  55           HA       ALA  55  -5.835  -9.283  -0.559
  426   1HB   ALA  55          1HB       ALA  55  -4.155  -8.716   1.900
  427   2HB   ALA  55          2HB       ALA  55  -5.095 -10.187   1.647
  428   3HB   ALA  55          3HB       ALA  55  -3.745  -9.808   0.577
  429    H    LEU  56           H        LEU  56  -5.795  -6.496   1.621
  430    HA   LEU  56           HA       LEU  56  -8.056  -7.252   3.191
  431   1HB   LEU  56          1HB       LEU  56  -6.501  -5.395   3.799
  432   2HB   LEU  56          2HB       LEU  56  -7.129  -4.454   2.452
  433    HG   LEU  56           HG       LEU  56  -9.444  -4.708   3.518
  434   1HD1  LEU  56          1HD1      LEU  56  -7.700  -5.780   5.747
  435   2HD1  LEU  56          2HD1      LEU  56  -9.282  -5.066   6.053
  436   3HD1  LEU  56          3HD1      LEU  56  -9.149  -6.510   5.055
  437   1HD2  LEU  56          1HD2      LEU  56  -7.169  -3.155   4.755
  438   2HD2  LEU  56          2HD2      LEU  56  -8.460  -2.578   3.699
  439   3HD2  LEU  56          3HD2      LEU  56  -8.812  -2.998   5.374
  440    H    ILE  57           H        ILE  57  -7.755  -5.350   0.201
  441    HA   ILE  57           HA       ILE  57 -10.516  -4.714  -0.097
  442    HB   ILE  57           HB       ILE  57  -8.674  -5.336  -2.419
  443   1HG1  ILE  57          1HG1      ILE  57  -7.321  -3.985  -0.955
  444   2HG1  ILE  57          2HG1      ILE  57  -7.953  -2.910  -2.198
  445   1HG2  ILE  57          1HG2      ILE  57 -10.878  -3.304  -1.955
  446   2HG2  ILE  57          2HG2      ILE  57  -9.905  -3.419  -3.422
  447   3HG2  ILE  57          3HG2      ILE  57 -10.977  -4.740  -2.970
  448   1HD1  ILE  57          1HD1      ILE  57  -9.880  -2.442  -0.535
  449   2HD1  ILE  57          2HD1      ILE  57  -8.830  -3.170   0.678
  450   3HD1  ILE  57          3HD1      ILE  57  -8.310  -1.726  -0.187
  451    H    ASP  58           H        ASP  58  -8.596  -7.538  -1.058
  452    HA   ASP  58           HA       ASP  58 -10.625  -8.876  -2.556
  453   1HB   ASP  58          1HB       ASP  58  -8.266  -9.607  -2.539
  454   2HB   ASP  58          2HB       ASP  58  -8.431 -10.090  -0.850
  455    H    GLU  59           H        GLU  59  -9.922  -8.868   0.926
  456    HA   GLU  59           HA       GLU  59 -11.934 -10.831   1.589
  457   1HB   GLU  59          1HB       GLU  59 -10.529  -8.710   3.237
  458   2HB   GLU  59          2HB       GLU  59 -11.660  -9.876   3.921
  459   1HG   GLU  59          1HG       GLU  59 -10.255 -11.729   3.098
  460   2HG   GLU  59          2HG       GLU  59  -9.121 -10.566   2.411
  461    H    ILE  60           H        ILE  60 -11.842  -7.299   1.435
  462    HA   ILE  60           HA       ILE  60 -14.491  -6.921   2.472
  463    HB   ILE  60           HB       ILE  60 -12.759  -5.151   0.729
  464   1HG1  ILE  60          1HG1      ILE  60 -13.375  -4.986   3.692
  465   2HG1  ILE  60          2HG1      ILE  60 -11.940  -5.779   3.044
  466   1HG2  ILE  60          1HG2      ILE  60 -15.385  -4.643   2.145
  467   2HG2  ILE  60          2HG2      ILE  60 -14.303  -3.341   1.650
  468   3HG2  ILE  60          3HG2      ILE  60 -15.013  -4.405   0.438
  469   1HD1  ILE  60          1HD1      ILE  60 -12.651  -2.918   2.368
  470   2HD1  ILE  60          2HD1      ILE  60 -11.641  -3.342   3.750
  471   3HD1  ILE  60          3HD1      ILE  60 -11.111  -3.741   2.117
  472    H    LEU  61           H        LEU  61 -13.193  -7.241  -0.821
  473    HA   LEU  61           HA       LEU  61 -15.703  -6.711  -2.140
  474   1HB   LEU  61          1HB       LEU  61 -13.190  -8.145  -3.038
  475   2HB   LEU  61          2HB       LEU  61 -14.564  -7.855  -4.103
  476    HG   LEU  61           HG       LEU  61 -13.069  -5.682  -2.610
  477   1HD1  LEU  61          1HD1      LEU  61 -12.810  -6.723  -5.442
  478   2HD1  LEU  61          2HD1      LEU  61 -12.186  -5.153  -4.936
  479   3HD1  LEU  61          3HD1      LEU  61 -11.551  -6.632  -4.211
  480   1HD2  LEU  61          1HD2      LEU  61 -15.389  -5.720  -4.530
  481   2HD2  LEU  61          2HD2      LEU  61 -15.125  -4.706  -3.111
  482   3HD2  LEU  61          3HD2      LEU  61 -14.262  -4.367  -4.606
  483    H    ALA  62           H        ALA  62 -14.101  -9.688  -1.064
  484    HA   ALA  62           HA       ALA  62 -16.044 -11.469  -2.232
  485   1HB   ALA  62          1HB       ALA  62 -14.195 -11.923   0.129
  486   2HB   ALA  62          2HB       ALA  62 -15.026 -13.179  -0.789
  487   3HB   ALA  62          3HB       ALA  62 -13.776 -12.204  -1.562
  488    H    ALA  63           H        ALA  63 -15.920  -9.672   0.775
  489    HA   ALA  63           HA       ALA  63 -18.596 -10.816   1.513
  490   1HB   ALA  63          1HB       ALA  63 -17.894 -10.561   3.905
  491   2HB   ALA  63          2HB       ALA  63 -16.265 -10.181   3.347
  492   3HB   ALA  63          3HB       ALA  63 -16.955 -11.774   3.033
  493    H    LEU  64           H        LEU  64 -18.914  -8.686   0.111
  494    HA   LEU  64           HA       LEU  64 -18.438  -6.177   1.426
  495   1HB   LEU  64          1HB       LEU  64 -20.378  -7.000  -0.743
  496   2HB   LEU  64          2HB       LEU  64 -20.196  -5.332  -0.208
  497    HG   LEU  64           HG       LEU  64 -17.793  -6.936  -1.093
  498   1HD1  LEU  64          1HD1      LEU  64 -19.643  -5.318  -2.870
  499   2HD1  LEU  64          2HD1      LEU  64 -18.098  -6.012  -3.363
  500   3HD1  LEU  64          3HD1      LEU  64 -19.440  -7.069  -2.920
  501   1HD2  LEU  64          1HD2      LEU  64 -18.485  -3.981  -0.963
  502   2HD2  LEU  64          2HD2      LEU  64 -17.264  -4.834  -0.021
  503   3HD2  LEU  64          3HD2      LEU  64 -17.038  -4.603  -1.752
  504    HA   PRO  65           HA       PRO  65 -21.600  -6.472   4.621
  505   1HB   PRO  65          1HB       PRO  65 -22.324  -3.655   4.080
  506   2HB   PRO  65          2HB       PRO  65 -21.677  -4.380   5.556
  507   1HG   PRO  65          1HG       PRO  65 -20.248  -2.762   3.747
  508   2HG   PRO  65          2HG       PRO  65 -19.546  -3.754   5.031
  509   1HD   PRO  65          1HD       PRO  65 -19.369  -4.163   2.152
  510   2HD   PRO  65          2HD       PRO  65 -18.593  -5.105   3.450

  No H/Q in entry =         510
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1  12.382  23.738 -15.408
    2    H2   MET   1           H2       MET   1  12.079  24.481 -13.911
    3    H3   MET   1           H3       MET   1  11.400  25.122 -15.325
    4    HA   MET   1           HA       MET   1  13.144  26.431 -15.595
    5   1HB   MET   1          1HB       MET   1  13.284  26.176 -13.074
    6   2HB   MET   1          2HB       MET   1  14.501  24.928 -13.339
    7   1HG   MET   1          1HG       MET   1  15.913  26.540 -14.548
    8   2HG   MET   1          2HG       MET   1  14.690  27.791 -14.328
    9   1HE   MET   1          1HE       MET   1  17.684  27.940 -13.658
   10   2HE   MET   1          2HE       MET   1  16.682  29.326 -13.232
   11   3HE   MET   1          3HE       MET   1  17.802  28.641 -12.046
   12    H    LYS   2           H        LYS   2  15.326  26.476 -16.520
   13    HA   LYS   2           HA       LYS   2  15.866  24.296 -18.264
   14   1HB   LYS   2          1HB       LYS   2  17.609  26.589 -17.335
   15   2HB   LYS   2          2HB       LYS   2  18.099  25.451 -18.591
   16   1HG   LYS   2          1HG       LYS   2  16.008  26.026 -19.853
   17   2HG   LYS   2          2HG       LYS   2  15.666  27.265 -18.647
   18   1HD   LYS   2          1HD       LYS   2  18.310  27.222 -20.106
   19   2HD   LYS   2          2HD       LYS   2  16.893  27.977 -20.829
   20   1HE   LYS   2          1HE       LYS   2  18.111  28.693 -18.142
   21   2HE   LYS   2          2HE       LYS   2  18.207  29.651 -19.618
   22   1HZ   LYS   2          1HZ       LYS   2  15.528  29.086 -19.222
   23   2HZ   LYS   2          2HZ       LYS   2  16.130  29.550 -17.706
   24   3HZ   LYS   2          3HZ       LYS   2  16.306  30.587 -19.040
   25    H    ALA   3           H        ALA   3  17.167  25.122 -15.077
   26    HA   ALA   3           HA       ALA   3  19.370  23.521 -14.775
   27   1HB   ALA   3          1HB       ALA   3  18.344  24.839 -12.942
   28   2HB   ALA   3          2HB       ALA   3  18.737  23.198 -12.427
   29   3HB   ALA   3          3HB       ALA   3  17.069  23.628 -12.803
   30    H    ILE   4           H        ILE   4  19.674  21.314 -13.944
   31    HA   ILE   4           HA       ILE   4  18.009  19.396 -15.407
   32    HB   ILE   4           HB       ILE   4  20.397  18.992 -13.581
   33   1HG1  ILE   4          1HG1      ILE   4  20.278  18.848 -16.601
   34   2HG1  ILE   4          2HG1      ILE   4  20.690  20.335 -15.745
   35   1HG2  ILE   4          1HG2      ILE   4  18.858  17.127 -15.403
   36   2HG2  ILE   4          2HG2      ILE   4  20.495  16.779 -14.845
   37   3HG2  ILE   4          3HG2      ILE   4  19.181  16.932 -13.680
   38   1HD1  ILE   4          1HD1      ILE   4  22.127  17.714 -15.266
   39   2HD1  ILE   4          2HD1      ILE   4  22.674  18.903 -16.447
   40   3HD1  ILE   4          3HD1      ILE   4  22.616  19.324 -14.736
   41    H    PHE   5           H        PHE   5  16.635  17.866 -14.486
   42    HA   PHE   5           HA       PHE   5  15.368  18.478 -12.010
   43   1HB   PHE   5          1HB       PHE   5  15.442  15.873 -13.566
   44   2HB   PHE   5          2HB       PHE   5  14.342  16.210 -12.229
   45    HD1  PHE   5           HD1      PHE   5  12.558  17.886 -12.446
   46    HD2  PHE   5           HD2      PHE   5  15.174  16.963 -15.726
   47    HE1  PHE   5           HE1      PHE   5  11.010  19.038 -14.005
   48    HE2  PHE   5           HE2      PHE   5  13.626  18.116 -17.285
   49    HZ   PHE   5           HZ       PHE   5  11.545  19.153 -16.424
   50    H    VAL   6           H        VAL   6  15.670  17.649  -9.932
   51    HA   VAL   6           HA       VAL   6  18.323  16.794  -9.250
   52    HB   VAL   6           HB       VAL   6  16.534  18.075  -7.855
   53   1HG1  VAL   6          1HG1      VAL   6  15.014  15.862  -8.085
   54   2HG1  VAL   6          2HG1      VAL   6  15.860  15.443  -6.596
   55   3HG1  VAL   6          3HG1      VAL   6  14.915  16.927  -6.686
   56   1HG2  VAL   6          1HG2      VAL   6  18.476  16.009  -6.830
   57   2HG2  VAL   6          2HG2      VAL   6  18.622  17.765  -6.838
   58   3HG2  VAL   6          3HG2      VAL   6  17.527  16.978  -5.702
   59    H    LEU   7           H        LEU   7  17.375  14.729  -7.232
   60    HA   LEU   7           HA       LEU   7  17.991  12.399  -8.726
   61   1HB   LEU   7          1HB       LEU   7  17.942  12.902  -6.122
   62   2HB   LEU   7          2HB       LEU   7  16.308  12.273  -6.223
   63    HG   LEU   7           HG       LEU   7  17.604  10.400  -5.636
   64   1HD1  LEU   7          1HD1      LEU   7  16.150  10.050  -7.693
   65   2HD1  LEU   7          2HD1      LEU   7  17.635  10.139  -8.642
   66   3HD1  LEU   7          3HD1      LEU   7  17.434   8.874  -7.438
   67   1HD2  LEU   7          1HD2      LEU   7  19.806  11.498  -6.057
   68   2HD2  LEU   7          2HD2      LEU   7  19.752   9.821  -6.595
   69   3HD2  LEU   7          3HD2      LEU   7  19.632  11.125  -7.770
   70    H    ASN   8           H        ASN   8  16.695  10.980  -9.882
   71    HA   ASN   8           HA       ASN   8  13.725  11.425  -9.839
   72   1HB   ASN   8          1HB       ASN   8  15.496  10.876 -12.241
   73   2HB   ASN   8          2HB       ASN   8  13.733  10.944 -12.274
   74   2HD2  ASN   8          2HD2      ASN   8  13.842  13.198 -10.178
   75   1HD2  ASN   8          1HD2      ASN   8  14.254  14.576 -11.078
   76    H    ALA   9           H        ALA   9  12.473   9.522 -10.347
   77    HA   ALA   9           HA       ALA   9  13.783   7.029  -9.457
   78   1HB   ALA   9          1HB       ALA   9  11.473   7.831  -8.680
   79   2HB   ALA   9          2HB       ALA   9  11.578   6.154  -9.212
   80   3HB   ALA   9          3HB       ALA   9  10.893   7.377 -10.282
   81    H    GLN  10           H        GLN  10  13.942   8.456 -12.267
   82    HA   GLN  10           HA       GLN  10  12.790   6.719 -14.199
   83   1HB   GLN  10          1HB       GLN  10  15.293   8.425 -14.288
   84   2HB   GLN  10          2HB       GLN  10  14.651   7.579 -15.694
   85   1HG   GLN  10          1HG       GLN  10  13.045   9.540 -14.033
   86   2HG   GLN  10          2HG       GLN  10  13.901   9.979 -15.510
   87   2HE2  GLN  10          2HE2      GLN  10  13.290   7.332 -16.814
   88   1HE2  GLN  10          1HE2      GLN  10  11.647   7.404 -17.229
   89    H    HIS  11           H        HIS  11  15.909   6.570 -12.501
   90    HA   HIS  11           HA       HIS  11  17.167   4.512 -13.902
   91   1HB   HIS  11          1HB       HIS  11  18.209   5.661 -11.996
   92   2HB   HIS  11          2HB       HIS  11  17.066   4.893 -10.894
   93    HD1  HIS  11           HD1      HIS  11  19.616   3.785 -13.519
   94    HD2  HIS  11           HD2      HIS  11  18.038   2.527  -9.871
   95    HE1  HIS  11           HE1      HIS  11  20.863   1.672 -12.889
   96    H    ASP  12           H        ASP  12  15.288   3.873 -10.912
   97    HA   ASP  12           HA       ASP  12  13.858   1.668 -12.202
   98   1HB   ASP  12          1HB       ASP  12  16.018   1.143 -10.146
   99   2HB   ASP  12          2HB       ASP  12  14.758  -0.025 -10.540
  100    H    GLU  13           H        GLU  13  12.583   0.433 -10.383
  101    HA   GLU  13           HA       GLU  13  11.260   2.491  -8.751
  102   1HB   GLU  13          1HB       GLU  13  10.740  -0.470  -9.155
  103   2HB   GLU  13          2HB       GLU  13   9.757   0.563  -8.117
  104   1HG   GLU  13          1HG       GLU  13   9.254   2.024 -10.040
  105   2HG   GLU  13          2HG       GLU  13  10.234   0.991 -11.081
  106    H    ALA  14           H        ALA  14  14.054   1.612  -8.155
  107    HA   ALA  14           HA       ALA  14  14.297  -0.114  -5.978
  108   1HB   ALA  14          1HB       ALA  14  15.734   2.524  -6.382
  109   2HB   ALA  14          2HB       ALA  14  16.264   1.227  -5.311
  110   3HB   ALA  14          3HB       ALA  14  16.227   0.969  -7.055
  111    H    VAL  15           H        VAL  15  12.593   2.853  -6.097
  112    HA   VAL  15           HA       VAL  15  12.685   3.258  -3.163
  113    HB   VAL  15           HB       VAL  15  11.051   4.720  -5.261
  114   1HG1  VAL  15          1HG1      VAL  15  11.819   5.355  -2.397
  115   2HG1  VAL  15          2HG1      VAL  15  11.056   6.505  -3.495
  116   3HG1  VAL  15          3HG1      VAL  15  10.197   5.043  -3.012
  117   1HG2  VAL  15          1HG2      VAL  15  13.790   5.321  -4.097
  118   2HG2  VAL  15          2HG2      VAL  15  13.427   4.935  -5.779
  119   3HG2  VAL  15          3HG2      VAL  15  12.854   6.449  -5.078
  120    H    ASP  16           H        ASP  16  11.471   1.748  -2.081
  121    HA   ASP  16           HA       ASP  16   8.974   0.706  -3.228
  122   1HB   ASP  16          1HB       ASP  16  10.613  -0.663  -1.847
  123   2HB   ASP  16          2HB       ASP  16  10.058   0.245  -0.440
  124    H    ALA  17           H        ALA  17   9.937   3.178  -0.962
  125    HA   ALA  17           HA       ALA  17   7.542   3.419   0.553
  126   1HB   ALA  17          1HB       ALA  17   9.754   4.629   0.939
  127   2HB   ALA  17          2HB       ALA  17   8.306   5.616   1.132
  128   3HB   ALA  17          3HB       ALA  17   9.266   5.741  -0.341
  129    H    ASN  18           H        ASN  18   8.464   4.947  -2.540
  130    HA   ASN  18           HA       ASN  18   6.110   6.512  -2.850
  131   1HB   ASN  18          1HB       ASN  18   8.105   6.791  -4.275
  132   2HB   ASN  18          2HB       ASN  18   7.809   5.210  -5.000
  133   2HD2  ASN  18          2HD2      ASN  18   6.272   8.430  -4.562
  134   1HD2  ASN  18          1HD2      ASN  18   5.342   8.347  -5.980
  135    H    SER  19           H        SER  19   6.814   3.156  -3.819
  136    HA   SER  19           HA       SER  19   4.307   2.726  -5.156
  137   1HB   SER  19          1HB       SER  19   4.885   0.374  -5.073
  138   2HB   SER  19          2HB       SER  19   6.348   1.292  -5.411
  139    HG   SER  19           HG       SER  19   6.001   1.119  -2.770
  140    H    LEU  20           H        LEU  20   5.373   2.149  -1.801
  141    HA   LEU  20           HA       LEU  20   3.000   0.834  -0.930
  142   1HB   LEU  20          1HB       LEU  20   5.053   2.523   0.510
  143   2HB   LEU  20          2HB       LEU  20   3.686   1.813   1.363
  144    HG   LEU  20           HG       LEU  20   5.370   0.035  -0.397
  145   1HD1  LEU  20          1HD1      LEU  20   6.119   1.058   2.351
  146   2HD1  LEU  20          2HD1      LEU  20   6.751  -0.453   1.696
  147   3HD1  LEU  20          3HD1      LEU  20   7.099   1.074   0.885
  148   1HD2  LEU  20          1HD2      LEU  20   3.224  -0.700   0.779
  149   2HD2  LEU  20          2HD2      LEU  20   4.648  -1.675   1.137
  150   3HD2  LEU  20          3HD2      LEU  20   4.083  -0.478   2.301
  151    H    ALA  21           H        ALA  21   3.873   4.296  -0.868
  152    HA   ALA  21           HA       ALA  21   1.447   5.198   0.283
  153   1HB   ALA  21          1HB       ALA  21   3.629   6.509  -0.139
  154   2HB   ALA  21          2HB       ALA  21   3.003   6.778  -1.766
  155   3HB   ALA  21          3HB       ALA  21   2.113   7.378  -0.366
  156    H    GLU  22           H        GLU  22   2.360   4.948  -3.173
  157    HA   GLU  22           HA       GLU  22  -0.146   5.874  -4.173
  158   1HB   GLU  22          1HB       GLU  22   1.991   5.612  -5.494
  159   2HB   GLU  22          2HB       GLU  22   1.684   3.874  -5.518
  160   1HG   GLU  22          1HG       GLU  22  -0.469   4.250  -6.632
  161   2HG   GLU  22          2HG       GLU  22  -0.203   5.994  -6.585
  162    H    ALA  23           H        ALA  23   0.984   2.587  -3.390
  163    HA   ALA  23           HA       ALA  23  -1.295   1.197  -4.380
  164   1HB   ALA  23          1HB       ALA  23  -0.651  -0.584  -2.759
  165   2HB   ALA  23          2HB       ALA  23   0.729   0.006  -3.686
  166   3HB   ALA  23          3HB       ALA  23   0.495   0.536  -2.019
  167    H    LYS  24           H        LYS  24  -0.647   2.666  -1.198
  168    HA   LYS  24           HA       LYS  24  -3.173   1.850  -0.053
  169   1HB   LYS  24          1HB       LYS  24  -1.251   4.082   0.673
  170   2HB   LYS  24          2HB       LYS  24  -2.637   3.608   1.655
  171   1HG   LYS  24          1HG       LYS  24  -1.720   1.323   1.860
  172   2HG   LYS  24          2HG       LYS  24  -0.329   1.794   0.882
  173   1HD   LYS  24          1HD       LYS  24   0.171   3.587   2.576
  174   2HD   LYS  24          2HD       LYS  24  -1.110   2.917   3.586
  175   1HE   LYS  24          1HE       LYS  24   0.086   0.712   3.536
  176   2HE   LYS  24          2HE       LYS  24   1.407   1.495   2.672
  177   1HZ   LYS  24          1HZ       LYS  24   0.420   2.588   5.227
  178   2HZ   LYS  24          2HZ       LYS  24   1.546   1.320   5.209
  179   3HZ   LYS  24          3HZ       LYS  24   1.932   2.807   4.485
  180    H    VAL  25           H        VAL  25  -2.035   4.779  -1.721
  181    HA   VAL  25           HA       VAL  25  -4.432   6.299  -1.338
  182    HB   VAL  25           HB       VAL  25  -2.266   6.439  -3.442
  183   1HG1  VAL  25          1HG1      VAL  25  -4.688   8.189  -2.995
  184   2HG1  VAL  25          2HG1      VAL  25  -3.244   8.779  -3.817
  185   3HG1  VAL  25          3HG1      VAL  25  -4.157   7.431  -4.496
  186   1HG2  VAL  25          1HG2      VAL  25  -1.772   6.973  -0.999
  187   2HG2  VAL  25          2HG2      VAL  25  -1.436   8.276  -2.140
  188   3HG2  VAL  25          3HG2      VAL  25  -2.900   8.319  -1.156
  189    H    LEU  26           H        LEU  26  -3.351   4.198  -4.016
  190    HA   LEU  26           HA       LEU  26  -5.683   4.593  -5.634
  191   1HB   LEU  26          1HB       LEU  26  -3.701   2.307  -5.475
  192   2HB   LEU  26          2HB       LEU  26  -4.977   2.394  -6.688
  193    HG   LEU  26           HG       LEU  26  -2.844   4.508  -6.259
  194   1HD1  LEU  26          1HD1      LEU  26  -3.116   2.373  -8.398
  195   2HD1  LEU  26          2HD1      LEU  26  -1.900   3.649  -8.383
  196   3HD1  LEU  26          3HD1      LEU  26  -1.895   2.412  -7.126
  197   1HD2  LEU  26          1HD2      LEU  26  -5.252   4.288  -8.040
  198   2HD2  LEU  26          2HD2      LEU  26  -4.520   5.715  -7.307
  199   3HD2  LEU  26          3HD2      LEU  26  -3.795   4.991  -8.740
  200    H    ALA  27           H        ALA  27  -4.924   2.203  -3.112
  201    HA   ALA  27           HA       ALA  27  -7.328   0.664  -3.487
  202   1HB   ALA  27          1HB       ALA  27  -5.370  -0.212  -2.258
  203   2HB   ALA  27          2HB       ALA  27  -5.626   0.993  -0.997
  204   3HB   ALA  27          3HB       ALA  27  -6.824  -0.273  -1.263
  205    H    ASN  28           H        ASN  28  -6.503   3.425  -1.423
  206    HA   ASN  28           HA       ASN  28  -8.900   3.500   0.106
  207   1HB   ASN  28          1HB       ASN  28  -6.838   4.872   0.545
  208   2HB   ASN  28          2HB       ASN  28  -7.280   5.884  -0.831
  209   2HD2  ASN  28          2HD2      ASN  28  -7.245   6.387   2.236
  210   1HD2  ASN  28          1HD2      ASN  28  -8.779   7.046   2.546
  211    H    ARG  29           H        ARG  29  -8.117   4.838  -3.080
  212    HA   ARG  29           HA       ARG  29 -10.478   6.371  -3.460
  213   1HB   ARG  29          1HB       ARG  29  -8.705   4.910  -5.433
  214   2HB   ARG  29          2HB       ARG  29 -10.011   5.976  -5.928
  215   1HG   ARG  29          1HG       ARG  29  -7.863   6.909  -4.019
  216   2HG   ARG  29          2HG       ARG  29  -7.616   6.975  -5.755
  217   1HD   ARG  29          1HD       ARG  29  -9.721   8.417  -4.131
  218   2HD   ARG  29          2HD       ARG  29  -8.441   9.134  -5.092
  219    HE   ARG  29           HE       ARG  29 -11.062   8.413  -6.008
  220   1HH1  ARG  29          1HH1      ARG  29 -11.556   8.037  -8.159
  221   2HH1  ARG  29          2HH1      ARG  29 -10.277   7.815  -9.306
  222   1HH2  ARG  29          1HH2      ARG  29  -7.751   8.212  -6.975
  223   2HH2  ARG  29          2HH2      ARG  29  -8.130   7.905  -8.634
  224    H    GLU  30           H        GLU  30  -9.847   2.921  -4.073
  225    HA   GLU  30           HA       GLU  30 -12.298   2.342  -5.400
  226   1HB   GLU  30          1HB       GLU  30 -10.459   0.678  -3.676
  227   2HB   GLU  30          2HB       GLU  30 -11.920  -0.003  -4.392
  228   1HG   GLU  30          1HG       GLU  30 -11.150   0.639  -6.626
  229   2HG   GLU  30          2HG       GLU  30  -9.693   1.357  -5.932
  230    H    LEU  31           H        LEU  31 -11.495   2.458  -1.953
  231    HA   LEU  31           HA       LEU  31 -14.054   1.515  -1.017
  232   1HB   LEU  31          1HB       LEU  31 -12.199   3.441   0.413
  233   2HB   LEU  31          2HB       LEU  31 -13.329   2.294   1.140
  234    HG   LEU  31           HG       LEU  31 -10.874   1.609  -0.487
  235   1HD1  LEU  31          1HD1      LEU  31 -11.535   1.496   2.456
  236   2HD1  LEU  31          2HD1      LEU  31 -10.275   0.479   1.759
  237   3HD1  LEU  31          3HD1      LEU  31 -10.140   2.235   1.671
  238   1HD2  LEU  31          1HD2      LEU  31 -13.157  -0.046   0.596
  239   2HD2  LEU  31          2HD2      LEU  31 -12.380  -0.127  -0.984
  240   3HD2  LEU  31          3HD2      LEU  31 -11.553  -0.761   0.435
  241    H    ASP  32           H        ASP  32 -12.674   4.702  -1.627
  242    HA   ASP  32           HA       ASP  32 -14.833   6.289  -0.708
  243   1HB   ASP  32          1HB       ASP  32 -12.597   7.160  -1.243
  244   2HB   ASP  32          2HB       ASP  32 -12.865   6.810  -2.949
  245    H    LYS  33           H        LYS  33 -14.217   4.894  -3.954
  246    HA   LYS  33           HA       LYS  33 -16.515   6.115  -5.178
  247   1HB   LYS  33          1HB       LYS  33 -14.945   3.619  -5.883
  248   2HB   LYS  33          2HB       LYS  33 -16.242   4.267  -6.889
  249   1HG   LYS  33          1HG       LYS  33 -15.010   6.459  -6.947
  250   2HG   LYS  33          2HG       LYS  33 -13.669   5.670  -6.119
  251   1HD   LYS  33          1HD       LYS  33 -14.826   4.690  -8.746
  252   2HD   LYS  33          2HD       LYS  33 -13.431   5.762  -8.636
  253   1HE   LYS  33          1HE       LYS  33 -12.423   3.963  -7.066
  254   2HE   LYS  33          2HE       LYS  33 -13.672   2.900  -7.713
  255   1HZ   LYS  33          1HZ       LYS  33 -12.468   4.267  -9.840
  256   2HZ   LYS  33          2HZ       LYS  33 -11.235   3.612  -8.876
  257   3HZ   LYS  33          3HZ       LYS  33 -12.444   2.601  -9.509
  258    H    TYR  34           H        TYR  34 -16.029   3.001  -3.535
  259    HA   TYR  34           HA       TYR  34 -18.713   2.040  -4.049
  260   1HB   TYR  34          1HB       TYR  34 -16.982   1.233  -1.708
  261   2HB   TYR  34          2HB       TYR  34 -18.202   0.274  -2.534
  262    HD1  TYR  34           HD1      TYR  34 -15.299  -0.504  -1.962
  263    HD2  TYR  34           HD2      TYR  34 -17.142   1.246  -5.434
  264    HE1  TYR  34           HE1      TYR  34 -13.542  -1.482  -3.400
  265    HE2  TYR  34           HE2      TYR  34 -15.385   0.268  -6.856
  266    HH   TYR  34           HH       TYR  34 -13.253  -2.135  -5.757
  267    H    GLY  35           H        GLY  35 -17.194   3.858  -1.415
  268   1HA   GLY  35          1HA       GLY  35 -19.903   4.695  -0.526
  269   2HA   GLY  35          2HA       GLY  35 -18.382   5.460  -0.069
  270    H    VAL  36           H        VAL  36 -17.063   2.946   0.642
  271    HA   VAL  36           HA       VAL  36 -18.668   1.647   2.692
  272    HB   VAL  36           HB       VAL  36 -15.658   1.524   2.740
  273   1HG1  VAL  36          1HG1      VAL  36 -17.888  -0.527   2.957
  274   2HG1  VAL  36          2HG1      VAL  36 -16.169  -0.912   3.029
  275   3HG1  VAL  36          3HG1      VAL  36 -16.898   0.097   4.276
  276   1HG2  VAL  36          1HG2      VAL  36 -17.425   0.511   0.505
  277   2HG2  VAL  36          2HG2      VAL  36 -15.969   1.497   0.380
  278   3HG2  VAL  36          3HG2      VAL  36 -15.847  -0.198   0.851
  279    H    SER  37           H        SER  37 -17.466   1.592   5.026
  280    HA   SER  37           HA       SER  37 -17.772   4.255   6.090
  281   1HB   SER  37          1HB       SER  37 -18.291   2.249   7.423
  282   2HB   SER  37          2HB       SER  37 -16.597   1.770   7.372
  283    HG   SER  37           HG       SER  37 -17.763   4.047   8.595
  284    H    ASP  38           H        ASP  38 -16.155   5.602   7.018
  285    HA   ASP  38           HA       ASP  38 -13.692   5.761   5.568
  286   1HB   ASP  38          1HB       ASP  38 -14.904   7.664   6.753
  287   2HB   ASP  38          2HB       ASP  38 -14.242   7.028   8.260
  288    H    TYR  39           H        TYR  39 -14.612   3.914   8.324
  289    HA   TYR  39           HA       TYR  39 -12.132   3.709   9.696
  290   1HB   TYR  39          1HB       TYR  39 -14.162   2.804  10.679
  291   2HB   TYR  39          2HB       TYR  39 -14.347   1.667   9.343
  292    HD1  TYR  39           HD1      TYR  39 -12.905  -0.273   9.119
  293    HD2  TYR  39           HD2      TYR  39 -12.417   2.475  12.382
  294    HE1  TYR  39           HE1      TYR  39 -11.445  -1.904  10.268
  295    HE2  TYR  39           HE2      TYR  39 -10.954   0.838  13.540
  296    HH   TYR  39           HH       TYR  39 -10.192  -2.317  12.051
  297    H    TYR  40           H        TYR  40 -13.426   1.718   7.010
  298    HA   TYR  40           HA       TYR  40 -11.218  -0.062   6.858
  299   1HB   TYR  40          1HB       TYR  40 -13.076   0.940   4.683
  300   2HB   TYR  40          2HB       TYR  40 -11.921  -0.374   4.461
  301    HD1  TYR  40           HD1      TYR  40 -15.092   0.637   5.969
  302    HD2  TYR  40           HD2      TYR  40 -12.159  -2.490   5.737
  303    HE1  TYR  40           HE1      TYR  40 -16.711  -0.955   6.965
  304    HE2  TYR  40           HE2      TYR  40 -13.778  -4.084   6.730
  305    HH   TYR  40           HH       TYR  40 -16.665  -3.079   8.216
  306    H    LYS  41           H        LYS  41 -11.718   3.129   5.334
  307    HA   LYS  41           HA       LYS  41  -9.354   3.101   3.717
  308   1HB   LYS  41          1HB       LYS  41 -10.720   5.448   5.079
  309   2HB   LYS  41          2HB       LYS  41  -9.584   5.557   3.732
  310   1HG   LYS  41          1HG       LYS  41 -11.094   4.300   2.297
  311   2HG   LYS  41          2HG       LYS  41 -12.205   4.049   3.644
  312   1HD   LYS  41          1HD       LYS  41 -12.161   6.712   3.758
  313   2HD   LYS  41          2HD       LYS  41 -11.655   6.557   2.073
  314   1HE   LYS  41          1HE       LYS  41 -13.638   5.147   1.625
  315   2HE   LYS  41          2HE       LYS  41 -14.139   5.344   3.305
  316   1HZ   LYS  41          1HZ       LYS  41 -13.971   7.837   2.784
  317   2HZ   LYS  41          2HZ       LYS  41 -14.036   7.361   1.155
  318   3HZ   LYS  41          3HZ       LYS  41 -15.317   6.984   2.204
  319    H    ASN  42           H        ASN  42 -10.055   4.192   6.993
  320    HA   ASN  42           HA       ASN  42  -7.450   5.148   7.619
  321   1HB   ASN  42          1HB       ASN  42  -9.617   3.970   9.379
  322   2HB   ASN  42          2HB       ASN  42  -8.137   4.685  10.018
  323   2HD2  ASN  42          2HD2      ASN  42  -8.661   6.438   7.284
  324   1HD2  ASN  42          1HD2      ASN  42  -9.614   7.694   7.911
  325    H    LEU  43           H        LEU  43  -8.909   1.932   7.836
  326    HA   LEU  43           HA       LEU  43  -6.747   0.632   9.141
  327   1HB   LEU  43          1HB       LEU  43  -8.954  -0.434   8.835
  328   2HB   LEU  43          2HB       LEU  43  -8.682  -0.503   7.095
  329    HG   LEU  43           HG       LEU  43  -6.730  -1.970   7.445
  330   1HD1  LEU  43          1HD1      LEU  43  -7.362  -1.417  10.339
  331   2HD1  LEU  43          2HD1      LEU  43  -6.616  -2.952   9.893
  332   3HD1  LEU  43          3HD1      LEU  43  -5.797  -1.437   9.526
  333   1HD2  LEU  43          1HD2      LEU  43  -9.154  -2.830   7.310
  334   2HD2  LEU  43          2HD2      LEU  43  -7.957  -3.943   7.972
  335   3HD2  LEU  43          3HD2      LEU  43  -9.042  -3.070   9.053
  336    H    ILE  44           H        ILE  44  -7.335   1.326   5.695
  337    HA   ILE  44           HA       ILE  44  -5.121  -0.148   4.652
  338    HB   ILE  44           HB       ILE  44  -6.229   2.502   3.648
  339   1HG1  ILE  44          1HG1      ILE  44  -8.040   0.908   3.684
  340   2HG1  ILE  44          2HG1      ILE  44  -7.487   1.038   2.023
  341   1HG2  ILE  44          1HG2      ILE  44  -4.499   0.373   2.379
  342   2HG2  ILE  44          2HG2      ILE  44  -5.330   1.620   1.449
  343   3HG2  ILE  44          3HG2      ILE  44  -4.106   2.072   2.634
  344   1HD1  ILE  44          1HD1      ILE  44  -5.958  -0.995   2.638
  345   2HD1  ILE  44          2HD1      ILE  44  -7.091  -1.211   3.972
  346   3HD1  ILE  44          3HD1      ILE  44  -7.667  -1.275   2.309
  347    H    ASN  45           H        ASN  45  -5.374   3.131   5.979
  348    HA   ASN  45           HA       ASN  45  -2.781   4.065   5.389
  349   1HB   ASN  45          1HB       ASN  45  -4.669   5.365   6.485
  350   2HB   ASN  45          2HB       ASN  45  -4.242   4.562   7.996
  351   2HD2  ASN  45          2HD2      ASN  45  -3.722   6.885   8.708
  352   1HD2  ASN  45          1HD2      ASN  45  -2.186   7.502   8.334
  353    H    ASN  46           H        ASN  46  -3.855   1.775   7.848
  354    HA   ASN  46           HA       ASN  46  -1.163   1.726   9.089
  355   1HB   ASN  46          1HB       ASN  46  -3.265   1.607  10.471
  356   2HB   ASN  46          2HB       ASN  46  -3.571   0.019   9.763
  357   2HD2  ASN  46          2HD2      ASN  46  -3.064  -1.427  11.450
  358   1HD2  ASN  46          1HD2      ASN  46  -1.591  -1.429  12.294
  359    H    ALA  47           H        ALA  47  -2.424   0.359   6.359
  360    HA   ALA  47           HA       ALA  47  -1.807  -2.402   6.585
  361   1HB   ALA  47          1HB       ALA  47  -2.909  -1.782   4.595
  362   2HB   ALA  47          2HB       ALA  47  -1.773  -0.477   4.265
  363   3HB   ALA  47          3HB       ALA  47  -1.274  -2.154   4.047
  364    H    LYS  48           H        LYS  48   0.095  -3.299   7.146
  365    HA   LYS  48           HA       LYS  48   2.548  -1.803   7.255
  366   1HB   LYS  48          1HB       LYS  48   1.945  -3.749   8.734
  367   2HB   LYS  48          2HB       LYS  48   2.256  -4.813   7.363
  368   1HG   LYS  48          1HG       LYS  48   4.558  -3.954   7.201
  369   2HG   LYS  48          2HG       LYS  48   4.260  -2.872   8.558
  370   1HD   LYS  48          1HD       LYS  48   3.935  -5.878   8.761
  371   2HD   LYS  48          2HD       LYS  48   5.455  -5.064   9.118
  372   1HE   LYS  48          1HE       LYS  48   4.052  -3.590  10.734
  373   2HE   LYS  48          2HE       LYS  48   2.820  -4.840  10.575
  374   1HZ   LYS  48          1HZ       LYS  48   4.544  -6.474  11.216
  375   2HZ   LYS  48          2HZ       LYS  48   5.604  -5.185  11.534
  376   3HZ   LYS  48          3HZ       LYS  48   4.177  -5.357  12.438
  377    H    THR  49           H        THR  49   1.330  -4.240   4.938
  378    HA   THR  49           HA       THR  49   3.504  -3.379   3.067
  379    HB   THR  49           HB       THR  49   4.175  -5.493   4.215
  380    HG1  THR  49           HG1      THR  49   3.766  -6.537   1.788
  381   1HG2  THR  49          1HG2      THR  49   1.791  -6.302   4.475
  382   2HG2  THR  49          2HG2      THR  49   1.823  -6.716   2.762
  383   3HG2  THR  49          3HG2      THR  49   2.924  -7.516   3.879
  384    H    VAL  50           H        VAL  50   3.068  -3.979   0.818
  385    HA   VAL  50           HA       VAL  50   0.443  -3.279  -0.030
  386    HB   VAL  50           HB       VAL  50   2.683  -4.664  -1.516
  387   1HG1  VAL  50          1HG1      VAL  50   0.067  -3.485  -2.466
  388   2HG1  VAL  50          2HG1      VAL  50   1.444  -3.719  -3.542
  389   3HG1  VAL  50          3HG1      VAL  50   0.692  -5.108  -2.758
  390   1HG2  VAL  50          1HG2      VAL  50   1.801  -1.778  -1.265
  391   2HG2  VAL  50          2HG2      VAL  50   3.343  -2.470  -0.761
  392   3HG2  VAL  50          3HG2      VAL  50   2.955  -2.337  -2.476
  393    H    GLU  51           H        GLU  51   2.014  -6.469   0.296
  394    HA   GLU  51           HA       GLU  51   0.069  -8.055  -0.968
  395   1HB   GLU  51          1HB       GLU  51   2.196  -8.945  -0.018
  396   2HB   GLU  51          2HB       GLU  51   1.542  -8.722   1.604
  397   1HG   GLU  51          1HG       GLU  51  -0.305 -10.273   1.082
  398   2HG   GLU  51          2HG       GLU  51   0.346 -10.499  -0.542
  399    H    GLY  52           H        GLY  52   0.075  -6.683   2.292
  400   1HA   GLY  52          1HA       GLY  52  -1.648  -6.552   3.889
  401   2HA   GLY  52          2HA       GLY  52  -2.437  -7.898   3.067
  402    H    VAL  53           H        VAL  53  -1.487  -4.887   1.457
  403    HA   VAL  53           HA       VAL  53  -3.994  -3.531   1.707
  404    HB   VAL  53           HB       VAL  53  -1.855  -3.370  -0.430
  405   1HG1  VAL  53          1HG1      VAL  53  -4.367  -1.752   0.012
  406   2HG1  VAL  53          2HG1      VAL  53  -2.976  -1.093  -0.849
  407   3HG1  VAL  53          3HG1      VAL  53  -3.809  -2.515  -1.477
  408   1HG2  VAL  53          1HG2      VAL  53  -2.526  -1.694   2.007
  409   2HG2  VAL  53          2HG2      VAL  53  -1.080  -2.676   1.767
  410   3HG2  VAL  53          3HG2      VAL  53  -1.340  -1.232   0.788
  411    H    LYS  54           H        LYS  54  -2.760  -5.593  -0.982
  412    HA   LYS  54           HA       LYS  54  -5.246  -5.433  -2.442
  413   1HB   LYS  54          1HB       LYS  54  -4.323  -7.262  -3.814
  414   2HB   LYS  54          2HB       LYS  54  -3.133  -5.985  -3.565
  415   1HG   LYS  54          1HG       LYS  54  -2.242  -7.337  -1.615
  416   2HG   LYS  54          2HG       LYS  54  -3.291  -8.654  -2.144
  417   1HD   LYS  54          1HD       LYS  54  -1.152  -7.328  -3.841
  418   2HD   LYS  54          2HD       LYS  54  -1.002  -8.901  -3.058
  419   1HE   LYS  54          1HE       LYS  54  -1.670  -9.503  -5.219
  420   2HE   LYS  54          2HE       LYS  54  -3.215  -9.461  -4.371
  421   1HZ   LYS  54          1HZ       LYS  54  -2.848  -6.891  -5.173
  422   2HZ   LYS  54          2HZ       LYS  54  -2.242  -7.785  -6.484
  423   3HZ   LYS  54          3HZ       LYS  54  -3.832  -8.038  -5.949
  424    H    ALA  55           H        ALA  55  -3.941  -7.836  -0.162
  425    HA   ALA  55           HA       ALA  55  -6.095  -9.719  -0.515
  426   1HB   ALA  55          1HB       ALA  55  -5.303 -10.546   1.777
  427   2HB   ALA  55          2HB       ALA  55  -4.091  -9.266   1.702
  428   3HB   ALA  55          3HB       ALA  55  -4.098 -10.547   0.490
  429    H    LEU  56           H        LEU  56  -5.620  -6.964   1.626
  430    HA   LEU  56           HA       LEU  56  -7.932  -7.479   3.252
  431   1HB   LEU  56          1HB       LEU  56  -6.137  -6.068   4.043
  432   2HB   LEU  56          2HB       LEU  56  -6.391  -4.935   2.719
  433    HG   LEU  56           HG       LEU  56  -8.631  -4.406   3.581
  434   1HD1  LEU  56          1HD1      LEU  56  -7.955  -6.615   5.521
  435   2HD1  LEU  56          2HD1      LEU  56  -9.060  -5.328   6.008
  436   3HD1  LEU  56          3HD1      LEU  56  -9.447  -6.342   4.622
  437   1HD2  LEU  56          1HD2      LEU  56  -6.398  -3.365   4.496
  438   2HD2  LEU  56          2HD2      LEU  56  -7.902  -3.040   5.352
  439   3HD2  LEU  56          3HD2      LEU  56  -6.786  -4.258   5.966
  440    H    ILE  57           H        ILE  57  -7.369  -5.560   0.312
  441    HA   ILE  57           HA       ILE  57 -10.097  -4.552   0.187
  442    HB   ILE  57           HB       ILE  57  -7.963  -4.871  -1.935
  443   1HG1  ILE  57          1HG1      ILE  57  -7.402  -3.277  -0.125
  444   2HG1  ILE  57          2HG1      ILE  57  -7.658  -2.438  -1.647
  445   1HG2  ILE  57          1HG2      ILE  57 -10.679  -3.560  -2.040
  446   2HG2  ILE  57          2HG2      ILE  57  -9.390  -3.171  -3.180
  447   3HG2  ILE  57          3HG2      ILE  57 -10.032  -4.811  -3.101
  448   1HD1  ILE  57          1HD1      ILE  57 -10.184  -2.334  -0.614
  449   2HD1  ILE  57          2HD1      ILE  57  -9.234  -2.351   0.868
  450   3HD1  ILE  57          3HD1      ILE  57  -8.968  -1.094  -0.336
  451    H    ASP  58           H        ASP  58  -8.313  -7.292  -1.181
  452    HA   ASP  58           HA       ASP  58 -10.435  -8.267  -2.852
  453   1HB   ASP  58          1HB       ASP  58  -8.067  -8.971  -3.090
  454   2HB   ASP  58          2HB       ASP  58  -8.188  -9.835  -1.557
  455    H    GLU  59           H        GLU  59  -9.543  -9.026   0.527
  456    HA   GLU  59           HA       GLU  59 -11.580 -11.061   0.766
  457   1HB   GLU  59          1HB       GLU  59 -10.978 -11.216   3.043
  458   2HB   GLU  59          2HB       GLU  59  -9.482 -10.712   2.265
  459   1HG   GLU  59          1HG       GLU  59  -9.968  -8.382   2.875
  460   2HG   GLU  59          2HG       GLU  59 -11.428  -8.889   3.709
  461    H    ILE  60           H        ILE  60 -11.425  -7.595   1.413
  462    HA   ILE  60           HA       ILE  60 -14.050  -7.459   2.590
  463    HB   ILE  60           HB       ILE  60 -12.299  -5.357   1.290
  464   1HG1  ILE  60          1HG1      ILE  60 -13.041  -5.760   4.198
  465   2HG1  ILE  60          2HG1      ILE  60 -11.611  -6.496   3.472
  466   1HG2  ILE  60          1HG2      ILE  60 -14.993  -5.151   2.651
  467   2HG2  ILE  60          2HG2      ILE  60 -13.887  -3.780   2.556
  468   3HG2  ILE  60          3HG2      ILE  60 -14.517  -4.508   1.079
  469   1HD1  ILE  60          1HD1      ILE  60 -10.872  -4.206   2.754
  470   2HD1  ILE  60          2HD1      ILE  60 -12.235  -3.534   3.649
  471   3HD1  ILE  60          3HD1      ILE  60 -10.956  -4.396   4.506
  472    H    LEU  61           H        LEU  61 -12.787  -7.029  -0.706
  473    HA   LEU  61           HA       LEU  61 -15.330  -6.315  -1.859
  474   1HB   LEU  61          1HB       LEU  61 -12.717  -7.331  -2.980
  475   2HB   LEU  61          2HB       LEU  61 -14.133  -7.196  -4.025
  476    HG   LEU  61           HG       LEU  61 -12.956  -4.927  -2.385
  477   1HD1  LEU  61          1HD1      LEU  61 -11.626  -5.878  -4.424
  478   2HD1  LEU  61          2HD1      LEU  61 -12.902  -5.147  -5.396
  479   3HD1  LEU  61          3HD1      LEU  61 -11.909  -4.140  -4.344
  480   1HD2  LEU  61          1HD2      LEU  61 -15.408  -5.221  -4.080
  481   2HD2  LEU  61          2HD2      LEU  61 -15.116  -4.168  -2.695
  482   3HD2  LEU  61          3HD2      LEU  61 -14.497  -3.725  -4.281
  483    H    ALA  62           H        ALA  62 -13.634  -9.389  -1.386
  484    HA   ALA  62           HA       ALA  62 -15.594 -10.981  -2.787
  485   1HB   ALA  62          1HB       ALA  62 -13.697 -11.832  -0.578
  486   2HB   ALA  62          2HB       ALA  62 -13.264 -11.743  -2.286
  487   3HB   ALA  62          3HB       ALA  62 -14.490 -12.890  -1.744
  488    H    ALA  63           H        ALA  63 -15.286  -9.791   0.506
  489    HA   ALA  63           HA       ALA  63 -17.175 -11.492   1.778
  490   1HB   ALA  63          1HB       ALA  63 -17.372  -9.715   3.459
  491   2HB   ALA  63          2HB       ALA  63 -15.685  -9.926   2.994
  492   3HB   ALA  63          3HB       ALA  63 -16.612  -8.569   2.357
  493    H    LEU  64           H        LEU  64 -17.640  -8.469  -0.049
  494    HA   LEU  64           HA       LEU  64 -20.436  -8.234   0.510
  495   1HB   LEU  64          1HB       LEU  64 -18.860  -7.275  -1.898
  496   2HB   LEU  64          2HB       LEU  64 -20.468  -6.713  -1.457
  497    HG   LEU  64           HG       LEU  64 -18.155  -6.533   0.483
  498   1HD1  LEU  64          1HD1      LEU  64 -17.486  -5.363  -1.582
  499   2HD1  LEU  64          2HD1      LEU  64 -18.998  -4.455  -1.559
  500   3HD1  LEU  64          3HD1      LEU  64 -17.806  -4.215  -0.282
  501   1HD2  LEU  64          1HD2      LEU  64 -20.842  -5.154   0.192
  502   2HD2  LEU  64          2HD2      LEU  64 -20.280  -6.156   1.529
  503   3HD2  LEU  64          3HD2      LEU  64 -19.581  -4.562   1.269
  504    HA   PRO  65           HA       PRO  65 -22.027 -11.542  -2.039
  505   1HB   PRO  65          1HB       PRO  65 -24.366 -10.237  -2.975
  506   2HB   PRO  65          2HB       PRO  65 -24.219 -11.198  -1.500
  507   1HG   PRO  65          1HG       PRO  65 -24.344  -8.258  -1.808
  508   2HG   PRO  65          2HG       PRO  65 -24.728  -9.255  -0.398
  509   1HD   PRO  65          1HD       PRO  65 -22.430  -7.673  -0.664
  510   2HD   PRO  65          2HD       PRO  65 -22.605  -9.033   0.474

  No H/Q in entry =         510
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1  37.643  14.242 -12.002
    2    H2   MET   1           H2       MET   1  38.677  13.022 -12.574
    3    H3   MET   1           H3       MET   1  39.218  14.628 -12.510
    4    HA   MET   1           HA       MET   1  38.144  15.243 -14.385
    5   1HB   MET   1          1HB       MET   1  39.618  13.270 -14.897
    6   2HB   MET   1          2HB       MET   1  38.200  12.234 -14.763
    7   1HG   MET   1          1HG       MET   1  38.504  12.741 -17.105
    8   2HG   MET   1          2HG       MET   1  37.097  13.641 -16.549
    9   1HE   MET   1          1HE       MET   1  40.726  13.472 -16.954
   10   2HE   MET   1          2HE       MET   1  41.244  14.986 -17.689
   11   3HE   MET   1          3HE       MET   1  41.097  14.858 -15.932
   12    H    LYS   2           H        LYS   2  36.115  15.713 -13.011
   13    HA   LYS   2           HA       LYS   2  33.862  13.868 -13.658
   14   1HB   LYS   2          1HB       LYS   2  32.629  14.909 -11.917
   15   2HB   LYS   2          2HB       LYS   2  34.256  14.729 -11.275
   16   1HG   LYS   2          1HG       LYS   2  33.033  17.266 -12.413
   17   2HG   LYS   2          2HG       LYS   2  33.438  16.950 -10.732
   18   1HD   LYS   2          1HD       LYS   2  35.845  16.592 -11.526
   19   2HD   LYS   2          2HD       LYS   2  35.332  17.314 -13.055
   20   1HE   LYS   2          1HE       LYS   2  36.290  19.025 -11.571
   21   2HE   LYS   2          2HE       LYS   2  34.574  19.329 -11.838
   22   1HZ   LYS   2          1HZ       LYS   2  35.492  17.731  -9.534
   23   2HZ   LYS   2          2HZ       LYS   2  35.464  19.429  -9.460
   24   3HZ   LYS   2          3HZ       LYS   2  34.028  18.564  -9.735
   25    H    ALA   3           H        ALA   3  35.305  15.893 -15.464
   26    HA   ALA   3           HA       ALA   3  33.578  18.072 -16.046
   27   1HB   ALA   3          1HB       ALA   3  35.493  16.463 -17.743
   28   2HB   ALA   3          2HB       ALA   3  35.703  18.093 -17.105
   29   3HB   ALA   3          3HB       ALA   3  34.565  17.802 -18.421
   30    H    ILE   4           H        ILE   4  33.515  14.694 -17.095
   31    HA   ILE   4           HA       ILE   4  30.910  15.187 -18.497
   32    HB   ILE   4           HB       ILE   4  32.815  14.127 -19.790
   33   1HG1  ILE   4          1HG1      ILE   4  31.367  12.218 -20.632
   34   2HG1  ILE   4          2HG1      ILE   4  30.258  12.565 -19.310
   35   1HG2  ILE   4          1HG2      ILE   4  33.568  12.797 -17.720
   36   2HG2  ILE   4          2HG2      ILE   4  32.255  11.684 -18.105
   37   3HG2  ILE   4          3HG2      ILE   4  33.562  11.940 -19.260
   38   1HD1  ILE   4          1HD1      ILE   4  31.046  14.867 -21.056
   39   2HD1  ILE   4          2HD1      ILE   4  29.957  13.663 -21.737
   40   3HD1  ILE   4          3HD1      ILE   4  29.509  14.521 -20.265
   41    H    PHE   5           H        PHE   5  29.080  14.090 -17.774
   42    HA   PHE   5           HA       PHE   5  29.412  12.073 -15.592
   43   1HB   PHE   5          1HB       PHE   5  27.655  13.205 -14.274
   44   2HB   PHE   5          2HB       PHE   5  29.053  14.257 -14.505
   45    HD1  PHE   5           HD1      PHE   5  28.965  16.172 -16.006
   46    HD2  PHE   5           HD2      PHE   5  25.549  13.627 -15.462
   47    HE1  PHE   5           HE1      PHE   5  27.529  17.865 -17.110
   48    HE2  PHE   5           HE2      PHE   5  24.112  15.320 -16.566
   49    HZ   PHE   5           HZ       PHE   5  25.103  17.440 -17.391
   50    H    VAL   6           H        VAL   6  27.673  10.614 -15.419
   51    HA   VAL   6           HA       VAL   6  25.563  10.770 -17.546
   52    HB   VAL   6           HB       VAL   6  27.083   8.288 -16.681
   53   1HG1  VAL   6          1HG1      VAL   6  24.763   8.769 -18.567
   54   2HG1  VAL   6          2HG1      VAL   6  25.746   7.306 -18.623
   55   3HG1  VAL   6          3HG1      VAL   6  24.816   7.688 -17.175
   56   1HG2  VAL   6          1HG2      VAL   6  27.054   9.847 -19.288
   57   2HG2  VAL   6          2HG2      VAL   6  28.412   9.726 -18.168
   58   3HG2  VAL   6          3HG2      VAL   6  27.862   8.299 -19.045
   59    H    LEU   7           H        LEU   7  23.549  10.491 -16.744
   60    HA   LEU   7           HA       LEU   7  23.117  10.220 -13.916
   61   1HB   LEU   7          1HB       LEU   7  21.302  10.103 -16.330
   62   2HB   LEU   7          2HB       LEU   7  20.676   9.871 -14.701
   63    HG   LEU   7           HG       LEU   7  20.514  12.241 -15.572
   64   1HD1  LEU   7          1HD1      LEU   7  20.754  11.505 -13.068
   65   2HD1  LEU   7          2HD1      LEU   7  22.356  12.236 -13.189
   66   3HD1  LEU   7          3HD1      LEU   7  20.919  13.205 -13.490
   67   1HD2  LEU   7          1HD2      LEU   7  22.778  12.111 -16.733
   68   2HD2  LEU   7          2HD2      LEU   7  22.482  13.581 -15.805
   69   3HD2  LEU   7          3HD2      LEU   7  23.510  12.313 -15.139
   70    H    ASN   8           H        ASN   8  24.491   8.178 -13.775
   71    HA   ASN   8           HA       ASN   8  23.628   5.689 -14.853
   72   1HB   ASN   8          1HB       ASN   8  25.840   6.007 -13.795
   73   2HB   ASN   8          2HB       ASN   8  25.055   6.212 -12.228
   74   2HD2  ASN   8          2HD2      ASN   8  25.856   4.271 -11.233
   75   1HD2  ASN   8          1HD2      ASN   8  25.449   2.721 -11.791
   76    H    ALA   9           H        ALA   9  22.797   7.308 -11.783
   77    HA   ALA   9           HA       ALA   9  20.845   5.154 -11.160
   78   1HB   ALA   9          1HB       ALA   9  21.700   7.614  -9.602
   79   2HB   ALA   9          2HB       ALA   9  22.237   5.959  -9.313
   80   3HB   ALA   9          3HB       ALA   9  20.554   6.405  -9.025
   81    H    GLN  10           H        GLN  10  18.693   5.404 -11.530
   82    HA   GLN  10           HA       GLN  10  17.769   7.811 -12.896
   83   1HB   GLN  10          1HB       GLN  10  15.585   6.635 -12.990
   84   2HB   GLN  10          2HB       GLN  10  16.902   5.638 -13.601
   85   1HG   GLN  10          1HG       GLN  10  16.013   5.449 -10.714
   86   2HG   GLN  10          2HG       GLN  10  15.206   4.535 -11.982
   87   2HE2  GLN  10          2HE2      GLN  10  17.187   3.773  -9.672
   88   1HE2  GLN  10          1HE2      GLN  10  18.326   2.792 -10.461
   89    H    HIS  11           H        HIS  11  16.135   9.241 -12.137
   90    HA   HIS  11           HA       HIS  11  15.432   9.092  -9.243
   91   1HB   HIS  11          1HB       HIS  11  17.440  10.510  -9.384
   92   2HB   HIS  11          2HB       HIS  11  16.660  11.506 -10.613
   93    HD1  HIS  11           HD1      HIS  11  14.855  13.165  -9.844
   94    HD2  HIS  11           HD2      HIS  11  16.376  10.841  -6.736
   95    HE1  HIS  11           HE1      HIS  11  14.010  14.203  -7.694
   96    H    ASP  12           H        ASP  12  13.493   8.432 -10.791
   97    HA   ASP  12           HA       ASP  12  12.100  10.572 -12.139
   98   1HB   ASP  12          1HB       ASP  12  11.197   7.858 -11.143
   99   2HB   ASP  12          2HB       ASP  12  10.150   8.954 -12.045
  100    H    GLU  13           H        GLU  13  12.383   9.629  -8.829
  101    HA   GLU  13           HA       GLU  13  10.527  11.807  -8.064
  102   1HB   GLU  13          1HB       GLU  13   9.357  10.285  -6.443
  103   2HB   GLU  13          2HB       GLU  13   9.035   9.899  -8.135
  104   1HG   GLU  13          1HG       GLU  13  10.820   8.167  -8.054
  105   2HG   GLU  13          2HG       GLU  13  11.048   8.515  -6.339
  106    H    ALA  14           H        ALA  14  10.787  12.411  -5.784
  107    HA   ALA  14           HA       ALA  14  13.534  12.311  -4.945
  108   1HB   ALA  14          1HB       ALA  14  12.866  13.689  -3.119
  109   2HB   ALA  14          2HB       ALA  14  11.855  14.168  -4.483
  110   3HB   ALA  14          3HB       ALA  14  11.197  13.126  -3.222
  111    H    VAL  15           H        VAL  15  10.606  10.822  -3.599
  112    HA   VAL  15           HA       VAL  15  12.370   8.930  -2.060
  113    HB   VAL  15           HB       VAL  15   9.579   9.860  -1.331
  114   1HG1  VAL  15          1HG1      VAL  15  11.667   8.160   0.059
  115   2HG1  VAL  15          2HG1      VAL  15  10.266   8.840   0.888
  116   3HG1  VAL  15          3HG1      VAL  15  10.040   7.681  -0.421
  117   1HG2  VAL  15          1HG2      VAL  15  12.324  10.753  -0.411
  118   2HG2  VAL  15          2HG2      VAL  15  11.033  11.750  -1.080
  119   3HG2  VAL  15          3HG2      VAL  15  10.863  11.051   0.530
  120    H    ASP  16           H        ASP  16  12.195   6.863  -2.730
  121    HA   ASP  16           HA       ASP  16  10.266   6.068  -4.726
  122   1HB   ASP  16          1HB       ASP  16  12.225   4.498  -3.036
  123   2HB   ASP  16          2HB       ASP  16  11.216   3.762  -4.281
  124    H    ALA  17           H        ALA  17  10.217   6.106  -1.267
  125    HA   ALA  17           HA       ALA  17   8.470   3.968  -0.680
  126   1HB   ALA  17          1HB       ALA  17   8.033   5.055   1.373
  127   2HB   ALA  17          2HB       ALA  17   8.233   6.659   0.669
  128   3HB   ALA  17          3HB       ALA  17   9.640   5.627   0.925
  129    H    ASN  18           H        ASN  18   7.893   6.532  -2.745
  130    HA   ASN  18           HA       ASN  18   5.172   7.195  -2.224
  131   1HB   ASN  18          1HB       ASN  18   6.764   7.133  -4.795
  132   2HB   ASN  18          2HB       ASN  18   5.123   7.769  -4.693
  133   2HD2  ASN  18          2HD2      ASN  18   5.130   9.176  -2.299
  134   1HD2  ASN  18          1HD2      ASN  18   6.293  10.412  -2.343
  135    H    SER  19           H        SER  19   6.604   4.545  -4.135
  136    HA   SER  19           HA       SER  19   4.178   3.566  -5.262
  137   1HB   SER  19          1HB       SER  19   6.716   2.129  -4.440
  138   2HB   SER  19          2HB       SER  19   5.407   1.348  -5.320
  139    HG   SER  19           HG       SER  19   6.141   3.742  -6.402
  140    H    LEU  20           H        LEU  20   5.749   2.921  -2.147
  141    HA   LEU  20           HA       LEU  20   3.940   0.905  -1.254
  142   1HB   LEU  20          1HB       LEU  20   6.118   1.413  -0.158
  143   2HB   LEU  20          2HB       LEU  20   5.487   2.966   0.364
  144    HG   LEU  20           HG       LEU  20   5.472   1.152   2.126
  145   1HD1  LEU  20          1HD1      LEU  20   3.727   3.192   1.827
  146   2HD1  LEU  20          2HD1      LEU  20   2.594   1.844   1.762
  147   3HD1  LEU  20          3HD1      LEU  20   3.645   2.045   3.159
  148   1HD2  LEU  20          1HD2      LEU  20   4.707  -0.598   0.358
  149   2HD2  LEU  20          2HD2      LEU  20   4.048  -0.707   1.989
  150   3HD2  LEU  20          3HD2      LEU  20   3.081   0.001   0.698
  151    H    ALA  21           H        ALA  21   3.989   4.423  -0.717
  152    HA   ALA  21           HA       ALA  21   1.484   4.497   0.676
  153   1HB   ALA  21          1HB       ALA  21   3.015   6.676  -0.768
  154   2HB   ALA  21          2HB       ALA  21   3.130   6.278   0.947
  155   3HB   ALA  21          3HB       ALA  21   1.636   6.954   0.298
  156    H    GLU  22           H        GLU  22   2.388   4.863  -2.737
  157    HA   GLU  22           HA       GLU  22  -0.100   5.867  -3.684
  158   1HB   GLU  22          1HB       GLU  22   1.957   5.730  -5.087
  159   2HB   GLU  22          2HB       GLU  22   1.773   3.976  -5.138
  160   1HG   GLU  22          1HG       GLU  22  -0.428   4.221  -6.215
  161   2HG   GLU  22          2HG       GLU  22  -0.276   5.976  -6.145
  162    H    ALA  23           H        ALA  23   0.985   2.548  -3.050
  163    HA   ALA  23           HA       ALA  23  -1.228   1.195  -4.196
  164   1HB   ALA  23          1HB       ALA  23   0.344   0.459  -1.704
  165   2HB   ALA  23          2HB       ALA  23   0.773   0.016  -3.355
  166   3HB   ALA  23          3HB       ALA  23  -0.691  -0.637  -2.619
  167    H    LYS  24           H        LYS  24  -0.811   2.565  -0.922
  168    HA   LYS  24           HA       LYS  24  -3.436   1.765  -0.018
  169   1HB   LYS  24          1HB       LYS  24  -1.527   3.908   0.931
  170   2HB   LYS  24          2HB       LYS  24  -3.046   3.538   1.745
  171   1HG   LYS  24          1HG       LYS  24  -2.272   1.145   1.924
  172   2HG   LYS  24          2HG       LYS  24  -0.702   1.668   1.317
  173   1HD   LYS  24          1HD       LYS  24  -2.031   2.894   3.747
  174   2HD   LYS  24          2HD       LYS  24  -0.893   1.558   3.850
  175   1HE   LYS  24          1HE       LYS  24   0.721   3.048   2.512
  176   2HE   LYS  24          2HE       LYS  24  -0.379   4.372   2.895
  177   1HZ   LYS  24          1HZ       LYS  24  -0.137   3.781   5.255
  178   2HZ   LYS  24          2HZ       LYS  24   1.022   2.616   4.832
  179   3HZ   LYS  24          3HZ       LYS  24   1.330   4.263   4.545
  180    H    VAL  25           H        VAL  25  -2.140   4.732  -1.496
  181    HA   VAL  25           HA       VAL  25  -4.529   6.272  -1.231
  182    HB   VAL  25           HB       VAL  25  -2.316   6.377  -3.293
  183   1HG1  VAL  25          1HG1      VAL  25  -4.727   8.146  -2.865
  184   2HG1  VAL  25          2HG1      VAL  25  -3.264   8.742  -3.651
  185   3HG1  VAL  25          3HG1      VAL  25  -4.168   7.409  -4.367
  186   1HG2  VAL  25          1HG2      VAL  25  -1.712   6.888  -0.931
  187   2HG2  VAL  25          2HG2      VAL  25  -1.571   8.305  -1.971
  188   3HG2  VAL  25          3HG2      VAL  25  -2.964   8.130  -0.902
  189    H    LEU  26           H        LEU  26  -3.348   4.246  -3.937
  190    HA   LEU  26           HA       LEU  26  -5.707   4.594  -5.532
  191   1HB   LEU  26          1HB       LEU  26  -3.658   2.356  -5.455
  192   2HB   LEU  26          2HB       LEU  26  -4.919   2.487  -6.679
  193    HG   LEU  26           HG       LEU  26  -2.852   4.635  -6.117
  194   1HD1  LEU  26          1HD1      LEU  26  -1.855   2.530  -6.991
  195   2HD1  LEU  26          2HD1      LEU  26  -2.958   2.601  -8.364
  196   3HD1  LEU  26          3HD1      LEU  26  -1.736   3.855  -8.149
  197   1HD2  LEU  26          1HD2      LEU  26  -5.112   4.329  -8.092
  198   2HD2  LEU  26          2HD2      LEU  26  -4.606   5.756  -7.189
  199   3HD2  LEU  26          3HD2      LEU  26  -3.668   5.217  -8.575
  200    H    ALA  27           H        ALA  27  -4.803   2.172  -3.076
  201    HA   ALA  27           HA       ALA  27  -7.192   0.582  -3.450
  202   1HB   ALA  27          1HB       ALA  27  -5.055  -0.181  -2.299
  203   2HB   ALA  27          2HB       ALA  27  -5.542   0.800  -0.917
  204   3HB   ALA  27          3HB       ALA  27  -6.544  -0.557  -1.433
  205    H    ASN  28           H        ASN  28  -6.286   3.223  -1.253
  206    HA   ASN  28           HA       ASN  28  -8.689   3.220   0.299
  207   1HB   ASN  28          1HB       ASN  28  -6.656   4.460   0.963
  208   2HB   ASN  28          2HB       ASN  28  -6.870   5.543  -0.412
  209   2HD2  ASN  28          2HD2      ASN  28  -6.913   6.429   2.365
  210   1HD2  ASN  28          1HD2      ASN  28  -8.470   7.029   2.678
  211    H    ARG  29           H        ARG  29  -7.802   4.836  -2.726
  212    HA   ARG  29           HA       ARG  29 -10.167   6.413  -2.999
  213   1HB   ARG  29          1HB       ARG  29  -8.263   5.259  -5.056
  214   2HB   ARG  29          2HB       ARG  29  -9.567   6.367  -5.470
  215   1HG   ARG  29          1HG       ARG  29  -7.611   7.128  -3.309
  216   2HG   ARG  29          2HG       ARG  29  -7.150   7.314  -4.998
  217   1HD   ARG  29          1HD       ARG  29  -9.682   8.487  -3.811
  218   2HD   ARG  29          2HD       ARG  29  -8.169   9.371  -3.971
  219    HE   ARG  29           HE       ARG  29  -8.624   8.423  -6.522
  220   1HH1  ARG  29          1HH1      ARG  29  -9.797   9.589  -8.060
  221   2HH1  ARG  29          2HH1      ARG  29 -10.980  10.740  -7.538
  222   1HH2  ARG  29          1HH2      ARG  29 -10.436  10.167  -4.162
  223   2HH2  ARG  29          2HH2      ARG  29 -11.343  11.067  -5.331
  224    H    GLU  30           H        GLU  30  -9.431   3.068  -3.896
  225    HA   GLU  30           HA       GLU  30 -11.710   2.597  -5.521
  226   1HB   GLU  30          1HB       GLU  30  -9.828   1.011  -5.342
  227   2HB   GLU  30          2HB       GLU  30 -10.275   0.662  -3.674
  228   1HG   GLU  30          1HG       GLU  30 -12.386   0.335  -5.796
  229   2HG   GLU  30          2HG       GLU  30 -11.121  -0.888  -5.691
  230    H    LEU  31           H        LEU  31 -11.322   2.395  -1.984
  231    HA   LEU  31           HA       LEU  31 -13.940   1.334  -1.439
  232   1HB   LEU  31          1HB       LEU  31 -12.419   3.278   0.330
  233   2HB   LEU  31          2HB       LEU  31 -13.577   2.044   0.830
  234    HG   LEU  31           HG       LEU  31 -10.887   1.539  -0.450
  235   1HD1  LEU  31          1HD1      LEU  31 -11.890   1.094   2.381
  236   2HD1  LEU  31          2HD1      LEU  31 -10.314   0.590   1.773
  237   3HD1  LEU  31          3HD1      LEU  31 -10.711   2.305   1.878
  238   1HD2  LEU  31          1HD2      LEU  31 -13.170  -0.260   0.386
  239   2HD2  LEU  31          2HD2      LEU  31 -12.261  -0.261  -1.125
  240   3HD2  LEU  31          3HD2      LEU  31 -11.516  -0.868   0.351
  241    H    ASP  32           H        ASP  32 -12.657   4.592  -1.763
  242    HA   ASP  32           HA       ASP  32 -14.974   6.053  -1.046
  243   1HB   ASP  32          1HB       ASP  32 -12.721   7.023  -1.311
  244   2HB   ASP  32          2HB       ASP  32 -12.817   6.756  -3.050
  245    H    LYS  33           H        LYS  33 -14.006   4.604  -4.138
  246    HA   LYS  33           HA       LYS  33 -15.969   5.836  -5.781
  247   1HB   LYS  33          1HB       LYS  33 -14.035   4.428  -6.570
  248   2HB   LYS  33          2HB       LYS  33 -14.932   3.001  -6.052
  249   1HG   LYS  33          1HG       LYS  33 -16.828   3.751  -7.544
  250   2HG   LYS  33          2HG       LYS  33 -15.761   5.011  -8.163
  251   1HD   LYS  33          1HD       LYS  33 -15.187   2.034  -8.261
  252   2HD   LYS  33          2HD       LYS  33 -15.745   3.006  -9.621
  253   1HE   LYS  33          1HE       LYS  33 -13.655   4.491  -9.107
  254   2HE   LYS  33          2HE       LYS  33 -13.082   3.079  -8.218
  255   1HZ   LYS  33          1HZ       LYS  33 -14.033   2.111 -10.608
  256   2HZ   LYS  33          2HZ       LYS  33 -13.175   3.518 -11.020
  257   3HZ   LYS  33          3HZ       LYS  33 -12.408   2.275 -10.153
  258    H    TYR  34           H        TYR  34 -16.186   2.884  -3.767
  259    HA   TYR  34           HA       TYR  34 -18.970   2.441  -4.616
  260   1HB   TYR  34          1HB       TYR  34 -17.226   1.089  -2.542
  261   2HB   TYR  34          2HB       TYR  34 -18.894   0.620  -2.869
  262    HD1  TYR  34           HD1      TYR  34 -15.467   0.712  -4.179
  263    HD2  TYR  34           HD2      TYR  34 -19.518  -0.435  -4.997
  264    HE1  TYR  34           HE1      TYR  34 -14.687  -0.642  -6.099
  265    HE2  TYR  34           HE2      TYR  34 -18.743  -1.795  -6.922
  266    HH   TYR  34           HH       TYR  34 -15.305  -1.863  -7.856
  267    H    GLY  35           H        GLY  35 -17.384   4.385  -2.322
  268   1HA   GLY  35          1HA       GLY  35 -19.948   5.227  -1.198
  269   2HA   GLY  35          2HA       GLY  35 -18.374   5.923  -0.821
  270    H    VAL  36           H        VAL  36 -17.494   2.969  -0.288
  271    HA   VAL  36           HA       VAL  36 -18.944   1.890   1.868
  272    HB   VAL  36           HB       VAL  36 -15.921   1.910   1.889
  273   1HG1  VAL  36          1HG1      VAL  36 -18.022  -0.191   2.502
  274   2HG1  VAL  36          2HG1      VAL  36 -16.279  -0.424   2.633
  275   3HG1  VAL  36          3HG1      VAL  36 -17.098   0.723   3.692
  276   1HG2  VAL  36          1HG2      VAL  36 -17.785   0.532  -0.055
  277   2HG2  VAL  36          2HG2      VAL  36 -16.362   1.507  -0.414
  278   3HG2  VAL  36          3HG2      VAL  36 -16.173  -0.096   0.293
  279    H    SER  37           H        SER  37 -18.281   1.978   4.240
  280    HA   SER  37           HA       SER  37 -18.490   4.636   5.233
  281   1HB   SER  37          1HB       SER  37 -18.178   3.678   7.418
  282   2HB   SER  37          2HB       SER  37 -19.076   2.500   6.466
  283    HG   SER  37           HG       SER  37 -17.302   1.577   7.611
  284    H    ASP  38           H        ASP  38 -16.864   5.816   6.539
  285    HA   ASP  38           HA       ASP  38 -14.270   5.843   5.181
  286   1HB   ASP  38          1HB       ASP  38 -13.811   7.813   6.549
  287   2HB   ASP  38          2HB       ASP  38 -15.438   7.937   5.878
  288    H    TYR  39           H        TYR  39 -15.465   3.965   7.632
  289    HA   TYR  39           HA       TYR  39 -13.267   4.045   9.506
  290   1HB   TYR  39          1HB       TYR  39 -15.355   3.112  10.245
  291   2HB   TYR  39          2HB       TYR  39 -15.385   1.964   8.907
  292    HD1  TYR  39           HD1      TYR  39 -13.876   0.046   8.854
  293    HD2  TYR  39           HD2      TYR  39 -13.932   2.735  12.202
  294    HE1  TYR  39           HE1      TYR  39 -12.619  -1.605  10.194
  295    HE2  TYR  39           HE2      TYR  39 -12.671   1.076  13.551
  296    HH   TYR  39           HH       TYR  39 -12.465  -2.002  12.953
  297    H    TYR  40           H        TYR  40 -13.984   2.068   6.651
  298    HA   TYR  40           HA       TYR  40 -11.798   0.249   6.929
  299   1HB   TYR  40          1HB       TYR  40 -13.304   1.159   4.464
  300   2HB   TYR  40          2HB       TYR  40 -12.176  -0.196   4.501
  301    HD1  TYR  40           HD1      TYR  40 -15.505   0.977   5.388
  302    HD2  TYR  40           HD2      TYR  40 -12.665  -2.199   5.917
  303    HE1  TYR  40           HE1      TYR  40 -17.313  -0.496   6.223
  304    HE2  TYR  40           HE2      TYR  40 -14.473  -3.676   6.757
  305    HH   TYR  40           HH       TYR  40 -16.791  -3.271   7.907
  306    H    LYS  41           H        LYS  41 -11.956   3.439   5.294
  307    HA   LYS  41           HA       LYS  41  -9.485   3.168   3.919
  308   1HB   LYS  41          1HB       LYS  41  -9.608   5.462   3.472
  309   2HB   LYS  41          2HB       LYS  41 -11.298   5.057   3.759
  310   1HG   LYS  41          1HG       LYS  41 -10.839   5.721   6.212
  311   2HG   LYS  41          2HG       LYS  41  -9.366   6.464   5.605
  312   1HD   LYS  41          1HD       LYS  41 -12.156   7.079   4.586
  313   2HD   LYS  41          2HD       LYS  41 -11.256   8.083   5.723
  314   1HE   LYS  41          1HE       LYS  41  -9.396   8.139   3.949
  315   2HE   LYS  41          2HE       LYS  41 -10.600   7.494   2.833
  316   1HZ   LYS  41          1HZ       LYS  41 -11.880   9.544   4.099
  317   2HZ   LYS  41          2HZ       LYS  41 -10.310  10.146   3.860
  318   3HZ   LYS  41          3HZ       LYS  41 -11.223   9.593   2.537
  319    H    ASN  42           H        ASN  42 -10.235   4.216   7.211
  320    HA   ASN  42           HA       ASN  42  -7.605   4.997   7.936
  321   1HB   ASN  42          1HB       ASN  42  -9.871   3.838   9.580
  322   2HB   ASN  42          2HB       ASN  42  -8.372   4.439  10.291
  323   2HD2  ASN  42          2HD2      ASN  42  -7.861   6.743   8.815
  324   1HD2  ASN  42          1HD2      ASN  42  -9.134   7.851   8.999
  325    H    LEU  43           H        LEU  43  -9.236   1.863   7.943
  326    HA   LEU  43           HA       LEU  43  -7.190   0.346   9.205
  327   1HB   LEU  43          1HB       LEU  43  -9.460  -0.536   8.791
  328   2HB   LEU  43          2HB       LEU  43  -9.155  -0.514   7.057
  329    HG   LEU  43           HG       LEU  43  -7.331  -2.137   7.342
  330   1HD1  LEU  43          1HD1      LEU  43  -7.981  -1.740  10.256
  331   2HD1  LEU  43          2HD1      LEU  43  -7.336  -3.290   9.713
  332   3HD1  LEU  43          3HD1      LEU  43  -6.404  -1.815   9.468
  333   1HD2  LEU  43          1HD2      LEU  43  -9.968  -2.901   8.626
  334   2HD2  LEU  43          2HD2      LEU  43  -9.549  -3.024   6.917
  335   3HD2  LEU  43          3HD2      LEU  43  -8.755  -4.068   8.096
  336    H    ILE  44           H        ILE  44  -7.662   1.290   5.814
  337    HA   ILE  44           HA       ILE  44  -5.552  -0.264   4.685
  338    HB   ILE  44           HB       ILE  44  -6.482   2.518   3.875
  339   1HG1  ILE  44          1HG1      ILE  44  -8.393   1.035   3.864
  340   2HG1  ILE  44          2HG1      ILE  44  -7.876   1.256   2.196
  341   1HG2  ILE  44          1HG2      ILE  44  -4.977   0.356   2.379
  342   2HG2  ILE  44          2HG2      ILE  44  -5.655   1.796   1.621
  343   3HG2  ILE  44          3HG2      ILE  44  -4.376   1.952   2.822
  344   1HD1  ILE  44          1HD1      ILE  44  -6.457  -0.912   2.629
  345   2HD1  ILE  44          2HD1      ILE  44  -7.587  -1.151   3.962
  346   3HD1  ILE  44          3HD1      ILE  44  -8.186  -1.056   2.311
  347    H    ASN  45           H        ASN  45  -5.584   2.928   6.217
  348    HA   ASN  45           HA       ASN  45  -2.940   3.747   5.720
  349   1HB   ASN  45          1HB       ASN  45  -4.775   5.049   6.908
  350   2HB   ASN  45          2HB       ASN  45  -4.386   4.118   8.355
  351   2HD2  ASN  45          2HD2      ASN  45  -3.750   6.318   9.268
  352   1HD2  ASN  45          1HD2      ASN  45  -2.197   6.912   8.927
  353    H    ASN  46           H        ASN  46  -4.123   1.234   7.847
  354    HA   ASN  46           HA       ASN  46  -1.547   1.025   9.277
  355   1HB   ASN  46          1HB       ASN  46  -4.105  -0.589   9.441
  356   2HB   ASN  46          2HB       ASN  46  -2.686  -0.870  10.450
  357   2HD2  ASN  46          2HD2      ASN  46  -1.877   1.763  11.019
  358   1HD2  ASN  46          1HD2      ASN  46  -3.092   2.550  11.904
  359    H    ALA  47           H        ALA  47  -2.285   0.160   6.238
  360    HA   ALA  47           HA       ALA  47  -1.727  -2.637   6.110
  361   1HB   ALA  47          1HB       ALA  47  -2.500  -0.991   4.228
  362   2HB   ALA  47          2HB       ALA  47  -1.473  -2.357   3.802
  363   3HB   ALA  47          3HB       ALA  47  -0.774  -0.748   3.965
  364    H    LYS  48           H        LYS  48   0.158  -3.775   6.287
  365    HA   LYS  48           HA       LYS  48   2.650  -2.230   6.856
  366   1HB   LYS  48          1HB       LYS  48   3.439  -4.392   7.833
  367   2HB   LYS  48          2HB       LYS  48   1.986  -3.764   8.610
  368   1HG   LYS  48          1HG       LYS  48   0.595  -5.265   7.230
  369   2HG   LYS  48          2HG       LYS  48   2.044  -5.898   6.454
  370   1HD   LYS  48          1HD       LYS  48   2.877  -6.675   8.652
  371   2HD   LYS  48          2HD       LYS  48   1.407  -6.066   9.413
  372   1HE   LYS  48          1HE       LYS  48   1.171  -8.462   9.002
  373   2HE   LYS  48          2HE       LYS  48   0.064  -7.577   7.954
  374   1HZ   LYS  48          1HZ       LYS  48   2.493  -7.784   6.613
  375   2HZ   LYS  48          2HZ       LYS  48   2.142  -9.328   7.230
  376   3HZ   LYS  48          3HZ       LYS  48   1.023  -8.543   6.226
  377    H    THR  49           H        THR  49   1.255  -4.375   4.495
  378    HA   THR  49           HA       THR  49   3.841  -4.322   2.992
  379    HB   THR  49           HB       THR  49   3.360  -6.718   2.305
  380    HG1  THR  49           HG1      THR  49   1.255  -6.913   2.947
  381   1HG2  THR  49          1HG2      THR  49   3.984  -6.076   5.198
  382   2HG2  THR  49          2HG2      THR  49   4.228  -7.662   4.472
  383   3HG2  THR  49          3HG2      THR  49   5.135  -6.271   3.879
  384    H    VAL  50           H        VAL  50   3.571  -4.470   0.705
  385    HA   VAL  50           HA       VAL  50   1.193  -3.229  -0.325
  386    HB   VAL  50           HB       VAL  50   3.307  -4.798  -1.809
  387   1HG1  VAL  50          1HG1      VAL  50   1.244  -2.760  -2.668
  388   2HG1  VAL  50          2HG1      VAL  50   2.619  -3.219  -3.674
  389   3HG1  VAL  50          3HG1      VAL  50   1.410  -4.424  -3.228
  390   1HG2  VAL  50          1HG2      VAL  50   3.153  -1.861  -1.067
  391   2HG2  VAL  50          2HG2      VAL  50   4.334  -3.030  -0.472
  392   3HG2  VAL  50          3HG2      VAL  50   4.345  -2.552  -2.169
  393    H    GLU  51           H        GLU  51   2.371  -6.601  -0.366
  394    HA   GLU  51           HA       GLU  51   0.275  -7.681  -1.967
  395   1HB   GLU  51          1HB       GLU  51   1.928  -8.919   0.257
  396   2HB   GLU  51          2HB       GLU  51   0.818  -9.840  -0.758
  397   1HG   GLU  51          1HG       GLU  51   2.053  -9.131  -2.769
  398   2HG   GLU  51          2HG       GLU  51   3.168  -8.207  -1.763
  399    H    GLY  52           H        GLY  52   0.540  -7.047   1.491
  400   1HA   GLY  52          1HA       GLY  52  -1.100  -6.952   3.157
  401   2HA   GLY  52          2HA       GLY  52  -1.925  -8.245   2.283
  402    H    VAL  53           H        VAL  53  -1.148  -5.040   0.922
  403    HA   VAL  53           HA       VAL  53  -3.697  -3.840   1.448
  404    HB   VAL  53           HB       VAL  53  -1.687  -3.356  -0.773
  405   1HG1  VAL  53          1HG1      VAL  53  -4.279  -1.947  -0.108
  406   2HG1  VAL  53          2HG1      VAL  53  -2.972  -1.133  -0.969
  407   3HG1  VAL  53          3HG1      VAL  53  -3.741  -2.557  -1.673
  408   1HG2  VAL  53          1HG2      VAL  53  -1.010  -2.832   1.577
  409   2HG2  VAL  53          2HG2      VAL  53  -1.095  -1.398   0.554
  410   3HG2  VAL  53          3HG2      VAL  53  -2.392  -1.742   1.698
  411    H    LYS  54           H        LYS  54  -2.528  -5.576  -1.464
  412    HA   LYS  54           HA       LYS  54  -4.975  -5.419  -2.906
  413   1HB   LYS  54          1HB       LYS  54  -2.842  -6.097  -3.930
  414   2HB   LYS  54          2HB       LYS  54  -2.858  -7.591  -2.998
  415   1HG   LYS  54          1HG       LYS  54  -5.361  -7.123  -4.536
  416   2HG   LYS  54          2HG       LYS  54  -3.934  -7.294  -5.552
  417   1HD   LYS  54          1HD       LYS  54  -4.438  -9.272  -3.327
  418   2HD   LYS  54          2HD       LYS  54  -5.279  -9.440  -4.867
  419   1HE   LYS  54          1HE       LYS  54  -3.142  -9.495  -6.064
  420   2HE   LYS  54          2HE       LYS  54  -2.267  -9.252  -4.553
  421   1HZ   LYS  54          1HZ       LYS  54  -3.839 -11.375  -3.998
  422   2HZ   LYS  54          2HZ       LYS  54  -3.450 -11.646  -5.630
  423   3HZ   LYS  54          3HZ       LYS  54  -2.214 -11.467  -4.477
  424    H    ALA  55           H        ALA  55  -3.806  -7.960  -0.681
  425    HA   ALA  55           HA       ALA  55  -6.146  -9.624  -0.994
  426   1HB   ALA  55          1HB       ALA  55  -5.305 -10.792   1.012
  427   2HB   ALA  55          2HB       ALA  55  -4.147  -9.488   1.281
  428   3HB   ALA  55          3HB       ALA  55  -4.007 -10.512  -0.148
  429    H    LEU  56           H        LEU  56  -5.411  -6.867   0.992
  430    HA   LEU  56           HA       LEU  56  -7.464  -7.310   2.944
  431   1HB   LEU  56          1HB       LEU  56  -5.596  -5.851   3.416
  432   2HB   LEU  56          2HB       LEU  56  -6.068  -4.770   2.109
  433    HG   LEU  56           HG       LEU  56  -8.156  -4.229   3.270
  434   1HD1  LEU  56          1HD1      LEU  56  -7.207  -6.388   5.154
  435   2HD1  LEU  56          2HD1      LEU  56  -8.260  -5.101   5.744
  436   3HD1  LEU  56          3HD1      LEU  56  -8.807  -6.159   4.447
  437   1HD2  LEU  56          1HD2      LEU  56  -6.108  -2.948   3.813
  438   2HD2  LEU  56          2HD2      LEU  56  -7.180  -3.062   5.208
  439   3HD2  LEU  56          3HD2      LEU  56  -5.749  -4.084   5.112
  440    H    ILE  57           H        ILE  57  -7.379  -5.514  -0.124
  441    HA   ILE  57           HA       ILE  57 -10.097  -4.524   0.209
  442    HB   ILE  57           HB       ILE  57  -8.599  -4.918  -2.394
  443   1HG1  ILE  57          1HG1      ILE  57  -7.147  -3.610  -0.964
  444   2HG1  ILE  57          2HG1      ILE  57  -7.935  -2.490  -2.066
  445   1HG2  ILE  57          1HG2      ILE  57 -11.076  -4.375  -2.406
  446   2HG2  ILE  57          2HG2      ILE  57 -10.670  -2.847  -1.631
  447   3HG2  ILE  57          3HG2      ILE  57 -10.057  -3.209  -3.243
  448   1HD1  ILE  57          1HD1      ILE  57  -9.713  -2.246  -0.170
  449   2HD1  ILE  57          2HD1      ILE  57  -8.464  -2.939   0.864
  450   3HD1  ILE  57          3HD1      ILE  57  -8.166  -1.424   0.012
  451    H    ASP  58           H        ASP  58  -8.545  -7.288  -1.365
  452    HA   ASP  58           HA       ASP  58 -10.891  -8.310  -2.654
  453   1HB   ASP  58          1HB       ASP  58  -8.368  -9.671  -1.701
  454   2HB   ASP  58          2HB       ASP  58  -9.619 -10.498  -2.627
  455    H    GLU  59           H        GLU  59  -9.552  -8.925   0.601
  456    HA   GLU  59           HA       GLU  59 -11.525 -10.954   1.190
  457   1HB   GLU  59          1HB       GLU  59 -10.678 -10.940   3.421
  458   2HB   GLU  59          2HB       GLU  59  -9.284 -10.605   2.398
  459   1HG   GLU  59          1HG       GLU  59  -9.545  -8.216   2.828
  460   2HG   GLU  59          2HG       GLU  59 -10.909  -8.529   3.892
  461    H    ILE  60           H        ILE  60 -11.323  -7.469   1.593
  462    HA   ILE  60           HA       ILE  60 -13.746  -7.218   3.131
  463    HB   ILE  60           HB       ILE  60 -12.190  -5.263   1.419
  464   1HG1  ILE  60          1HG1      ILE  60 -12.524  -5.384   4.425
  465   2HG1  ILE  60          2HG1      ILE  60 -11.220  -6.219   3.581
  466   1HG2  ILE  60          1HG2      ILE  60 -14.656  -4.858   3.129
  467   2HG2  ILE  60          2HG2      ILE  60 -13.570  -3.535   2.704
  468   3HG2  ILE  60          3HG2      ILE  60 -14.427  -4.413   1.438
  469   1HD1  ILE  60          1HD1      ILE  60 -11.776  -3.238   3.447
  470   2HD1  ILE  60          2HD1      ILE  60 -10.484  -3.997   4.379
  471   3HD1  ILE  60          3HD1      ILE  60 -10.466  -4.077   2.617
  472    H    LEU  61           H        LEU  61 -12.989  -7.046  -0.337
  473    HA   LEU  61           HA       LEU  61 -15.683  -6.390  -1.142
  474   1HB   LEU  61          1HB       LEU  61 -13.322  -7.546  -2.644
  475   2HB   LEU  61          2HB       LEU  61 -14.864  -7.192  -3.422
  476    HG   LEU  61           HG       LEU  61 -13.214  -5.162  -1.886
  477   1HD1  LEU  61          1HD1      LEU  61 -13.462  -5.659  -4.869
  478   2HD1  LEU  61          2HD1      LEU  61 -12.646  -4.276  -4.144
  479   3HD1  LEU  61          3HD1      LEU  61 -12.016  -5.904  -3.891
  480   1HD2  LEU  61          1HD2      LEU  61 -15.821  -5.072  -3.390
  481   2HD2  LEU  61          2HD2      LEU  61 -15.361  -4.251  -1.899
  482   3HD2  LEU  61          3HD2      LEU  61 -14.772  -3.656  -3.444
  483    H    ALA  62           H        ALA  62 -13.932  -9.437  -0.698
  484    HA   ALA  62           HA       ALA  62 -15.855 -11.152  -1.906
  485   1HB   ALA  62          1HB       ALA  62 -14.142 -11.756   0.523
  486   2HB   ALA  62          2HB       ALA  62 -13.580 -11.865  -1.145
  487   3HB   ALA  62          3HB       ALA  62 -14.861 -12.935  -0.576
  488    H    ALA  63           H        ALA  63 -15.645  -9.856   1.407
  489    HA   ALA  63           HA       ALA  63 -17.839 -11.316   2.492
  490   1HB   ALA  63          1HB       ALA  63 -17.973  -9.477   4.156
  491   2HB   ALA  63          2HB       ALA  63 -16.311 -10.013   3.908
  492   3HB   ALA  63          3HB       ALA  63 -16.876  -8.517   3.164
  493    H    LEU  64           H        LEU  64 -17.702  -8.250   0.707
  494    HA   LEU  64           HA       LEU  64 -20.555  -7.780   0.919
  495   1HB   LEU  64          1HB       LEU  64 -18.378  -6.617  -0.834
  496   2HB   LEU  64          2HB       LEU  64 -20.050  -6.082  -0.939
  497    HG   LEU  64           HG       LEU  64 -18.566  -6.113   1.698
  498   1HD1  LEU  64          1HD1      LEU  64 -18.644  -3.914  -0.388
  499   2HD1  LEU  64          2HD1      LEU  64 -18.128  -3.674   1.281
  500   3HD1  LEU  64          3HD1      LEU  64 -17.213  -4.746   0.220
  501   1HD2  LEU  64          1HD2      LEU  64 -21.044  -4.734   0.620
  502   2HD2  LEU  64          2HD2      LEU  64 -20.909  -5.796   2.022
  503   3HD2  LEU  64          3HD2      LEU  64 -20.231  -4.174   2.078
  504    HA   PRO  65           HA       PRO  65 -21.944 -10.518  -2.306
  505   1HB   PRO  65          1HB       PRO  65 -23.685  -8.638  -3.617
  506   2HB   PRO  65          2HB       PRO  65 -24.125  -9.870  -2.429
  507   1HG   PRO  65          1HG       PRO  65 -23.874  -6.970  -2.064
  508   2HG   PRO  65          2HG       PRO  65 -24.626  -8.164  -0.999
  509   1HD   PRO  65          1HD       PRO  65 -22.189  -6.838  -0.506
  510   2HD   PRO  65          2HD       PRO  65 -22.749  -8.307   0.325

  No H/Q in entry =         510
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1  27.168 -10.301 -10.685
    2    H2   MET   1           H2       MET   1  28.291 -11.186  -9.772
    3    H3   MET   1           H3       MET   1  26.665 -11.677  -9.823
    4    HA   MET   1           HA       MET   1  27.153 -10.583  -7.727
    5   1HB   MET   1          1HB       MET   1  28.974  -9.145  -8.780
    6   2HB   MET   1          2HB       MET   1  27.682  -8.119  -9.402
    7   1HG   MET   1          1HG       MET   1  28.401  -7.154  -7.318
    8   2HG   MET   1          2HG       MET   1  26.835  -7.910  -7.027
    9   1HE   MET   1          1HE       MET   1  27.625  -7.481  -4.564
   10   2HE   MET   1          2HE       MET   1  26.566  -8.874  -4.764
   11   3HE   MET   1          3HE       MET   1  27.956  -8.981  -3.685
   12    H    LYS   2           H        LYS   2  25.300  -9.769  -6.742
   13    HA   LYS   2           HA       LYS   2  23.022  -9.124  -8.546
   14   1HB   LYS   2          1HB       LYS   2  23.082  -9.594  -5.545
   15   2HB   LYS   2          2HB       LYS   2  21.636  -9.448  -6.539
   16   1HG   LYS   2          1HG       LYS   2  23.755 -11.576  -6.964
   17   2HG   LYS   2          2HG       LYS   2  22.301 -11.828  -5.999
   18   1HD   LYS   2          1HD       LYS   2  21.000 -11.055  -8.101
   19   2HD   LYS   2          2HD       LYS   2  22.511 -11.317  -8.970
   20   1HE   LYS   2          1HE       LYS   2  21.127 -13.410  -7.270
   21   2HE   LYS   2          2HE       LYS   2  21.030 -13.316  -9.029
   22   1HZ   LYS   2          1HZ       LYS   2  23.473 -13.481  -9.089
   23   2HZ   LYS   2          2HZ       LYS   2  23.483 -13.719  -7.407
   24   3HZ   LYS   2          3HZ       LYS   2  22.737 -14.858  -8.420
   25    H    ALA   3           H        ALA   3  22.703  -7.000  -8.979
   26    HA   ALA   3           HA       ALA   3  22.499  -5.024  -6.876
   27   1HB   ALA   3          1HB       ALA   3  25.039  -5.364  -7.241
   28   2HB   ALA   3          2HB       ALA   3  24.430  -3.708  -7.284
   29   3HB   ALA   3          3HB       ALA   3  24.793  -4.555  -8.788
   30    H    ILE   4           H        ILE   4  20.724  -3.982  -7.700
   31    HA   ILE   4           HA       ILE   4  20.894  -2.554 -10.219
   32    HB   ILE   4           HB       ILE   4  20.438  -4.915 -10.972
   33   1HG1  ILE   4          1HG1      ILE   4  18.133  -3.014 -11.486
   34   2HG1  ILE   4          2HG1      ILE   4  19.715  -2.867 -12.254
   35   1HG2  ILE   4          1HG2      ILE   4  18.983  -5.395  -8.926
   36   2HG2  ILE   4          2HG2      ILE   4  17.707  -4.497  -9.747
   37   3HG2  ILE   4          3HG2      ILE   4  18.359  -5.966 -10.472
   38   1HD1  ILE   4          1HD1      ILE   4  19.473  -5.165 -13.157
   39   2HD1  ILE   4          2HD1      ILE   4  17.867  -5.265 -12.433
   40   3HD1  ILE   4          3HD1      ILE   4  18.183  -4.103 -13.721
   41    H    PHE   5           H        PHE   5  18.939  -3.748  -7.531
   42    HA   PHE   5           HA       PHE   5  16.734  -1.947  -7.935
   43   1HB   PHE   5          1HB       PHE   5  16.948  -4.047  -6.361
   44   2HB   PHE   5          2HB       PHE   5  17.592  -2.892  -5.195
   45    HD1  PHE   5           HD1      PHE   5  14.633  -3.868  -7.172
   46    HD2  PHE   5           HD2      PHE   5  16.188  -1.160  -4.229
   47    HE1  PHE   5           HE1      PHE   5  12.328  -3.117  -6.648
   48    HE2  PHE   5           HE2      PHE   5  13.884  -0.407  -3.711
   49    HZ   PHE   5           HZ       PHE   5  11.956  -1.383  -4.915
   50    H    VAL   6           H        VAL   6  16.470   0.179  -7.214
   51    HA   VAL   6           HA       VAL   6  18.795   1.782  -6.838
   52    HB   VAL   6           HB       VAL   6  15.914   2.392  -6.120
   53   1HG1  VAL   6          1HG1      VAL   6  18.393   4.103  -6.357
   54   2HG1  VAL   6          2HG1      VAL   6  16.777   4.784  -6.529
   55   3HG1  VAL   6          3HG1      VAL   6  17.252   4.011  -5.016
   56   1HG2  VAL   6          1HG2      VAL   6  16.347   1.750  -8.507
   57   2HG2  VAL   6          2HG2      VAL   6  15.801   3.418  -8.323
   58   3HG2  VAL   6          3HG2      VAL   6  17.506   3.076  -8.610
   59    H    LEU   7           H        LEU   7  16.373   0.654  -4.465
   60    HA   LEU   7           HA       LEU   7  17.903   1.800  -2.242
   61   1HB   LEU   7          1HB       LEU   7  15.571  -0.139  -2.138
   62   2HB   LEU   7          2HB       LEU   7  16.177   0.854  -0.816
   63    HG   LEU   7           HG       LEU   7  14.961   1.895  -3.393
   64   1HD1  LEU   7          1HD1      LEU   7  13.941   1.706  -0.548
   65   2HD1  LEU   7          2HD1      LEU   7  13.208   2.756  -1.760
   66   3HD1  LEU   7          3HD1      LEU   7  13.219   1.011  -1.998
   67   1HD2  LEU   7          1HD2      LEU   7  16.314   3.229  -1.050
   68   2HD2  LEU   7          2HD2      LEU   7  16.474   3.574  -2.773
   69   3HD2  LEU   7          3HD2      LEU   7  15.023   4.074  -1.907
   70    H    ASN   8           H        ASN   8  18.721   0.388  -0.462
   71    HA   ASN   8           HA       ASN   8  20.518  -1.589  -1.393
   72   1HB   ASN   8          1HB       ASN   8  20.782  -2.214   0.980
   73   2HB   ASN   8          2HB       ASN   8  20.744  -0.460   0.796
   74   2HD2  ASN   8          2HD2      ASN   8  19.260   0.619   2.108
   75   1HD2  ASN   8          1HD2      ASN   8  17.923  -0.108   2.860
   76    H    ALA   9           H        ALA   9  20.411  -3.859  -1.427
   77    HA   ALA   9           HA       ALA   9  17.834  -5.013  -1.980
   78   1HB   ALA   9          1HB       ALA   9  20.172  -5.748  -2.821
   79   2HB   ALA   9          2HB       ALA   9  20.300  -6.612  -1.288
   80   3HB   ALA   9          3HB       ALA   9  19.009  -7.013  -2.423
   81    H    GLN  10           H        GLN  10  19.635  -4.576   0.943
   82    HA   GLN  10           HA       GLN  10  18.648  -6.758   2.474
   83   1HB   GLN  10          1HB       GLN  10  20.454  -5.239   3.234
   84   2HB   GLN  10          2HB       GLN  10  19.275  -3.940   3.410
   85   1HG   GLN  10          1HG       GLN  10  18.040  -5.280   5.075
   86   2HG   GLN  10          2HG       GLN  10  19.215  -6.584   4.897
   87   2HE2  GLN  10          2HE2      GLN  10  18.735  -3.319   6.180
   88   1HE2  GLN  10          1HE2      GLN  10  20.170  -3.275   7.088
   89    H    HIS  11           H        HIS  11  16.648  -7.182   3.270
   90    HA   HIS  11           HA       HIS  11  14.539  -5.056   3.048
   91   1HB   HIS  11          1HB       HIS  11  14.342  -8.084   3.030
   92   2HB   HIS  11          2HB       HIS  11  12.952  -6.996   3.036
   93    HD1  HIS  11           HD1      HIS  11  15.780  -8.185   0.870
   94    HD2  HIS  11           HD2      HIS  11  12.493  -5.637   0.576
   95    HE1  HIS  11           HE1      HIS  11  15.529  -7.621  -1.586
   96    H    ASP  12           H        ASP  12  14.152  -4.157   5.025
   97    HA   ASP  12           HA       ASP  12  13.335  -5.798   7.253
   98   1HB   ASP  12          1HB       ASP  12  15.833  -6.077   7.350
   99   2HB   ASP  12          2HB       ASP  12  15.968  -4.336   7.605
  100    H    GLU  13           H        GLU  13  14.935  -3.222   8.601
  101    HA   GLU  13           HA       GLU  13  12.566  -1.771   9.221
  102   1HB   GLU  13          1HB       GLU  13  15.483  -0.951   9.273
  103   2HB   GLU  13          2HB       GLU  13  14.180   0.060   9.899
  104   1HG   GLU  13          1HG       GLU  13  13.509  -1.739  11.441
  105   2HG   GLU  13          2HG       GLU  13  14.801  -2.763  10.816
  106    H    ALA  14           H        ALA  14  14.989  -1.319   6.672
  107    HA   ALA  14           HA       ALA  14  14.039   1.167   5.673
  108   1HB   ALA  14          1HB       ALA  14  15.294  -1.145   4.159
  109   2HB   ALA  14          2HB       ALA  14  16.166   0.178   4.935
  110   3HB   ALA  14          3HB       ALA  14  15.127   0.501   3.546
  111    H    VAL  15           H        VAL  15  12.425   1.678   4.219
  112    HA   VAL  15           HA       VAL  15  10.652  -0.539   3.246
  113    HB   VAL  15           HB       VAL  15   8.710   0.906   3.713
  114   1HG1  VAL  15          1HG1      VAL  15   9.715  -0.686   5.454
  115   2HG1  VAL  15          2HG1      VAL  15  10.408   0.748   6.212
  116   3HG1  VAL  15          3HG1      VAL  15   8.658   0.581   6.076
  117   1HG2  VAL  15          1HG2      VAL  15  10.839   2.763   4.822
  118   2HG2  VAL  15          2HG2      VAL  15   9.717   3.097   3.502
  119   3HG2  VAL  15          3HG2      VAL  15   9.116   2.948   5.153
  120    H    ASP  16           H        ASP  16   9.399   0.093   1.319
  121    HA   ASP  16           HA       ASP  16  10.970   1.323  -0.689
  122   1HB   ASP  16          1HB       ASP  16   7.987   0.839  -0.507
  123   2HB   ASP  16          2HB       ASP  16   8.768   1.463  -1.960
  124    H    ALA  17           H        ALA  17   8.084   2.913  -1.110
  125    HA   ALA  17           HA       ALA  17   8.438   5.228   0.559
  126   1HB   ALA  17          1HB       ALA  17  10.442   5.636  -0.733
  127   2HB   ALA  17          2HB       ALA  17   9.577   5.368  -2.245
  128   3HB   ALA  17          3HB       ALA  17   9.217   6.787  -1.261
  129    H    ASN  18           H        ASN  18   7.865   5.974  -2.742
  130    HA   ASN  18           HA       ASN  18   5.140   6.755  -2.222
  131   1HB   ASN  18          1HB       ASN  18   6.658   7.805  -3.937
  132   2HB   ASN  18          2HB       ASN  18   6.461   6.353  -4.919
  133   2HD2  ASN  18          2HD2      ASN  18   4.467   8.864  -3.266
  134   1HD2  ASN  18          1HD2      ASN  18   3.225   8.848  -4.422
  135    H    SER  19           H        SER  19   6.601   3.791  -3.323
  136    HA   SER  19           HA       SER  19   4.422   2.693  -4.778
  137   1HB   SER  19          1HB       SER  19   6.539   1.370  -3.071
  138   2HB   SER  19          2HB       SER  19   5.393   0.469  -4.059
  139    HG   SER  19           HG       SER  19   6.881   0.790  -5.531
  140    H    LEU  20           H        LEU  20   5.087   2.651  -1.258
  141    HA   LEU  20           HA       LEU  20   2.769   1.024  -0.650
  142   1HB   LEU  20          1HB       LEU  20   4.316   2.967   1.098
  143   2HB   LEU  20          2HB       LEU  20   3.100   1.835   1.684
  144    HG   LEU  20           HG       LEU  20   5.647   1.053   0.238
  145   1HD1  LEU  20          1HD1      LEU  20   5.958   2.015   2.542
  146   2HD1  LEU  20          2HD1      LEU  20   4.921   0.730   3.165
  147   3HD1  LEU  20          3HD1      LEU  20   6.461   0.330   2.403
  148   1HD2  LEU  20          1HD2      LEU  20   3.278  -0.476   1.309
  149   2HD2  LEU  20          2HD2      LEU  20   4.196  -0.727  -0.178
  150   3HD2  LEU  20          3HD2      LEU  20   4.875  -1.227   1.366
  151    H    ALA  21           H        ALA  21   3.378   4.519  -0.757
  152    HA   ALA  21           HA       ALA  21   0.774   5.245   0.194
  153   1HB   ALA  21          1HB       ALA  21   2.731   6.820  -1.500
  154   2HB   ALA  21          2HB       ALA  21   2.659   6.821   0.263
  155   3HB   ALA  21          3HB       ALA  21   1.326   7.496  -0.675
  156    H    GLU  22           H        GLU  22   2.149   5.004  -3.100
  157    HA   GLU  22           HA       GLU  22  -0.221   5.825  -4.445
  158   1HB   GLU  22          1HB       GLU  22   2.060   5.527  -5.500
  159   2HB   GLU  22          2HB       GLU  22   1.778   3.786  -5.462
  160   1HG   GLU  22          1HG       GLU  22   1.136   4.597  -7.651
  161   2HG   GLU  22          2HG       GLU  22  -0.330   4.168  -6.772
  162    H    ALA  23           H        ALA  23   0.891   2.549  -3.541
  163    HA   ALA  23           HA       ALA  23  -1.354   1.154  -4.607
  164   1HB   ALA  23          1HB       ALA  23   0.306   0.467  -2.158
  165   2HB   ALA  23          2HB       ALA  23   0.695   0.012  -3.816
  166   3HB   ALA  23          3HB       ALA  23  -0.743  -0.647  -3.035
  167    H    LYS  24           H        LYS  24  -0.776   2.440  -1.323
  168    HA   LYS  24           HA       LYS  24  -3.399   1.717  -0.358
  169   1HB   LYS  24          1HB       LYS  24  -1.325   3.692   0.629
  170   2HB   LYS  24          2HB       LYS  24  -2.823   3.350   1.496
  171   1HG   LYS  24          1HG       LYS  24  -2.180   0.906   1.467
  172   2HG   LYS  24          2HG       LYS  24  -0.613   1.384   0.826
  173   1HD   LYS  24          1HD       LYS  24  -1.760   2.483   3.409
  174   2HD   LYS  24          2HD       LYS  24  -0.691   1.083   3.346
  175   1HE   LYS  24          1HE       LYS  24   0.792   2.857   3.753
  176   2HE   LYS  24          2HE       LYS  24   0.910   2.655   2.009
  177   1HZ   LYS  24          1HZ       LYS  24  -1.191   4.353   2.334
  178   2HZ   LYS  24          2HZ       LYS  24  -0.095   4.864   3.528
  179   3HZ   LYS  24          3HZ       LYS  24   0.386   4.800   1.900
  180    H    VAL  25           H        VAL  25  -2.023   4.702  -1.740
  181    HA   VAL  25           HA       VAL  25  -4.346   6.318  -1.305
  182    HB   VAL  25           HB       VAL  25  -2.089   6.534  -3.298
  183   1HG1  VAL  25          1HG1      VAL  25  -4.473   8.336  -2.840
  184   2HG1  VAL  25          2HG1      VAL  25  -2.969   8.937  -3.537
  185   3HG1  VAL  25          3HG1      VAL  25  -3.885   7.680  -4.367
  186   1HG2  VAL  25          1HG2      VAL  25  -1.854   6.896  -0.702
  187   2HG2  VAL  25          2HG2      VAL  25  -1.156   8.085  -1.800
  188   3HG2  VAL  25          3HG2      VAL  25  -2.701   8.410  -1.016
  189    H    LEU  26           H        LEU  26  -3.293   4.510  -4.222
  190    HA   LEU  26           HA       LEU  26  -5.619   5.181  -5.756
  191   1HB   LEU  26          1HB       LEU  26  -3.759   2.794  -5.934
  192   2HB   LEU  26          2HB       LEU  26  -5.002   3.161  -7.125
  193    HG   LEU  26           HG       LEU  26  -2.687   4.974  -6.378
  194   1HD1  LEU  26          1HD1      LEU  26  -2.077   2.914  -7.656
  195   2HD1  LEU  26          2HD1      LEU  26  -3.219   3.391  -8.911
  196   3HD1  LEU  26          3HD1      LEU  26  -1.806   4.393  -8.581
  197   1HD2  LEU  26          1HD2      LEU  26  -5.113   5.313  -8.126
  198   2HD2  LEU  26          2HD2      LEU  26  -4.276   6.501  -7.126
  199   3HD2  LEU  26          3HD2      LEU  26  -3.594   6.020  -8.677
  200    H    ALA  27           H        ALA  27  -4.924   2.443  -3.593
  201    HA   ALA  27           HA       ALA  27  -7.355   1.025  -4.179
  202   1HB   ALA  27          1HB       ALA  27  -5.373   0.011  -3.044
  203   2HB   ALA  27          2HB       ALA  27  -5.730   0.984  -1.616
  204   3HB   ALA  27          3HB       ALA  27  -6.873  -0.248  -2.153
  205    H    ASN  28           H        ASN  28  -6.499   3.442  -1.725
  206    HA   ASN  28           HA       ASN  28  -8.923   3.355  -0.243
  207   1HB   ASN  28          1HB       ASN  28  -6.903   4.561   0.513
  208   2HB   ASN  28          2HB       ASN  28  -7.114   5.727  -0.792
  209   2HD2  ASN  28          2HD2      ASN  28  -7.274   6.089   2.234
  210   1HD2  ASN  28          1HD2      ASN  28  -8.789   6.811   2.496
  211    H    ARG  29           H        ARG  29  -8.043   5.187  -3.158
  212    HA   ARG  29           HA       ARG  29 -10.396   6.777  -3.328
  213   1HB   ARG  29          1HB       ARG  29  -8.548   5.713  -5.474
  214   2HB   ARG  29          2HB       ARG  29  -9.856   6.851  -5.802
  215   1HG   ARG  29          1HG       ARG  29  -8.890   8.429  -4.178
  216   2HG   ARG  29          2HG       ARG  29  -7.575   7.304  -3.854
  217   1HD   ARG  29          1HD       ARG  29  -7.019   7.389  -6.314
  218   2HD   ARG  29          2HD       ARG  29  -8.189   8.693  -6.483
  219    HE   ARG  29           HE       ARG  29  -5.484   8.924  -5.539
  220   1HH1  ARG  29          1HH1      ARG  29  -4.757  10.631  -4.291
  221   2HH1  ARG  29          2HH1      ARG  29  -5.900  11.697  -3.546
  222   1HH2  ARG  29          1HH2      ARG  29  -8.669  10.051  -4.811
  223   2HH2  ARG  29          2HH2      ARG  29  -8.108  11.366  -3.834
  224    H    GLU  30           H        GLU  30  -9.730   3.493  -4.494
  225    HA   GLU  30           HA       GLU  30 -12.118   3.127  -5.996
  226   1HB   GLU  30          1HB       GLU  30 -10.199   1.557  -6.050
  227   2HB   GLU  30          2HB       GLU  30 -10.558   1.073  -4.394
  228   1HG   GLU  30          1HG       GLU  30 -12.781   0.269  -5.105
  229   2HG   GLU  30          2HG       GLU  30 -12.428   0.756  -6.763
  230    H    LEU  31           H        LEU  31 -11.454   2.685  -2.536
  231    HA   LEU  31           HA       LEU  31 -13.951   1.514  -1.807
  232   1HB   LEU  31          1HB       LEU  31 -12.458   3.513  -0.088
  233   2HB   LEU  31          2HB       LEU  31 -13.425   2.133   0.431
  234    HG   LEU  31           HG       LEU  31 -10.781   2.050  -1.012
  235   1HD1  LEU  31          1HD1      LEU  31 -10.841   2.552   1.476
  236   2HD1  LEU  31          2HD1      LEU  31 -11.542   0.949   1.700
  237   3HD1  LEU  31          3HD1      LEU  31  -9.926   1.117   1.018
  238   1HD2  LEU  31          1HD2      LEU  31 -12.785  -0.110  -0.324
  239   2HD2  LEU  31          2HD2      LEU  31 -12.010   0.206  -1.876
  240   3HD2  LEU  31          3HD2      LEU  31 -11.075  -0.480  -0.548
  241    H    ASP  32           H        ASP  32 -12.920   4.858  -2.191
  242    HA   ASP  32           HA       ASP  32 -15.200   6.185  -1.203
  243   1HB   ASP  32          1HB       ASP  32 -12.991   7.179  -1.987
  244   2HB   ASP  32          2HB       ASP  32 -13.608   7.030  -3.632
  245    H    LYS  33           H        LYS  33 -14.591   4.716  -4.377
  246    HA   LYS  33           HA       LYS  33 -16.931   5.665  -5.703
  247   1HB   LYS  33          1HB       LYS  33 -15.024   4.448  -6.790
  248   2HB   LYS  33          2HB       LYS  33 -15.574   2.964  -6.015
  249   1HG   LYS  33          1HG       LYS  33 -17.833   3.375  -7.157
  250   2HG   LYS  33          2HG       LYS  33 -17.014   4.609  -8.108
  251   1HD   LYS  33          1HD       LYS  33 -16.044   1.742  -7.935
  252   2HD   LYS  33          2HD       LYS  33 -17.143   2.309  -9.187
  253   1HE   LYS  33          1HE       LYS  33 -14.995   2.471 -10.164
  254   2HE   LYS  33          2HE       LYS  33 -15.376   4.121  -9.677
  255   1HZ   LYS  33          1HZ       LYS  33 -14.081   2.525  -7.646
  256   2HZ   LYS  33          2HZ       LYS  33 -13.126   2.819  -9.020
  257   3HZ   LYS  33          3HZ       LYS  33 -13.770   4.119  -8.136
  258    H    TYR  34           H        TYR  34 -16.358   2.648  -3.881
  259    HA   TYR  34           HA       TYR  34 -19.121   1.811  -4.006
  260   1HB   TYR  34          1HB       TYR  34 -16.813   0.953  -2.238
  261   2HB   TYR  34          2HB       TYR  34 -18.394   0.165  -2.245
  262    HD1  TYR  34           HD1      TYR  34 -15.175   0.129  -3.706
  263    HD2  TYR  34           HD2      TYR  34 -19.324  -0.433  -4.669
  264    HE1  TYR  34           HE1      TYR  34 -14.534  -1.154  -5.730
  265    HE2  TYR  34           HE2      TYR  34 -18.681  -1.719  -6.688
  266    HH   TYR  34           HH       TYR  34 -16.692  -1.874  -8.210
  267    H    GLY  35           H        GLY  35 -17.182   3.618  -1.660
  268   1HA   GLY  35          1HA       GLY  35 -19.644   4.673  -0.459
  269   2HA   GLY  35          2HA       GLY  35 -18.000   5.161  -0.052
  270    H    VAL  36           H        VAL  36 -16.996   2.505   0.497
  271    HA   VAL  36           HA       VAL  36 -18.649   1.135   2.398
  272    HB   VAL  36           HB       VAL  36 -16.692  -0.128   2.939
  273   1HG1  VAL  36          1HG1      VAL  36 -17.628  -0.285   0.581
  274   2HG1  VAL  36          2HG1      VAL  36 -16.297   0.755   0.073
  275   3HG1  VAL  36          3HG1      VAL  36 -15.960  -0.831   0.767
  276   1HG2  VAL  36          1HG2      VAL  36 -15.224   2.298   1.901
  277   2HG2  VAL  36          2HG2      VAL  36 -15.051   1.495   3.460
  278   3HG2  VAL  36          3HG2      VAL  36 -14.428   0.726   2.002
  279    H    SER  37           H        SER  37 -17.360   0.880   4.753
  280    HA   SER  37           HA       SER  37 -17.959   3.362   6.099
  281   1HB   SER  37          1HB       SER  37 -17.308   2.216   8.117
  282   2HB   SER  37          2HB       SER  37 -18.160   1.053   7.105
  283    HG   SER  37           HG       SER  37 -15.489   1.172   6.573
  284    H    ASP  38           H        ASP  38 -16.391   4.596   7.418
  285    HA   ASP  38           HA       ASP  38 -13.899   5.064   5.910
  286   1HB   ASP  38          1HB       ASP  38 -13.637   6.996   7.424
  287   2HB   ASP  38          2HB       ASP  38 -15.251   6.979   6.713
  288    H    TYR  39           H        TYR  39 -14.713   2.845   8.136
  289    HA   TYR  39           HA       TYR  39 -12.416   3.116   9.946
  290   1HB   TYR  39          1HB       TYR  39 -14.416   2.132  10.866
  291   2HB   TYR  39          2HB       TYR  39 -14.513   0.964   9.549
  292    HD1  TYR  39           HD1      TYR  39 -12.764   1.876  12.665
  293    HD2  TYR  39           HD2      TYR  39 -13.007  -0.937   9.430
  294    HE1  TYR  39           HE1      TYR  39 -11.331   0.294  13.930
  295    HE2  TYR  39           HE2      TYR  39 -11.580  -2.515  10.689
  296    HH   TYR  39           HH       TYR  39 -10.585  -2.941  12.641
  297    H    TYR  40           H        TYR  40 -13.372   1.020   7.233
  298    HA   TYR  40           HA       TYR  40 -11.036  -0.645   7.291
  299   1HB   TYR  40          1HB       TYR  40 -12.901   0.029   4.995
  300   2HB   TYR  40          2HB       TYR  40 -11.717  -1.277   4.986
  301    HD1  TYR  40           HD1      TYR  40 -11.831  -2.838   7.187
  302    HD2  TYR  40           HD2      TYR  40 -15.094  -0.541   5.585
  303    HE1  TYR  40           HE1      TYR  40 -13.447  -4.323   8.342
  304    HE2  TYR  40           HE2      TYR  40 -16.705  -2.028   6.740
  305    HH   TYR  40           HH       TYR  40 -15.618  -4.532   8.979
  306    H    LYS  41           H        LYS  41 -11.750   2.374   5.510
  307    HA   LYS  41           HA       LYS  41  -9.431   2.317   3.867
  308   1HB   LYS  41          1HB       LYS  41  -9.837   4.629   3.440
  309   2HB   LYS  41          2HB       LYS  41 -11.429   3.919   3.702
  310   1HG   LYS  41          1HG       LYS  41 -11.216   4.630   6.129
  311   2HG   LYS  41          2HG       LYS  41  -9.802   5.561   5.657
  312   1HD   LYS  41          1HD       LYS  41 -12.465   5.902   4.262
  313   2HD   LYS  41          2HD       LYS  41 -12.052   6.811   5.712
  314   1HE   LYS  41          1HE       LYS  41 -10.511   6.814   3.101
  315   2HE   LYS  41          2HE       LYS  41 -11.487   8.132   3.742
  316   1HZ   LYS  41          1HZ       LYS  41  -9.951   7.899   5.779
  317   2HZ   LYS  41          2HZ       LYS  41  -8.901   7.109   4.702
  318   3HZ   LYS  41          3HZ       LYS  41  -9.377   8.709   4.401
  319    H    ASN  42           H        ASN  42  -9.976   3.384   7.174
  320    HA   ASN  42           HA       ASN  42  -7.385   4.554   7.540
  321   1HB   ASN  42          1HB       ASN  42  -9.399   4.915   9.037
  322   2HB   ASN  42          2HB       ASN  42  -9.117   3.299   9.682
  323   2HD2  ASN  42          2HD2      ASN  42  -8.795   4.720  11.755
  324   1HD2  ASN  42          1HD2      ASN  42  -7.220   5.285  12.045
  325    H    LEU  43           H        LEU  43  -8.673   1.298   7.893
  326    HA   LEU  43           HA       LEU  43  -6.493   0.110   9.275
  327   1HB   LEU  43          1HB       LEU  43  -8.657  -1.024   8.906
  328   2HB   LEU  43          2HB       LEU  43  -8.323  -1.105   7.178
  329    HG   LEU  43           HG       LEU  43  -6.338  -2.502   7.626
  330   1HD1  LEU  43          1HD1      LEU  43  -7.130  -1.959  10.479
  331   2HD1  LEU  43          2HD1      LEU  43  -6.330  -3.479  10.079
  332   3HD1  LEU  43          3HD1      LEU  43  -5.527  -1.947   9.745
  333   1HD2  LEU  43          1HD2      LEU  43  -8.690  -3.441   7.324
  334   2HD2  LEU  43          2HD2      LEU  43  -7.535  -4.511   8.120
  335   3HD2  LEU  43          3HD2      LEU  43  -8.736  -3.642   9.076
  336    H    ILE  44           H        ILE  44  -7.046   0.617   5.798
  337    HA   ILE  44           HA       ILE  44  -4.670  -0.729   4.914
  338    HB   ILE  44           HB       ILE  44  -6.363   1.456   3.678
  339   1HG1  ILE  44          1HG1      ILE  44  -6.087  -1.436   2.836
  340   2HG1  ILE  44          2HG1      ILE  44  -7.230  -0.958   4.093
  341   1HG2  ILE  44          1HG2      ILE  44  -3.977  -0.050   2.591
  342   2HG2  ILE  44          2HG2      ILE  44  -5.180   0.686   1.533
  343   3HG2  ILE  44          3HG2      ILE  44  -4.234   1.694   2.629
  344   1HD1  ILE  44          1HD1      ILE  44  -8.208   0.691   2.487
  345   2HD1  ILE  44          2HD1      ILE  44  -7.151   0.040   1.235
  346   3HD1  ILE  44          3HD1      ILE  44  -8.385  -0.984   1.967
  347    H    ASN  45           H        ASN  45  -5.332   2.646   5.801
  348    HA   ASN  45           HA       ASN  45  -2.899   3.813   4.998
  349   1HB   ASN  45          1HB       ASN  45  -4.655   4.386   7.400
  350   2HB   ASN  45          2HB       ASN  45  -3.297   5.407   6.926
  351   2HD2  ASN  45          2HD2      ASN  45  -6.038   6.339   6.896
  352   1HD2  ASN  45          1HD2      ASN  45  -6.460   6.650   5.281
  353    H    ASN  46           H        ASN  46  -3.610   1.751   7.755
  354    HA   ASN  46           HA       ASN  46  -0.805   2.079   8.752
  355   1HB   ASN  46          1HB       ASN  46  -1.602   1.073  10.822
  356   2HB   ASN  46          2HB       ASN  46  -2.666   2.407  10.381
  357   2HD2  ASN  46          2HD2      ASN  46  -4.677   1.680  11.177
  358   1HD2  ASN  46          1HD2      ASN  46  -5.401   0.212  10.727
  359    H    ALA  47           H        ALA  47  -1.904   0.374   6.404
  360    HA   ALA  47           HA       ALA  47  -1.774  -2.373   7.070
  361   1HB   ALA  47          1HB       ALA  47  -2.410  -1.392   4.822
  362   2HB   ALA  47          2HB       ALA  47  -1.326  -2.781   4.737
  363   3HB   ALA  47          3HB       ALA  47  -0.690  -1.149   4.518
  364    H    LYS  48           H        LYS  48  -0.087  -3.770   7.446
  365    HA   LYS  48           HA       LYS  48   2.463  -2.679   8.229
  366   1HB   LYS  48          1HB       LYS  48   1.156  -4.924   8.893
  367   2HB   LYS  48          2HB       LYS  48   2.147  -5.607   7.608
  368   1HG   LYS  48          1HG       LYS  48   3.186  -4.079  10.019
  369   2HG   LYS  48          2HG       LYS  48   3.252  -5.828   9.805
  370   1HD   LYS  48          1HD       LYS  48   4.523  -5.315   7.610
  371   2HD   LYS  48          2HD       LYS  48   4.729  -3.693   8.269
  372   1HE   LYS  48          1HE       LYS  48   5.591  -6.258   9.634
  373   2HE   LYS  48          2HE       LYS  48   6.663  -5.118   8.821
  374   1HZ   LYS  48          1HZ       LYS  48   5.426  -3.459  10.441
  375   2HZ   LYS  48          2HZ       LYS  48   5.273  -4.871  11.374
  376   3HZ   LYS  48          3HZ       LYS  48   6.812  -4.315  10.916
  377    H    THR  49           H        THR  49   1.343  -4.472   5.354
  378    HA   THR  49           HA       THR  49   3.646  -3.369   3.855
  379    HB   THR  49           HB       THR  49   3.121  -6.331   3.616
  380    HG1  THR  49           HG1      THR  49   3.938  -6.655   5.499
  381   1HG2  THR  49          1HG2      THR  49   4.579  -5.001   2.012
  382   2HG2  THR  49          2HG2      THR  49   5.680  -4.739   3.364
  383   3HG2  THR  49          3HG2      THR  49   5.368  -6.375   2.784
  384    H    VAL  50           H        VAL  50   3.350  -3.611   1.506
  385    HA   VAL  50           HA       VAL  50   0.631  -3.161   0.707
  386    HB   VAL  50           HB       VAL  50   2.410  -2.152  -0.554
  387   1HG1  VAL  50          1HG1      VAL  50   4.100  -3.939  -0.105
  388   2HG1  VAL  50          2HG1      VAL  50   3.283  -4.963  -1.284
  389   3HG1  VAL  50          3HG1      VAL  50   4.051  -3.462  -1.801
  390   1HG2  VAL  50          1HG2      VAL  50   0.301  -2.974  -1.744
  391   2HG2  VAL  50          2HG2      VAL  50   1.695  -2.661  -2.775
  392   3HG2  VAL  50          3HG2      VAL  50   1.280  -4.318  -2.334
  393    H    GLU  51           H        GLU  51   2.579  -6.046   0.920
  394    HA   GLU  51           HA       GLU  51   1.157  -7.693  -0.919
  395   1HB   GLU  51          1HB       GLU  51   2.565  -8.361   1.684
  396   2HB   GLU  51          2HB       GLU  51   1.921  -9.584   0.586
  397   1HG   GLU  51          1HG       GLU  51   3.333  -8.700  -1.233
  398   2HG   GLU  51          2HG       GLU  51   3.980  -7.478  -0.138
  399    H    GLY  52           H        GLY  52   0.544  -6.789   2.433
  400   1HA   GLY  52          1HA       GLY  52  -1.289  -7.288   3.834
  401   2HA   GLY  52          2HA       GLY  52  -1.816  -8.492   2.657
  402    H    VAL  53           H        VAL  53  -1.124  -5.158   1.719
  403    HA   VAL  53           HA       VAL  53  -3.737  -4.072   2.043
  404    HB   VAL  53           HB       VAL  53  -1.560  -3.452   0.032
  405   1HG1  VAL  53          1HG1      VAL  53  -4.224  -2.126   0.532
  406   2HG1  VAL  53          2HG1      VAL  53  -2.863  -1.236  -0.151
  407   3HG1  VAL  53          3HG1      VAL  53  -3.523  -2.630  -1.006
  408   1HG2  VAL  53          1HG2      VAL  53  -2.484  -2.068   2.572
  409   2HG2  VAL  53          2HG2      VAL  53  -1.004  -3.012   2.395
  410   3HG2  VAL  53          3HG2      VAL  53  -1.195  -1.497   1.512
  411    H    LYS  54           H        LYS  54  -2.271  -5.673  -0.804
  412    HA   LYS  54           HA       LYS  54  -4.553  -5.471  -2.486
  413   1HB   LYS  54          1HB       LYS  54  -2.317  -7.510  -2.381
  414   2HB   LYS  54          2HB       LYS  54  -3.530  -7.470  -3.662
  415   1HG   LYS  54          1HG       LYS  54  -2.892  -5.146  -4.197
  416   2HG   LYS  54          2HG       LYS  54  -1.676  -5.186  -2.919
  417   1HD   LYS  54          1HD       LYS  54  -0.526  -7.044  -4.068
  418   2HD   LYS  54          2HD       LYS  54  -1.739  -6.999  -5.348
  419   1HE   LYS  54          1HE       LYS  54  -1.093  -4.726  -5.943
  420   2HE   LYS  54          2HE       LYS  54   0.040  -4.665  -4.593
  421   1HZ   LYS  54          1HZ       LYS  54   0.305  -6.844  -6.531
  422   2HZ   LYS  54          2HZ       LYS  54   0.827  -5.295  -6.993
  423   3HZ   LYS  54          3HZ       LYS  54   1.500  -6.050  -5.628
  424    H    ALA  55           H        ALA  55  -3.643  -7.966  -0.115
  425    HA   ALA  55           HA       ALA  55  -5.905  -9.671  -0.756
  426   1HB   ALA  55          1HB       ALA  55  -5.235 -10.953   1.204
  427   2HB   ALA  55          2HB       ALA  55  -4.206  -9.631   1.753
  428   3HB   ALA  55          3HB       ALA  55  -3.798 -10.513   0.282
  429    H    LEU  56           H        LEU  56  -5.413  -6.948   1.380
  430    HA   LEU  56           HA       LEU  56  -7.636  -7.486   3.127
  431   1HB   LEU  56          1HB       LEU  56  -5.865  -5.893   3.760
  432   2HB   LEU  56          2HB       LEU  56  -6.309  -4.846   2.413
  433    HG   LEU  56           HG       LEU  56  -8.489  -4.414   3.392
  434   1HD1  LEU  56          1HD1      LEU  56  -7.665  -6.578   5.321
  435   2HD1  LEU  56          2HD1      LEU  56  -8.821  -5.344   5.823
  436   3HD1  LEU  56          3HD1      LEU  56  -9.189  -6.386   4.453
  437   1HD2  LEU  56          1HD2      LEU  56  -6.314  -3.250   4.239
  438   2HD2  LEU  56          2HD2      LEU  56  -7.787  -3.042   5.182
  439   3HD2  LEU  56          3HD2      LEU  56  -6.559  -4.194   5.705
  440    H    ILE  57           H        ILE  57  -7.264  -5.668   0.114
  441    HA   ILE  57           HA       ILE  57  -9.943  -4.634   0.050
  442    HB   ILE  57           HB       ILE  57  -8.157  -5.360  -2.292
  443   1HG1  ILE  57          1HG1      ILE  57  -6.945  -3.814  -0.867
  444   2HG1  ILE  57          2HG1      ILE  57  -7.565  -2.904  -2.240
  445   1HG2  ILE  57          1HG2      ILE  57 -10.527  -3.500  -2.014
  446   2HG2  ILE  57          2HG2      ILE  57  -9.492  -3.585  -3.440
  447   3HG2  ILE  57          3HG2      ILE  57 -10.447  -4.983  -2.960
  448   1HD1  ILE  57          1HD1      ILE  57  -9.615  -2.435  -0.667
  449   2HD1  ILE  57          2HD1      ILE  57  -8.496  -2.885   0.619
  450   3HD1  ILE  57          3HD1      ILE  57  -8.126  -1.523  -0.437
  451    H    ASP  58           H        ASP  58  -8.436  -7.636  -1.039
  452    HA   ASP  58           HA       ASP  58 -10.651  -8.679  -2.498
  453   1HB   ASP  58          1HB       ASP  58  -8.472 -10.061  -0.909
  454   2HB   ASP  58          2HB       ASP  58  -9.632 -10.927  -1.919
  455    H    GLU  59           H        GLU  59  -9.874  -8.815   0.971
  456    HA   GLU  59           HA       GLU  59 -12.128 -10.496   1.639
  457   1HB   GLU  59          1HB       GLU  59 -10.420  -8.622   3.302
  458   2HB   GLU  59          2HB       GLU  59 -11.694  -9.635   3.983
  459   1HG   GLU  59          1HG       GLU  59  -9.387 -10.719   2.344
  460   2HG   GLU  59          2HG       GLU  59  -9.392 -10.659   4.106
  461    H    ILE  60           H        ILE  60 -11.530  -7.016   1.534
  462    HA   ILE  60           HA       ILE  60 -14.069  -6.242   2.608
  463    HB   ILE  60           HB       ILE  60 -12.150  -4.781   0.777
  464   1HG1  ILE  60          1HG1      ILE  60 -12.685  -4.445   3.742
  465   2HG1  ILE  60          2HG1      ILE  60 -11.391  -5.457   3.103
  466   1HG2  ILE  60          1HG2      ILE  60 -14.641  -3.860   2.230
  467   2HG2  ILE  60          2HG2      ILE  60 -13.402  -2.745   1.653
  468   3HG2  ILE  60          3HG2      ILE  60 -14.295  -3.741   0.504
  469   1HD1  ILE  60          1HD1      ILE  60 -11.684  -2.549   2.325
  470   2HD1  ILE  60          2HD1      ILE  60 -10.750  -3.053   3.733
  471   3HD1  ILE  60          3HD1      ILE  60 -10.278  -3.593   2.121
  472    H    LEU  61           H        LEU  61 -12.903  -6.644  -0.741
  473    HA   LEU  61           HA       LEU  61 -15.455  -5.981  -1.926
  474   1HB   LEU  61          1HB       LEU  61 -13.043  -7.477  -2.996
  475   2HB   LEU  61          2HB       LEU  61 -14.466  -7.118  -3.974
  476    HG   LEU  61           HG       LEU  61 -12.753  -5.047  -2.563
  477   1HD1  LEU  61          1HD1      LEU  61 -11.653  -6.262  -4.480
  478   2HD1  LEU  61          2HD1      LEU  61 -12.953  -5.686  -5.521
  479   3HD1  LEU  61          3HD1      LEU  61 -11.861  -4.531  -4.759
  480   1HD2  LEU  61          1HD2      LEU  61 -15.287  -4.928  -4.179
  481   2HD2  LEU  61          2HD2      LEU  61 -14.787  -3.944  -2.803
  482   3HD2  LEU  61          3HD2      LEU  61 -14.114  -3.630  -4.397
  483    H    ALA  62           H        ALA  62 -13.902  -9.011  -0.952
  484    HA   ALA  62           HA       ALA  62 -15.829 -10.792  -2.052
  485   1HB   ALA  62          1HB       ALA  62 -14.210 -11.097   0.496
  486   2HB   ALA  62          2HB       ALA  62 -15.017 -12.404  -0.370
  487   3HB   ALA  62          3HB       ALA  62 -13.670 -11.549  -1.121
  488    H    ALA  63           H        ALA  63 -15.763  -9.067   1.060
  489    HA   ALA  63           HA       ALA  63 -18.029 -10.337   2.221
  490   1HB   ALA  63          1HB       ALA  63 -16.407  -8.828   3.411
  491   2HB   ALA  63          2HB       ALA  63 -17.186  -7.457   2.621
  492   3HB   ALA  63          3HB       ALA  63 -18.100  -8.462   3.744
  493    H    LEU  64           H        LEU  64 -17.925  -7.161   0.532
  494    HA   LEU  64           HA       LEU  64 -20.795  -6.945   0.500
  495   1HB   LEU  64          1HB       LEU  64 -20.449  -4.947  -0.789
  496   2HB   LEU  64          2HB       LEU  64 -19.095  -5.058   0.320
  497    HG   LEU  64           HG       LEU  64 -17.878  -6.308  -1.607
  498   1HD1  LEU  64          1HD1      LEU  64 -20.383  -5.645  -2.945
  499   2HD1  LEU  64          2HD1      LEU  64 -19.033  -4.861  -3.764
  500   3HD1  LEU  64          3HD1      LEU  64 -19.030  -6.603  -3.527
  501   1HD2  LEU  64          1HD2      LEU  64 -18.490  -3.342  -1.793
  502   2HD2  LEU  64          2HD2      LEU  64 -17.251  -4.082  -0.780
  503   3HD2  LEU  64          3HD2      LEU  64 -17.107  -4.143  -2.536
  504    HA   PRO  65           HA       PRO  65 -21.986  -9.615  -2.866
  505   1HB   PRO  65          1HB       PRO  65 -23.251  -7.326  -4.268
  506   2HB   PRO  65          2HB       PRO  65 -23.985  -8.818  -3.667
  507   1HG   PRO  65          1HG       PRO  65 -24.215  -6.279  -2.479
  508   2HG   PRO  65          2HG       PRO  65 -24.633  -7.818  -1.718
  509   1HD   PRO  65          1HD       PRO  65 -22.440  -6.039  -1.043
  510   2HD   PRO  65          2HD       PRO  65 -22.897  -7.562  -0.246

  No H/Q in entry =         510
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  21.367  -4.956 -27.854
    2    H2   MET   1           H2       MET   1  21.680  -6.554 -27.367
    3    H3   MET   1           H3       MET   1  20.081  -6.034 -27.590
    4    HA   MET   1           HA       MET   1  19.942  -5.120 -25.572
    5   1HB   MET   1          1HB       MET   1  22.503  -6.729 -25.312
    6   2HB   MET   1          2HB       MET   1  21.604  -6.083 -23.940
    7   1HG   MET   1          1HG       MET   1  20.816  -8.306 -24.163
    8   2HG   MET   1          2HG       MET   1  19.564  -7.326 -24.922
    9   1HE   MET   1          1HE       MET   1  18.997  -9.791 -25.620
   10   2HE   MET   1          2HE       MET   1  18.459  -8.678 -26.875
   11   3HE   MET   1          3HE       MET   1  19.260 -10.192 -27.316
   12    H    LYS   2           H        LYS   2  20.596  -3.367 -24.247
   13    HA   LYS   2           HA       LYS   2  22.364  -1.454 -25.489
   14   1HB   LYS   2          1HB       LYS   2  21.144  -1.533 -22.712
   15   2HB   LYS   2          2HB       LYS   2  21.993  -0.144 -23.383
   16   1HG   LYS   2          1HG       LYS   2  19.656  -1.381 -24.842
   17   2HG   LYS   2          2HG       LYS   2  19.397  -0.202 -23.559
   18   1HD   LYS   2          1HD       LYS   2  20.953   1.362 -24.803
   19   2HD   LYS   2          2HD       LYS   2  20.935   0.214 -26.139
   20   1HE   LYS   2          1HE       LYS   2  18.484   1.539 -24.946
   21   2HE   LYS   2          2HE       LYS   2  19.262   2.009 -26.457
   22   1HZ   LYS   2          1HZ       LYS   2  18.836  -0.740 -26.555
   23   2HZ   LYS   2          2HZ       LYS   2  17.388  -0.040 -26.014
   24   3HZ   LYS   2          3HZ       LYS   2  18.079   0.466 -27.481
   25    H    ALA   3           H        ALA   3  24.491  -0.939 -24.977
   26    HA   ALA   3           HA       ALA   3  25.985  -2.966 -23.451
   27   1HB   ALA   3          1HB       ALA   3  27.111  -0.433 -24.663
   28   2HB   ALA   3          2HB       ALA   3  27.949  -1.949 -24.331
   29   3HB   ALA   3          3HB       ALA   3  26.768  -1.862 -25.638
   30    H    ILE   4           H        ILE   4  28.008  -1.417 -22.318
   31    HA   ILE   4           HA       ILE   4  26.867  -0.659 -19.822
   32    HB   ILE   4           HB       ILE   4  29.261  -1.260 -20.130
   33   1HG1  ILE   4          1HG1      ILE   4  28.877   1.549 -19.047
   34   2HG1  ILE   4          2HG1      ILE   4  28.475   0.077 -18.163
   35   1HG2  ILE   4          1HG2      ILE   4  29.421   0.103 -22.300
   36   2HG2  ILE   4          2HG2      ILE   4  29.616   1.519 -21.267
   37   3HG2  ILE   4          3HG2      ILE   4  30.796   0.210 -21.202
   38   1HD1  ILE   4          1HD1      ILE   4  30.842  -0.670 -18.395
   39   2HD1  ILE   4          2HD1      ILE   4  31.221   0.867 -19.173
   40   3HD1  ILE   4          3HD1      ILE   4  30.695   0.837 -17.490
   41    H    PHE   5           H        PHE   5  27.778   1.262 -22.672
   42    HA   PHE   5           HA       PHE   5  27.222   3.818 -21.472
   43   1HB   PHE   5          1HB       PHE   5  27.267   2.903 -24.362
   44   2HB   PHE   5          2HB       PHE   5  27.058   4.586 -23.877
   45    HD1  PHE   5           HD1      PHE   5  28.883   5.841 -22.836
   46    HD2  PHE   5           HD2      PHE   5  29.389   1.743 -24.017
   47    HE1  PHE   5           HE1      PHE   5  31.339   6.073 -22.584
   48    HE2  PHE   5           HE2      PHE   5  31.846   1.974 -23.765
   49    HZ   PHE   5           HZ       PHE   5  32.821   4.138 -23.048
   50    H    VAL   6           H        VAL   6  25.301   4.943 -21.330
   51    HA   VAL   6           HA       VAL   6  22.849   3.740 -22.559
   52    HB   VAL   6           HB       VAL   6  21.672   4.375 -20.388
   53   1HG1  VAL   6          1HG1      VAL   6  23.804   2.220 -20.428
   54   2HG1  VAL   6          2HG1      VAL   6  22.556   2.329 -19.186
   55   3HG1  VAL   6          3HG1      VAL   6  22.106   2.049 -20.868
   56   1HG2  VAL   6          1HG2      VAL   6  23.706   5.810 -19.677
   57   2HG2  VAL   6          2HG2      VAL   6  22.963   4.802 -18.438
   58   3HG2  VAL   6          3HG2      VAL   6  24.460   4.284 -19.215
   59    H    LEU   7           H        LEU   7  21.081   5.328 -22.756
   60    HA   LEU   7           HA       LEU   7  22.040   7.889 -23.677
   61   1HB   LEU   7          1HB       LEU   7  19.364   8.308 -23.528
   62   2HB   LEU   7          2HB       LEU   7  20.099   7.375 -24.827
   63    HG   LEU   7           HG       LEU   7  19.356   5.923 -22.295
   64   1HD1  LEU   7          1HD1      LEU   7  17.399   6.805 -24.435
   65   2HD1  LEU   7          2HD1      LEU   7  17.070   5.532 -23.258
   66   3HD1  LEU   7          3HD1      LEU   7  17.337   7.190 -22.715
   67   1HD2  LEU   7          1HD2      LEU   7  20.546   4.977 -24.437
   68   2HD2  LEU   7          2HD2      LEU   7  19.237   4.046 -23.712
   69   3HD2  LEU   7          3HD2      LEU   7  18.935   5.023 -25.150
   70    H    ASN   8           H        ASN   8  20.351   6.832 -20.730
   71    HA   ASN   8           HA       ASN   8  20.171   9.551 -19.679
   72   1HB   ASN   8          1HB       ASN   8  19.369   8.445 -17.621
   73   2HB   ASN   8          2HB       ASN   8  18.525   7.825 -19.040
   74   2HD2  ASN   8          2HD2      ASN   8  18.598   6.198 -16.761
   75   1HD2  ASN   8          1HD2      ASN   8  19.637   4.883 -17.027
   76    H    ALA   9           H        ALA   9  21.287  10.204 -17.659
   77    HA   ALA   9           HA       ALA   9  24.123   9.415 -17.747
   78   1HB   ALA   9          1HB       ALA   9  24.306  11.195 -15.932
   79   2HB   ALA   9          2HB       ALA   9  23.720  11.766 -17.496
   80   3HB   ALA   9          3HB       ALA   9  22.585  11.494 -16.172
   81    H    GLN  10           H        GLN  10  21.305   8.596 -15.980
   82    HA   GLN  10           HA       GLN  10  22.825   6.730 -14.317
   83   1HB   GLN  10          1HB       GLN  10  21.981   7.618 -12.171
   84   2HB   GLN  10          2HB       GLN  10  22.999   8.805 -12.988
   85   1HG   GLN  10          1HG       GLN  10  20.891   9.808 -13.961
   86   2HG   GLN  10          2HG       GLN  10  19.972   8.742 -12.897
   87   2HE2  GLN  10          2HE2      GLN  10  19.158  10.280 -11.399
   88   1HE2  GLN  10          1HE2      GLN  10  20.150  11.267 -10.438
   89    H    HIS  11           H        HIS  11  21.329   5.272 -13.121
   90    HA   HIS  11           HA       HIS  11  18.690   5.070 -14.523
   91   1HB   HIS  11          1HB       HIS  11  18.733   2.712 -13.745
   92   2HB   HIS  11          2HB       HIS  11  20.146   3.106 -14.725
   93    HD1  HIS  11           HD1      HIS  11  21.131   4.810 -11.951
   94    HD2  HIS  11           HD2      HIS  11  20.590   0.720 -12.547
   95    HE1  HIS  11           HE1      HIS  11  22.514   3.640 -10.182
   96    H    ASP  12           H        ASP  12  17.134   6.077 -13.333
   97    HA   ASP  12           HA       ASP  12  16.436   5.087 -10.715
   98   1HB   ASP  12          1HB       ASP  12  16.809   7.166  -9.438
   99   2HB   ASP  12          2HB       ASP  12  18.335   6.524 -10.046
  100    H    GLU  13           H        GLU  13  14.240   5.145 -10.883
  101    HA   GLU  13           HA       GLU  13  12.944   7.641 -11.889
  102   1HB   GLU  13          1HB       GLU  13  12.270   4.836 -12.835
  103   2HB   GLU  13          2HB       GLU  13  11.378   6.296 -13.253
  104   1HG   GLU  13          1HG       GLU  13  14.303   5.806 -13.894
  105   2HG   GLU  13          2HG       GLU  13  12.974   5.643 -15.039
  106    H    ALA  14           H        ALA  14  11.549   4.454 -11.184
  107    HA   ALA  14           HA       ALA  14   9.662   5.685  -9.323
  108   1HB   ALA  14          1HB       ALA  14   8.773   3.379  -9.100
  109   2HB   ALA  14          2HB       ALA  14  10.124   2.780 -10.063
  110   3HB   ALA  14          3HB       ALA  14   8.934   3.860 -10.789
  111    H    VAL  15           H        VAL  15   9.397   4.948  -7.090
  112    HA   VAL  15           HA       VAL  15  11.884   3.849  -5.826
  113    HB   VAL  15           HB       VAL  15  11.512   5.468  -3.949
  114   1HG1  VAL  15          1HG1      VAL  15  13.151   5.901  -5.779
  115   2HG1  VAL  15          2HG1      VAL  15  11.897   6.773  -6.660
  116   3HG1  VAL  15          3HG1      VAL  15  12.477   7.388  -5.112
  117   1HG2  VAL  15          1HG2      VAL  15   9.524   6.656  -5.912
  118   2HG2  VAL  15          2HG2      VAL  15   9.138   5.937  -4.348
  119   3HG2  VAL  15          3HG2      VAL  15  10.063   7.437  -4.425
  120    H    ASP  16           H        ASP  16  11.476   2.436  -4.118
  121    HA   ASP  16           HA       ASP  16   8.840   1.269  -3.975
  122   1HB   ASP  16          1HB       ASP  16  11.320   0.916  -2.273
  123   2HB   ASP  16          2HB       ASP  16   9.845  -0.023  -2.041
  124    H    ALA  17           H        ALA  17  10.427   3.832  -2.248
  125    HA   ALA  17           HA       ALA  17   8.976   3.762   0.195
  126   1HB   ALA  17          1HB       ALA  17  10.974   5.261  -0.499
  127   2HB   ALA  17          2HB       ALA  17   9.745   5.965   0.551
  128   3HB   ALA  17          3HB       ALA  17   9.751   6.338  -1.173
  129    H    ASN  18           H        ASN  18   8.227   5.542  -2.825
  130    HA   ASN  18           HA       ASN  18   5.615   6.360  -1.773
  131   1HB   ASN  18          1HB       ASN  18   6.904   6.640  -4.500
  132   2HB   ASN  18          2HB       ASN  18   5.311   7.281  -4.100
  133   2HD2  ASN  18          2HD2      ASN  18   5.571   8.441  -1.655
  134   1HD2  ASN  18          1HD2      ASN  18   6.797   9.616  -1.647
  135    H    SER  19           H        SER  19   6.828   3.566  -3.313
  136    HA   SER  19           HA       SER  19   4.653   2.847  -4.993
  137   1HB   SER  19          1HB       SER  19   6.539   1.120  -3.377
  138   2HB   SER  19          2HB       SER  19   5.408   0.486  -4.569
  139    HG   SER  19           HG       SER  19   6.766   1.070  -6.053
  140    H    LEU  20           H        LEU  20   5.136   2.231  -1.496
  141    HA   LEU  20           HA       LEU  20   2.642   0.786  -1.240
  142   1HB   LEU  20          1HB       LEU  20   4.741   1.820   0.591
  143   2HB   LEU  20          2HB       LEU  20   3.134   1.790   1.306
  144    HG   LEU  20           HG       LEU  20   2.992  -0.643   0.473
  145   1HD1  LEU  20          1HD1      LEU  20   5.048  -0.296  -1.033
  146   2HD1  LEU  20          2HD1      LEU  20   6.004  -0.412   0.444
  147   3HD1  LEU  20          3HD1      LEU  20   5.010  -1.775  -0.072
  148   1HD2  LEU  20          1HD2      LEU  20   5.036   0.109   2.577
  149   2HD2  LEU  20          2HD2      LEU  20   3.293  -0.017   2.827
  150   3HD2  LEU  20          3HD2      LEU  20   4.236  -1.455   2.438
  151    H    ALA  21           H        ALA  21   3.598   4.168  -0.791
  152    HA   ALA  21           HA       ALA  21   1.151   5.096   0.282
  153   1HB   ALA  21          1HB       ALA  21   3.063   6.557  -1.563
  154   2HB   ALA  21          2HB       ALA  21   3.213   6.464   0.192
  155   3HB   ALA  21          3HB       ALA  21   1.847   7.313  -0.534
  156    H    GLU  22           H        GLU  22   2.240   4.966  -3.125
  157    HA   GLU  22           HA       GLU  22  -0.200   5.946  -4.238
  158   1HB   GLU  22          1HB       GLU  22   1.896   5.753  -5.537
  159   2HB   GLU  22          2HB       GLU  22   1.788   3.995  -5.440
  160   1HG   GLU  22          1HG       GLU  22  -0.304   4.009  -6.684
  161   2HG   GLU  22          2HG       GLU  22  -0.318   5.773  -6.702
  162    H    ALA  23           H        ALA  23   0.891   2.648  -3.486
  163    HA   ALA  23           HA       ALA  23  -1.363   1.274  -4.546
  164   1HB   ALA  23          1HB       ALA  23  -0.708  -0.551  -2.999
  165   2HB   ALA  23          2HB       ALA  23   0.385   0.558  -2.174
  166   3HB   ALA  23          3HB       ALA  23   0.686   0.111  -3.852
  167    H    LYS  24           H        LYS  24  -0.752   2.543  -1.259
  168    HA   LYS  24           HA       LYS  24  -3.331   1.725  -0.251
  169   1HB   LYS  24          1HB       LYS  24  -1.389   3.845   0.730
  170   2HB   LYS  24          2HB       LYS  24  -2.819   3.316   1.619
  171   1HG   LYS  24          1HG       LYS  24  -1.944   1.002   1.656
  172   2HG   LYS  24          2HG       LYS  24  -0.512   1.526   0.771
  173   1HD   LYS  24          1HD       LYS  24  -0.079   3.174   2.654
  174   2HD   LYS  24          2HD       LYS  24  -1.361   2.362   3.553
  175   1HE   LYS  24          1HE       LYS  24   1.362   1.356   2.811
  176   2HE   LYS  24          2HE       LYS  24   0.460   1.139   4.311
  177   1HZ   LYS  24          1HZ       LYS  24  -1.116  -0.234   2.825
  178   2HZ   LYS  24          2HZ       LYS  24   0.204  -0.316   1.762
  179   3HZ   LYS  24          3HZ       LYS  24   0.345  -0.930   3.340
  180    H    VAL  25           H        VAL  25  -2.072   4.731  -1.675
  181    HA   VAL  25           HA       VAL  25  -4.432   6.300  -1.272
  182    HB   VAL  25           HB       VAL  25  -2.236   6.466  -3.338
  183   1HG1  VAL  25          1HG1      VAL  25  -4.570   8.315  -2.819
  184   2HG1  VAL  25          2HG1      VAL  25  -3.111   8.830  -3.666
  185   3HG1  VAL  25          3HG1      VAL  25  -4.121   7.553  -4.344
  186   1HG2  VAL  25          1HG2      VAL  25  -1.866   6.895  -0.786
  187   2HG2  VAL  25          2HG2      VAL  25  -1.261   8.088  -1.935
  188   3HG2  VAL  25          3HG2      VAL  25  -2.769   8.381  -1.070
  189    H    LEU  26           H        LEU  26  -3.336   4.383  -4.094
  190    HA   LEU  26           HA       LEU  26  -5.686   4.858  -5.664
  191   1HB   LEU  26          1HB       LEU  26  -3.704   2.562  -5.665
  192   2HB   LEU  26          2HB       LEU  26  -4.988   2.732  -6.860
  193    HG   LEU  26           HG       LEU  26  -2.804   4.773  -6.333
  194   1HD1  LEU  26          1HD1      LEU  26  -2.056   2.620  -7.389
  195   2HD1  LEU  26          2HD1      LEU  26  -3.198   2.917  -8.699
  196   3HD1  LEU  26          3HD1      LEU  26  -1.851   4.023  -8.439
  197   1HD2  LEU  26          1HD2      LEU  26  -5.237   4.723  -8.107
  198   2HD2  LEU  26          2HD2      LEU  26  -4.516   6.075  -7.233
  199   3HD2  LEU  26          3HD2      LEU  26  -3.774   5.498  -8.720
  200    H    ALA  27           H        ALA  27  -4.843   2.299  -3.349
  201    HA   ALA  27           HA       ALA  27  -7.271   0.795  -3.717
  202   1HB   ALA  27          1HB       ALA  27  -5.383  -0.264  -2.624
  203   2HB   ALA  27          2HB       ALA  27  -5.346   0.983  -1.377
  204   3HB   ALA  27          3HB       ALA  27  -6.691  -0.156  -1.446
  205    H    ASN  28           H        ASN  28  -6.303   3.420  -1.559
  206    HA   ASN  28           HA       ASN  28  -8.624   3.494   0.084
  207   1HB   ASN  28          1HB       ASN  28  -6.546   4.764   0.551
  208   2HB   ASN  28          2HB       ASN  28  -6.869   5.790  -0.846
  209   2HD2  ASN  28          2HD2      ASN  28  -7.957   4.994   2.429
  210   1HD2  ASN  28          1HD2      ASN  28  -8.962   6.350   2.615
  211    H    ARG  29           H        ARG  29  -7.921   4.990  -3.058
  212    HA   ARG  29           HA       ARG  29 -10.281   6.562  -3.288
  213   1HB   ARG  29          1HB       ARG  29  -8.557   5.220  -5.381
  214   2HB   ARG  29          2HB       ARG  29  -9.882   6.304  -5.788
  215   1HG   ARG  29          1HG       ARG  29  -7.698   7.146  -3.880
  216   2HG   ARG  29          2HG       ARG  29  -7.486   7.307  -5.619
  217   1HD   ARG  29          1HD       ARG  29  -9.754   8.558  -5.588
  218   2HD   ARG  29          2HD       ARG  29  -9.527   8.676  -3.848
  219    HE   ARG  29           HE       ARG  29  -8.296  10.320  -5.838
  220   1HH1  ARG  29          1HH1      ARG  29  -6.404  11.463  -5.503
  221   2HH1  ARG  29          2HH1      ARG  29  -5.406  11.087  -4.139
  222   1HH2  ARG  29          1HH2      ARG  29  -7.488   8.589  -2.960
  223   2HH2  ARG  29          2HH2      ARG  29  -6.015   9.458  -2.709
  224    H    GLU  30           H        GLU  30  -9.674   3.156  -4.081
  225    HA   GLU  30           HA       GLU  30 -12.117   2.641  -5.436
  226   1HB   GLU  30          1HB       GLU  30 -10.226   1.052  -5.381
  227   2HB   GLU  30          2HB       GLU  30 -10.512   0.776  -3.662
  228   1HG   GLU  30          1HG       GLU  30 -12.674  -0.178  -4.091
  229   2HG   GLU  30          2HG       GLU  30 -12.612   0.303  -5.789
  230    H    LEU  31           H        LEU  31 -11.362   2.514  -1.944
  231    HA   LEU  31           HA       LEU  31 -13.954   1.548  -1.133
  232   1HB   LEU  31          1HB       LEU  31 -12.194   3.434   0.466
  233   2HB   LEU  31          2HB       LEU  31 -13.333   2.234   1.081
  234    HG   LEU  31           HG       LEU  31 -10.779   1.676  -0.435
  235   1HD1  LEU  31          1HD1      LEU  31 -11.615   1.246   2.450
  236   2HD1  LEU  31          2HD1      LEU  31 -10.153   0.561   1.737
  237   3HD1  LEU  31          3HD1      LEU  31 -10.339   2.311   1.860
  238   1HD2  LEU  31          1HD2      LEU  31 -13.055  -0.088   0.488
  239   2HD2  LEU  31          2HD2      LEU  31 -12.252  -0.055  -1.083
  240   3HD2  LEU  31          3HD2      LEU  31 -11.426  -0.740   0.314
  241    H    ASP  32           H        ASP  32 -12.537   4.754  -1.475
  242    HA   ASP  32           HA       ASP  32 -14.782   6.303  -0.686
  243   1HB   ASP  32          1HB       ASP  32 -12.500   7.202  -0.977
  244   2HB   ASP  32          2HB       ASP  32 -12.614   6.925  -2.713
  245    H    LYS  33           H        LYS  33 -13.815   4.937  -3.806
  246    HA   LYS  33           HA       LYS  33 -15.812   6.153  -5.423
  247   1HB   LYS  33          1HB       LYS  33 -13.894   4.930  -6.349
  248   2HB   LYS  33          2HB       LYS  33 -14.502   3.426  -5.662
  249   1HG   LYS  33          1HG       LYS  33 -16.482   3.525  -7.073
  250   2HG   LYS  33          2HG       LYS  33 -16.004   5.109  -7.687
  251   1HD   LYS  33          1HD       LYS  33 -14.166   4.228  -8.884
  252   2HD   LYS  33          2HD       LYS  33 -14.172   2.722  -7.964
  253   1HE   LYS  33          1HE       LYS  33 -16.112   1.928  -9.061
  254   2HE   LYS  33          2HE       LYS  33 -16.512   3.525  -9.696
  255   1HZ   LYS  33          1HZ       LYS  33 -13.905   2.666 -10.486
  256   2HZ   LYS  33          2HZ       LYS  33 -15.104   1.579 -10.993
  257   3HZ   LYS  33          3HZ       LYS  33 -15.199   3.214 -11.442
  258    H    TYR  34           H        TYR  34 -15.857   2.980  -3.742
  259    HA   TYR  34           HA       TYR  34 -18.612   2.455  -4.444
  260   1HB   TYR  34          1HB       TYR  34 -16.801   1.285  -2.320
  261   2HB   TYR  34          2HB       TYR  34 -18.449   0.722  -2.597
  262    HD1  TYR  34           HD1      TYR  34 -15.083   0.165  -3.461
  263    HD2  TYR  34           HD2      TYR  34 -19.020   0.281  -5.183
  264    HE1  TYR  34           HE1      TYR  34 -14.309  -1.257  -5.342
  265    HE2  TYR  34           HE2      TYR  34 -18.239  -1.136  -7.060
  266    HH   TYR  34           HH       TYR  34 -15.793  -2.989  -7.071
  267    H    GLY  35           H        GLY  35 -17.022   4.106  -1.780
  268   1HA   GLY  35          1HA       GLY  35 -19.658   5.127  -0.891
  269   2HA   GLY  35          2HA       GLY  35 -18.083   5.743  -0.386
  270    H    VAL  36           H        VAL  36 -17.059   3.024   0.211
  271    HA   VAL  36           HA       VAL  36 -18.765   1.767   2.158
  272    HB   VAL  36           HB       VAL  36 -15.751   1.610   2.293
  273   1HG1  VAL  36          1HG1      VAL  36 -17.997  -0.411   2.601
  274   2HG1  VAL  36          2HG1      VAL  36 -16.279  -0.766   2.786
  275   3HG1  VAL  36          3HG1      VAL  36 -17.080   0.325   3.916
  276   1HG2  VAL  36          1HG2      VAL  36 -17.576   0.523   0.138
  277   2HG2  VAL  36          2HG2      VAL  36 -16.089   1.451  -0.060
  278   3HG2  VAL  36          3HG2      VAL  36 -16.017  -0.218   0.503
  279    H    SER  37           H        SER  37 -18.086   1.652   4.554
  280    HA   SER  37           HA       SER  37 -18.297   4.221   5.726
  281   1HB   SER  37          1HB       SER  37 -18.893   2.137   6.912
  282   2HB   SER  37          2HB       SER  37 -17.196   1.680   6.965
  283    HG   SER  37           HG       SER  37 -17.909   4.203   7.918
  284    H    ASP  38           H        ASP  38 -16.790   5.671   6.493
  285    HA   ASP  38           HA       ASP  38 -14.212   5.772   5.317
  286   1HB   ASP  38          1HB       ASP  38 -15.517   7.710   6.296
  287   2HB   ASP  38          2HB       ASP  38 -15.026   7.144   7.892
  288    H    TYR  39           H        TYR  39 -15.314   3.993   8.034
  289    HA   TYR  39           HA       TYR  39 -12.969   3.889   9.636
  290   1HB   TYR  39          1HB       TYR  39 -15.075   2.959  10.426
  291   2HB   TYR  39          2HB       TYR  39 -15.082   1.775   9.118
  292    HD1  TYR  39           HD1      TYR  39 -13.575   2.716  12.340
  293    HD2  TYR  39           HD2      TYR  39 -13.510  -0.090   9.091
  294    HE1  TYR  39           HE1      TYR  39 -12.190   1.171  13.700
  295    HE2  TYR  39           HE2      TYR  39 -12.132  -1.633  10.445
  296    HH   TYR  39           HH       TYR  39 -10.677  -1.626  12.330
  297    H    TYR  40           H        TYR  40 -13.955   1.812   6.899
  298    HA   TYR  40           HA       TYR  40 -11.702   0.080   6.974
  299   1HB   TYR  40          1HB       TYR  40 -13.380   0.959   4.606
  300   2HB   TYR  40          2HB       TYR  40 -12.251  -0.397   4.593
  301    HD1  TYR  40           HD1      TYR  40 -15.531   0.776   5.619
  302    HD2  TYR  40           HD2      TYR  40 -12.649  -2.368   6.097
  303    HE1  TYR  40           HE1      TYR  40 -17.287  -0.682   6.592
  304    HE2  TYR  40           HE2      TYR  40 -14.402  -3.829   7.069
  305    HH   TYR  40           HH       TYR  40 -16.608  -3.494   8.277
  306    H    LYS  41           H        LYS  41 -12.074   3.311   5.577
  307    HA   LYS  41           HA       LYS  41  -9.760   3.261   3.907
  308   1HB   LYS  41          1HB       LYS  41 -11.142   5.535   5.359
  309   2HB   LYS  41          2HB       LYS  41  -9.818   5.771   4.218
  310   1HG   LYS  41          1HG       LYS  41 -11.109   4.702   2.439
  311   2HG   LYS  41          2HG       LYS  41 -12.412   4.345   3.570
  312   1HD   LYS  41          1HD       LYS  41 -13.054   6.326   2.352
  313   2HD   LYS  41          2HD       LYS  41 -12.627   6.828   3.986
  314   1HE   LYS  41          1HE       LYS  41 -10.577   7.759   3.301
  315   2HE   LYS  41          2HE       LYS  41 -10.565   6.857   1.786
  316   1HZ   LYS  41          1HZ       LYS  41 -12.566   8.942   2.455
  317   2HZ   LYS  41          2HZ       LYS  41 -11.159   9.235   1.549
  318   3HZ   LYS  41          3HZ       LYS  41 -12.348   8.175   0.958
  319    H    ASN  42           H        ASN  42 -10.220   4.101   7.309
  320    HA   ASN  42           HA       ASN  42  -7.531   4.930   7.786
  321   1HB   ASN  42          1HB       ASN  42  -9.456   5.361   9.333
  322   2HB   ASN  42          2HB       ASN  42  -9.448   3.648   9.753
  323   2HD2  ASN  42          2HD2      ASN  42  -8.735   3.876  11.945
  324   1HD2  ASN  42          1HD2      ASN  42  -7.208   4.492  12.356
  325    H    LEU  43           H        LEU  43  -9.126   1.798   7.833
  326    HA   LEU  43           HA       LEU  43  -7.031   0.304   9.039
  327   1HB   LEU  43          1HB       LEU  43  -9.305  -0.586   8.698
  328   2HB   LEU  43          2HB       LEU  43  -9.057  -0.568   6.956
  329    HG   LEU  43           HG       LEU  43  -7.206  -2.183   7.196
  330   1HD1  LEU  43          1HD1      LEU  43  -7.814  -1.778  10.124
  331   2HD1  LEU  43          2HD1      LEU  43  -7.171  -3.328   9.575
  332   3HD1  LEU  43          3HD1      LEU  43  -6.247  -1.852   9.315
  333   1HD2  LEU  43          1HD2      LEU  43  -9.806  -2.965   8.552
  334   2HD2  LEU  43          2HD2      LEU  43  -9.452  -3.060   6.827
  335   3HD2  LEU  43          3HD2      LEU  43  -8.609  -4.116   7.960
  336    H    ILE  44           H        ILE  44  -7.607   1.225   5.640
  337    HA   ILE  44           HA       ILE  44  -5.481  -0.301   4.489
  338    HB   ILE  44           HB       ILE  44  -6.385   2.464   3.616
  339   1HG1  ILE  44          1HG1      ILE  44  -8.380   1.129   3.748
  340   2HG1  ILE  44          2HG1      ILE  44  -7.905   1.165   2.054
  341   1HG2  ILE  44          1HG2      ILE  44  -5.105   0.135   2.153
  342   2HG2  ILE  44          2HG2      ILE  44  -5.693   1.602   1.372
  343   3HG2  ILE  44          3HG2      ILE  44  -4.354   1.687   2.515
  344   1HD1  ILE  44          1HD1      ILE  44  -6.642  -1.035   2.566
  345   2HD1  ILE  44          2HD1      ILE  44  -7.619  -1.087   4.031
  346   3HD1  ILE  44          3HD1      ILE  44  -8.400  -1.105   2.455
  347    H    ASN  45           H        ASN  45  -5.556   2.934   5.949
  348    HA   ASN  45           HA       ASN  45  -2.861   3.658   5.397
  349   1HB   ASN  45          1HB       ASN  45  -4.713   4.406   7.680
  350   2HB   ASN  45          2HB       ASN  45  -3.118   5.131   7.454
  351   2HD2  ASN  45          2HD2      ASN  45  -5.608   6.624   7.281
  352   1HD2  ASN  45          1HD2      ASN  45  -5.751   7.192   5.688
  353    H    ASN  46           H        ASN  46  -4.276   1.811   8.072
  354    HA   ASN  46           HA       ASN  46  -1.837   1.586   9.580
  355   1HB   ASN  46          1HB       ASN  46  -4.169   1.225  10.468
  356   2HB   ASN  46          2HB       ASN  46  -4.194  -0.314   9.607
  357   2HD2  ASN  46          2HD2      ASN  46  -4.428  -1.131  11.971
  358   1HD2  ASN  46          1HD2      ASN  46  -2.993  -1.424  12.829
  359    H    ALA  47           H        ALA  47  -2.724   0.134   6.625
  360    HA   ALA  47           HA       ALA  47  -1.709  -2.495   6.878
  361   1HB   ALA  47          1HB       ALA  47  -1.727  -0.585   4.538
  362   2HB   ALA  47          2HB       ALA  47  -1.122  -2.234   4.397
  363   3HB   ALA  47          3HB       ALA  47  -2.805  -1.946   4.840
  364    H    LYS  48           H        LYS  48   0.322  -3.358   6.955
  365    HA   LYS  48           HA       LYS  48   2.609  -1.466   7.187
  366   1HB   LYS  48          1HB       LYS  48   2.255  -4.374   7.973
  367   2HB   LYS  48          2HB       LYS  48   3.772  -3.497   8.142
  368   1HG   LYS  48          1HG       LYS  48   1.225  -2.423   9.353
  369   2HG   LYS  48          2HG       LYS  48   2.186  -3.627  10.205
  370   1HD   LYS  48          1HD       LYS  48   4.183  -2.089   9.937
  371   2HD   LYS  48          2HD       LYS  48   3.072  -0.859   9.336
  372   1HE   LYS  48          1HE       LYS  48   1.816  -0.907  11.418
  373   2HE   LYS  48          2HE       LYS  48   2.810  -2.234  12.022
  374   1HZ   LYS  48          1HZ       LYS  48   4.746  -0.795  11.896
  375   2HZ   LYS  48          2HZ       LYS  48   3.784   0.483  11.322
  376   3HZ   LYS  48          3HZ       LYS  48   3.557  -0.114  12.896
  377    H    THR  49           H        THR  49   1.313  -3.879   5.050
  378    HA   THR  49           HA       THR  49   3.699  -3.546   3.297
  379    HB   THR  49           HB       THR  49   4.113  -5.613   4.540
  380    HG1  THR  49           HG1      THR  49   3.972  -5.366   1.948
  381   1HG2  THR  49          1HG2      THR  49   1.777  -6.107   5.146
  382   2HG2  THR  49          2HG2      THR  49   1.422  -6.491   3.463
  383   3HG2  THR  49          3HG2      THR  49   2.540  -7.499   4.376
  384    H    VAL  50           H        VAL  50   3.240  -3.794   1.075
  385    HA   VAL  50           HA       VAL  50   0.538  -3.178   0.274
  386    HB   VAL  50           HB       VAL  50   2.493  -2.378  -0.974
  387   1HG1  VAL  50          1HG1      VAL  50   3.824  -4.498  -0.620
  388   2HG1  VAL  50          2HG1      VAL  50   2.836  -5.244  -1.877
  389   3HG1  VAL  50          3HG1      VAL  50   3.873  -3.872  -2.268
  390   1HG2  VAL  50          1HG2      VAL  50   0.246  -2.742  -2.086
  391   2HG2  VAL  50          2HG2      VAL  50   1.623  -2.758  -3.188
  392   3HG2  VAL  50          3HG2      VAL  50   0.875  -4.275  -2.689
  393    H    GLU  51           H        GLU  51   2.371  -6.184   0.444
  394    HA   GLU  51           HA       GLU  51   0.763  -7.729  -1.321
  395   1HB   GLU  51          1HB       GLU  51   2.877  -8.573  -0.324
  396   2HB   GLU  51          2HB       GLU  51   2.095  -8.633   1.257
  397   1HG   GLU  51          1HG       GLU  51   0.446 -10.249   0.393
  398   2HG   GLU  51          2HG       GLU  51   1.206 -10.180  -1.197
  399    H    GLY  52           H        GLY  52   0.370  -6.866   2.078
  400   1HA   GLY  52          1HA       GLY  52  -1.462  -7.146   3.526
  401   2HA   GLY  52          2HA       GLY  52  -2.074  -8.386   2.428
  402    H    VAL  53           H        VAL  53  -1.268  -5.126   1.314
  403    HA   VAL  53           HA       VAL  53  -3.838  -3.938   1.640
  404    HB   VAL  53           HB       VAL  53  -1.680  -3.463  -0.438
  405   1HG1  VAL  53          1HG1      VAL  53  -4.250  -1.968   0.128
  406   2HG1  VAL  53          2HG1      VAL  53  -2.888  -1.240  -0.722
  407   3HG1  VAL  53          3HG1      VAL  53  -3.711  -2.638  -1.412
  408   1HG2  VAL  53          1HG2      VAL  53  -1.213  -3.011   2.017
  409   2HG2  VAL  53          2HG2      VAL  53  -1.059  -1.605   0.964
  410   3HG2  VAL  53          3HG2      VAL  53  -2.498  -1.807   1.964
  411    H    LYS  54           H        LYS  54  -2.478  -5.669  -1.197
  412    HA   LYS  54           HA       LYS  54  -4.825  -5.507  -2.808
  413   1HB   LYS  54          1HB       LYS  54  -2.526  -6.218  -3.579
  414   2HB   LYS  54          2HB       LYS  54  -2.818  -7.777  -2.808
  415   1HG   LYS  54          1HG       LYS  54  -4.887  -8.021  -4.201
  416   2HG   LYS  54          2HG       LYS  54  -4.452  -6.538  -5.044
  417   1HD   LYS  54          1HD       LYS  54  -2.741  -9.042  -4.903
  418   2HD   LYS  54          2HD       LYS  54  -3.708  -8.550  -6.291
  419   1HE   LYS  54          1HE       LYS  54  -1.210  -7.284  -5.186
  420   2HE   LYS  54          2HE       LYS  54  -1.579  -7.741  -6.847
  421   1HZ   LYS  54          1HZ       LYS  54  -3.463  -5.975  -6.523
  422   2HZ   LYS  54          2HZ       LYS  54  -2.403  -5.368  -5.342
  423   3HZ   LYS  54          3HZ       LYS  54  -1.891  -5.504  -6.957
  424    H    ALA  55           H        ALA  55  -3.765  -8.039  -0.529
  425    HA   ALA  55           HA       ALA  55  -6.033  -9.757  -0.993
  426   1HB   ALA  55          1HB       ALA  55  -4.389  -9.635   1.539
  427   2HB   ALA  55          2HB       ALA  55  -5.233 -11.028   0.861
  428   3HB   ALA  55          3HB       ALA  55  -3.796 -10.392   0.061
  429    H    LEU  56           H        LEU  56  -5.404  -7.129   1.255
  430    HA   LEU  56           HA       LEU  56  -7.562  -7.563   3.033
  431   1HB   LEU  56          1HB       LEU  56  -5.775  -5.981   3.539
  432   2HB   LEU  56          2HB       LEU  56  -6.238  -4.975   2.169
  433    HG   LEU  56           HG       LEU  56  -8.396  -4.488   3.212
  434   1HD1  LEU  56          1HD1      LEU  56  -7.445  -6.529   5.220
  435   2HD1  LEU  56          2HD1      LEU  56  -8.585  -5.274   5.707
  436   3HD1  LEU  56          3HD1      LEU  56  -9.016  -6.404   4.425
  437   1HD2  LEU  56          1HD2      LEU  56  -6.373  -3.134   3.805
  438   2HD2  LEU  56          2HD2      LEU  56  -7.592  -3.154   5.080
  439   3HD2  LEU  56          3HD2      LEU  56  -6.151  -4.159   5.222
  440    H    ILE  57           H        ILE  57  -7.420  -5.511   0.104
  441    HA   ILE  57           HA       ILE  57 -10.188  -4.750   0.227
  442    HB   ILE  57           HB       ILE  57  -8.482  -5.027  -2.265
  443   1HG1  ILE  57          1HG1      ILE  57  -7.236  -3.666  -0.699
  444   2HG1  ILE  57          2HG1      ILE  57  -7.981  -2.579  -1.865
  445   1HG2  ILE  57          1HG2      ILE  57 -10.998  -4.616  -2.451
  446   2HG2  ILE  57          2HG2      ILE  57 -10.703  -3.057  -1.688
  447   3HG2  ILE  57          3HG2      ILE  57  -9.964  -3.431  -3.243
  448   1HD1  ILE  57          1HD1      ILE  57  -9.931  -2.453  -0.128
  449   2HD1  ILE  57          2HD1      ILE  57  -8.732  -3.068   1.008
  450   3HD1  ILE  57          3HD1      ILE  57  -8.458  -1.537   0.177
  451    H    ASP  58           H        ASP  58  -8.458  -7.437  -1.323
  452    HA   ASP  58           HA       ASP  58 -10.681  -8.491  -2.777
  453   1HB   ASP  58          1HB       ASP  58  -8.273  -9.858  -1.560
  454   2HB   ASP  58          2HB       ASP  58  -9.429 -10.685  -2.601
  455    H    GLU  59           H        GLU  59  -9.625  -9.031   0.575
  456    HA   GLU  59           HA       GLU  59 -11.634 -11.031   1.125
  457   1HB   GLU  59          1HB       GLU  59  -9.843  -9.303   2.831
  458   2HB   GLU  59          2HB       GLU  59 -11.099 -10.293   3.571
  459   1HG   GLU  59          1HG       GLU  59  -8.801 -11.382   3.407
  460   2HG   GLU  59          2HG       GLU  59 -10.133 -12.317   2.734
  461    H    ILE  60           H        ILE  60 -11.433  -7.520   1.522
  462    HA   ILE  60           HA       ILE  60 -13.946  -7.242   2.869
  463    HB   ILE  60           HB       ILE  60 -12.352  -5.295   1.183
  464   1HG1  ILE  60          1HG1      ILE  60 -12.701  -5.427   4.188
  465   2HG1  ILE  60          2HG1      ILE  60 -11.381  -6.245   3.350
  466   1HG2  ILE  60          1HG2      ILE  60 -14.813  -4.914   2.907
  467   2HG2  ILE  60          2HG2      ILE  60 -13.750  -3.582   2.447
  468   3HG2  ILE  60          3HG2      ILE  60 -14.614  -4.491   1.206
  469   1HD1  ILE  60          1HD1      ILE  60 -11.965  -3.282   3.102
  470   2HD1  ILE  60          2HD1      ILE  60 -10.764  -3.962   4.200
  471   3HD1  ILE  60          3HD1      ILE  60 -10.569  -4.142   2.456
  472    H    LEU  61           H        LEU  61 -13.025  -6.932  -0.563
  473    HA   LEU  61           HA       LEU  61 -15.729  -6.456  -1.466
  474   1HB   LEU  61          1HB       LEU  61 -13.227  -7.366  -2.912
  475   2HB   LEU  61          2HB       LEU  61 -14.757  -7.063  -3.735
  476    HG   LEU  61           HG       LEU  61 -13.284  -5.025  -2.034
  477   1HD1  LEU  61          1HD1      LEU  61 -12.113  -5.734  -4.171
  478   2HD1  LEU  61          2HD1      LEU  61 -13.518  -5.133  -5.053
  479   3HD1  LEU  61          3HD1      LEU  61 -12.539  -4.024  -4.094
  480   1HD2  LEU  61          1HD2      LEU  61 -15.865  -5.018  -3.586
  481   2HD2  LEU  61          2HD2      LEU  61 -15.483  -4.247  -2.047
  482   3HD2  LEU  61          3HD2      LEU  61 -14.910  -3.536  -3.554
  483    H    ALA  62           H        ALA  62 -13.818  -9.317  -0.848
  484    HA   ALA  62           HA       ALA  62 -15.706 -11.107  -2.190
  485   1HB   ALA  62          1HB       ALA  62 -13.353 -11.748  -2.070
  486   2HB   ALA  62          2HB       ALA  62 -13.390 -11.655  -0.310
  487   3HB   ALA  62          3HB       ALA  62 -14.316 -12.900  -1.146
  488    H    ALA  63           H        ALA  63 -15.618  -9.468   0.778
  489    HA   ALA  63           HA       ALA  63 -17.895 -11.085   1.768
  490   1HB   ALA  63          1HB       ALA  63 -15.506 -10.516   3.543
  491   2HB   ALA  63          2HB       ALA  63 -16.928 -11.481   3.940
  492   3HB   ALA  63          3HB       ALA  63 -15.772 -12.064   2.742
  493    H    LEU  64           H        LEU  64 -18.640  -8.820   0.945
  494    HA   LEU  64           HA       LEU  64 -18.037  -6.493   2.516
  495   1HB   LEU  64          1HB       LEU  64 -20.427  -7.197   0.782
  496   2HB   LEU  64          2HB       LEU  64 -20.224  -5.623   1.534
  497    HG   LEU  64           HG       LEU  64 -17.853  -5.672   0.363
  498   1HD1  LEU  64          1HD1      LEU  64 -19.457  -7.669  -1.263
  499   2HD1  LEU  64          2HD1      LEU  64 -18.007  -6.859  -1.848
  500   3HD1  LEU  64          3HD1      LEU  64 -17.910  -7.945  -0.466
  501   1HD2  LEU  64          1HD2      LEU  64 -20.496  -5.207  -1.041
  502   2HD2  LEU  64          2HD2      LEU  64 -19.483  -4.012  -0.228
  503   3HD2  LEU  64          3HD2      LEU  64 -18.943  -4.746  -1.739
  504    HA   PRO  65           HA       PRO  65 -20.404  -7.375   6.197
  505   1HB   PRO  65          1HB       PRO  65 -21.477  -4.773   6.613
  506   2HB   PRO  65          2HB       PRO  65 -19.961  -5.406   7.262
  507   1HG   PRO  65          1HG       PRO  65 -20.390  -3.520   5.026
  508   2HG   PRO  65          2HG       PRO  65 -18.944  -3.779   6.011
  509   1HD   PRO  65          1HD       PRO  65 -19.246  -4.620   3.357
  510   2HD   PRO  65          2HD       PRO  65 -18.052  -5.278   4.501

  No H/Q in entry =         510
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1  22.708  -7.957  16.964
    2    H2   MET   1           H2       MET   1  23.653  -7.322  15.705
    3    H3   MET   1           H3       MET   1  22.053  -7.811  15.403
    4    HA   MET   1           HA       MET   1  22.955  -9.705  14.686
    5   1HB   MET   1          1HB       MET   1  25.278 -10.378  15.311
    6   2HB   MET   1          2HB       MET   1  25.190  -8.750  14.640
    7   1HG   MET   1          1HG       MET   1  25.225  -7.791  16.905
    8   2HG   MET   1          2HG       MET   1  25.252  -9.410  17.600
    9   1HE   MET   1          1HE       MET   1  26.961  -6.606  15.832
   10   2HE   MET   1          2HE       MET   1  28.596  -7.140  15.457
   11   3HE   MET   1          3HE       MET   1  27.234  -7.714  14.492
   12    H    LYS   2           H        LYS   2  23.015  -8.922  18.100
   13    HA   LYS   2           HA       LYS   2  23.208 -11.553  19.167
   14   1HB   LYS   2          1HB       LYS   2  23.302  -9.426  20.494
   15   2HB   LYS   2          2HB       LYS   2  21.564  -9.247  20.257
   16   1HG   LYS   2          1HG       LYS   2  21.258 -11.511  21.320
   17   2HG   LYS   2          2HG       LYS   2  22.980 -11.505  21.698
   18   1HD   LYS   2          1HD       LYS   2  20.978  -9.417  22.607
   19   2HD   LYS   2          2HD       LYS   2  21.633 -10.708  23.614
   20   1HE   LYS   2          1HE       LYS   2  23.961  -9.726  22.923
   21   2HE   LYS   2          2HE       LYS   2  23.033  -8.285  22.505
   22   1HZ   LYS   2          1HZ       LYS   2  22.011  -8.808  24.880
   23   2HZ   LYS   2          2HZ       LYS   2  23.558  -9.464  25.112
   24   3HZ   LYS   2          3HZ       LYS   2  23.386  -7.832  24.670
   25    H    ALA   3           H        ALA   3  20.394  -9.687  18.036
   26    HA   ALA   3           HA       ALA   3  18.927 -12.225  17.628
   27   1HB   ALA   3          1HB       ALA   3  17.969 -10.003  19.455
   28   2HB   ALA   3          2HB       ALA   3  18.251 -11.690  19.885
   29   3HB   ALA   3          3HB       ALA   3  16.911 -11.263  18.819
   30    H    ILE   4           H        ILE   4  20.034  -9.652  16.235
   31    HA   ILE   4           HA       ILE   4  17.523  -8.814  14.831
   32    HB   ILE   4           HB       ILE   4  20.266  -7.533  14.725
   33   1HG1  ILE   4          1HG1      ILE   4  19.471  -7.455  17.030
   34   2HG1  ILE   4          2HG1      ILE   4  19.294  -5.857  16.311
   35   1HG2  ILE   4          1HG2      ILE   4  17.492  -6.601  13.934
   36   2HG2  ILE   4          2HG2      ILE   4  18.928  -5.579  13.926
   37   3HG2  ILE   4          3HG2      ILE   4  18.829  -6.968  12.843
   38   1HD1  ILE   4          1HD1      ILE   4  16.866  -6.636  15.736
   39   2HD1  ILE   4          2HD1      ILE   4  17.155  -7.882  16.949
   40   3HD1  ILE   4          3HD1      ILE   4  17.234  -6.180  17.397
   41    H    PHE   5           H        PHE   5  17.327  -9.174  12.615
   42    HA   PHE   5           HA       PHE   5  18.610 -11.301  11.356
   43   1HB   PHE   5          1HB       PHE   5  17.543  -8.784  10.036
   44   2HB   PHE   5          2HB       PHE   5  17.875 -10.303   9.202
   45    HD1  PHE   5           HD1      PHE   5  16.493 -12.297   9.603
   46    HD2  PHE   5           HD2      PHE   5  15.655  -8.564  11.556
   47    HE1  PHE   5           HE1      PHE   5  14.256 -13.143  10.262
   48    HE2  PHE   5           HE2      PHE   5  13.420  -9.411  12.215
   49    HZ   PHE   5           HZ       PHE   5  12.720 -11.700  11.568
   50    H    VAL   6           H        VAL   6  20.321 -11.394   9.733
   51    HA   VAL   6           HA       VAL   6  22.683 -10.003  10.489
   52    HB   VAL   6           HB       VAL   6  21.990 -11.466   7.925
   53   1HG1  VAL   6          1HG1      VAL   6  24.610 -10.316   8.917
   54   2HG1  VAL   6          2HG1      VAL   6  24.522 -11.573   7.682
   55   3HG1  VAL   6          3HG1      VAL   6  23.807  -9.989   7.381
   56   1HG2  VAL   6          1HG2      VAL   6  22.038 -12.719  10.134
   57   2HG2  VAL   6          2HG2      VAL   6  23.179 -13.306   8.926
   58   3HG2  VAL   6          3HG2      VAL   6  23.746 -12.293  10.253
   59    H    LEU   7           H        LEU   7  20.341  -9.351   7.890
   60    HA   LEU   7           HA       LEU   7  21.867  -7.083   6.869
   61   1HB   LEU   7          1HB       LEU   7  19.090  -8.174   6.383
   62   2HB   LEU   7          2HB       LEU   7  19.575  -6.620   5.710
   63    HG   LEU   7           HG       LEU   7  21.578  -7.778   4.686
   64   1HD1  LEU   7          1HD1      LEU   7  20.099 -10.180   5.782
   65   2HD1  LEU   7          2HD1      LEU   7  21.217 -10.312   4.427
   66   3HD1  LEU   7          3HD1      LEU   7  21.796  -9.754   5.997
   67   1HD2  LEU   7          1HD2      LEU   7  18.817  -8.762   3.901
   68   2HD2  LEU   7          2HD2      LEU   7  19.588  -7.274   3.348
   69   3HD2  LEU   7          3HD2      LEU   7  20.248  -8.839   2.872
   70    H    ASN   8           H        ASN   8  21.799  -5.018   7.632
   71    HA   ASN   8           HA       ASN   8  20.541  -4.374  10.099
   72   1HB   ASN   8          1HB       ASN   8  22.474  -3.129   9.209
   73   2HB   ASN   8          2HB       ASN   8  21.467  -2.492   7.909
   74   2HD2  ASN   8          2HD2      ASN   8  22.068  -0.316   8.927
   75   1HD2  ASN   8          1HD2      ASN   8  21.140   0.232  10.239
   76    H    ALA   9           H        ALA   9  19.523  -3.724   6.741
   77    HA   ALA   9           HA       ALA   9  17.080  -2.376   7.646
   78   1HB   ALA   9          1HB       ALA   9  16.500  -2.446   5.188
   79   2HB   ALA   9          2HB       ALA   9  18.025  -3.289   4.912
   80   3HB   ALA   9          3HB       ALA   9  18.029  -1.643   5.545
   81    H    GLN  10           H        GLN  10  14.970  -3.269   7.542
   82    HA   GLN  10           HA       GLN  10  14.793  -6.099   8.053
   83   1HB   GLN  10          1HB       GLN  10  12.335  -5.710   8.017
   84   2HB   GLN  10          2HB       GLN  10  13.175  -4.528   9.020
   85   1HG   GLN  10          1HG       GLN  10  13.152  -2.927   7.124
   86   2HG   GLN  10          2HG       GLN  10  12.261  -4.104   6.158
   87   2HE2  GLN  10          2HE2      GLN  10  11.106  -1.569   6.728
   88   1HE2  GLN  10          1HE2      GLN  10   9.795  -1.788   7.785
   89    H    HIS  11           H        HIS  11  14.399  -4.109   5.191
   90    HA   HIS  11           HA       HIS  11  14.269  -6.581   3.543
   91   1HB   HIS  11          1HB       HIS  11  11.925  -5.892   3.830
   92   2HB   HIS  11          2HB       HIS  11  12.326  -4.259   3.298
   93    HD1  HIS  11           HD1      HIS  11  12.821  -7.795   1.917
   94    HD2  HIS  11           HD2      HIS  11  11.817  -3.965   0.610
   95    HE1  HIS  11           HE1      HIS  11  12.394  -7.976  -0.573
   96    H    ASP  12           H        ASP  12  13.477  -3.572   2.063
   97    HA   ASP  12           HA       ASP  12  15.875  -3.611   0.445
   98   1HB   ASP  12          1HB       ASP  12  13.612  -2.683  -0.248
   99   2HB   ASP  12          2HB       ASP  12  13.955  -1.295   0.784
  100    H    GLU  13           H        GLU  13  17.590  -2.036   0.452
  101    HA   GLU  13           HA       GLU  13  18.592  -1.336   3.025
  102   1HB   GLU  13          1HB       GLU  13  19.259  -0.279   0.261
  103   2HB   GLU  13          2HB       GLU  13  20.167   0.154   1.711
  104   1HG   GLU  13          1HG       GLU  13  21.329  -1.690   0.700
  105   2HG   GLU  13          2HG       GLU  13  20.496  -2.333   2.115
  106    H    ALA  14           H        ALA  14  16.785   0.537   0.616
  107    HA   ALA  14           HA       ALA  14  16.548   2.797   2.576
  108   1HB   ALA  14          1HB       ALA  14  17.454   3.578   0.497
  109   2HB   ALA  14          2HB       ALA  14  16.275   2.660  -0.437
  110   3HB   ALA  14          3HB       ALA  14  15.756   4.059   0.504
  111    H    VAL  15           H        VAL  15  14.451   3.531   3.122
  112    HA   VAL  15           HA       VAL  15  12.305   1.549   2.659
  113    HB   VAL  15           HB       VAL  15  11.046   2.848   4.328
  114   1HG1  VAL  15          1HG1      VAL  15  12.648   1.134   5.086
  115   2HG1  VAL  15          2HG1      VAL  15  13.931   2.343   5.121
  116   3HG1  VAL  15          3HG1      VAL  15  12.569   2.469   6.235
  117   1HG2  VAL  15          1HG2      VAL  15  13.362   4.757   3.981
  118   2HG2  VAL  15          2HG2      VAL  15  11.634   5.106   3.981
  119   3HG2  VAL  15          3HG2      VAL  15  12.454   4.718   5.492
  120    H    ASP  16           H        ASP  16  10.933   1.786   0.995
  121    HA   ASP  16           HA       ASP  16  10.785   4.342  -0.461
  122   1HB   ASP  16          1HB       ASP  16   9.393   3.099  -2.050
  123   2HB   ASP  16          2HB       ASP  16  10.845   2.169  -1.676
  124    H    ALA  17           H        ALA  17   8.490   5.096  -1.093
  125    HA   ALA  17           HA       ALA  17   6.436   4.568   0.974
  126   1HB   ALA  17          1HB       ALA  17   7.670   6.384   2.003
  127   2HB   ALA  17          2HB       ALA  17   7.660   7.301   0.497
  128   3HB   ALA  17          3HB       ALA  17   6.155   7.035   1.377
  129    H    ASN  18           H        ASN  18   7.406   6.171  -2.025
  130    HA   ASN  18           HA       ASN  18   4.829   7.078  -2.832
  131   1HB   ASN  18          1HB       ASN  18   7.247   6.198  -4.424
  132   2HB   ASN  18          2HB       ASN  18   5.804   6.884  -5.172
  133   2HD2  ASN  18          2HD2      ASN  18   5.152   8.859  -3.211
  134   1HD2  ASN  18          1HD2      ASN  18   6.385  10.026  -3.190
  135    H    SER  19           H        SER  19   6.436   3.928  -3.279
  136    HA   SER  19           HA       SER  19   4.323   2.823  -4.913
  137   1HB   SER  19          1HB       SER  19   5.414   0.688  -4.528
  138   2HB   SER  19          2HB       SER  19   6.657   1.910  -4.779
  139    HG   SER  19           HG       SER  19   7.327   1.562  -2.823
  140    H    LEU  20           H        LEU  20   5.027   2.771  -1.425
  141    HA   LEU  20           HA       LEU  20   2.825   1.043  -0.732
  142   1HB   LEU  20          1HB       LEU  20   4.523   3.017   0.796
  143   2HB   LEU  20          2HB       LEU  20   3.156   2.225   1.573
  144    HG   LEU  20           HG       LEU  20   5.348   1.047   1.920
  145   1HD1  LEU  20          1HD1      LEU  20   2.922  -0.074   1.648
  146   2HD1  LEU  20          2HD1      LEU  20   3.712  -0.843   0.274
  147   3HD1  LEU  20          3HD1      LEU  20   4.374  -1.042   1.892
  148   1HD2  LEU  20          1HD2      LEU  20   6.189   1.616  -0.410
  149   2HD2  LEU  20          2HD2      LEU  20   6.449  -0.053   0.095
  150   3HD2  LEU  20          3HD2      LEU  20   5.138   0.335  -1.015
  151    H    ALA  21           H        ALA  21   3.206   4.567  -0.935
  152    HA   ALA  21           HA       ALA  21   0.578   5.179   0.027
  153   1HB   ALA  21          1HB       ALA  21   2.414   6.799  -1.757
  154   2HB   ALA  21          2HB       ALA  21   2.400   6.839   0.005
  155   3HB   ALA  21          3HB       ALA  21   1.005   7.425  -0.902
  156    H    GLU  22           H        GLU  22   1.922   4.838  -3.275
  157    HA   GLU  22           HA       GLU  22  -0.468   5.542  -4.652
  158   1HB   GLU  22          1HB       GLU  22   1.716   5.301  -5.786
  159   2HB   GLU  22          2HB       GLU  22   1.666   3.562  -5.500
  160   1HG   GLU  22          1HG       GLU  22  -0.369   3.372  -6.856
  161   2HG   GLU  22          2HG       GLU  22  -0.384   5.117  -7.105
  162    H    ALA  23           H        ALA  23   0.705   2.341  -3.578
  163    HA   ALA  23           HA       ALA  23  -1.518   0.850  -4.557
  164   1HB   ALA  23          1HB       ALA  23  -0.893  -0.769  -2.688
  165   2HB   ALA  23          2HB       ALA  23   0.412  -0.359  -3.798
  166   3HB   ALA  23          3HB       ALA  23   0.341   0.399  -2.208
  167    H    LYS  24           H        LYS  24  -0.937   2.356  -1.385
  168    HA   LYS  24           HA       LYS  24  -3.500   1.646  -0.287
  169   1HB   LYS  24          1HB       LYS  24  -1.496   3.806   0.421
  170   2HB   LYS  24          2HB       LYS  24  -2.953   3.490   1.366
  171   1HG   LYS  24          1HG       LYS  24  -2.226   1.155   1.711
  172   2HG   LYS  24          2HG       LYS  24  -0.768   1.470   0.771
  173   1HD   LYS  24          1HD       LYS  24  -0.090   3.201   2.397
  174   2HD   LYS  24          2HD       LYS  24  -1.545   2.878   3.339
  175   1HE   LYS  24          1HE       LYS  24  -0.827   0.644   3.845
  176   2HE   LYS  24          2HE       LYS  24   0.506   0.750   2.694
  177   1HZ   LYS  24          1HZ       LYS  24   0.589   2.880   4.577
  178   2HZ   LYS  24          2HZ       LYS  24   0.593   1.375   5.365
  179   3HZ   LYS  24          3HZ       LYS  24   1.779   1.725   4.205
  180    H    VAL  25           H        VAL  25  -2.279   4.516  -2.008
  181    HA   VAL  25           HA       VAL  25  -4.687   6.049  -1.699
  182    HB   VAL  25           HB       VAL  25  -2.456   6.195  -3.727
  183   1HG1  VAL  25          1HG1      VAL  25  -4.903   7.927  -3.366
  184   2HG1  VAL  25          2HG1      VAL  25  -3.440   8.522  -4.151
  185   3HG1  VAL  25          3HG1      VAL  25  -4.321   7.162  -4.845
  186   1HG2  VAL  25          1HG2      VAL  25  -2.218   6.781  -1.157
  187   2HG2  VAL  25          2HG2      VAL  25  -1.544   7.871  -2.365
  188   3HG2  VAL  25          3HG2      VAL  25  -3.092   8.242  -1.609
  189    H    LEU  26           H        LEU  26  -3.512   3.996  -4.398
  190    HA   LEU  26           HA       LEU  26  -5.810   4.362  -6.048
  191   1HB   LEU  26          1HB       LEU  26  -3.883   2.034  -5.806
  192   2HB   LEU  26          2HB       LEU  26  -5.137   2.123  -7.041
  193    HG   LEU  26           HG       LEU  26  -2.941   4.178  -6.633
  194   1HD1  LEU  26          1HD1      LEU  26  -2.177   1.936  -7.464
  195   2HD1  LEU  26          2HD1      LEU  26  -3.276   2.116  -8.832
  196   3HD1  LEU  26          3HD1      LEU  26  -1.928   3.236  -8.629
  197   1HD2  LEU  26          1HD2      LEU  26  -5.335   3.999  -8.442
  198   2HD2  LEU  26          2HD2      LEU  26  -4.586   5.416  -7.708
  199   3HD2  LEU  26          3HD2      LEU  26  -3.848   4.667  -9.118
  200    H    ALA  27           H        ALA  27  -5.131   2.013  -3.472
  201    HA   ALA  27           HA       ALA  27  -7.609   0.563  -3.815
  202   1HB   ALA  27          1HB       ALA  27  -5.871  -0.569  -2.630
  203   2HB   ALA  27          2HB       ALA  27  -5.633   0.792  -1.534
  204   3HB   ALA  27          3HB       ALA  27  -7.092  -0.191  -1.416
  205    H    ASN  28           H        ASN  28  -6.584   3.311  -1.851
  206    HA   ASN  28           HA       ASN  28  -8.878   3.533  -0.192
  207   1HB   ASN  28          1HB       ASN  28  -6.760   4.813   0.117
  208   2HB   ASN  28          2HB       ASN  28  -7.168   5.779  -1.302
  209   2HD2  ASN  28          2HD2      ASN  28  -8.047   5.131   2.067
  210   1HD2  ASN  28          1HD2      ASN  28  -9.082   6.467   2.237
  211    H    ARG  29           H        ARG  29  -8.249   4.808  -3.461
  212    HA   ARG  29           HA       ARG  29 -10.587   6.410  -3.689
  213   1HB   ARG  29          1HB       ARG  29  -8.997   4.907  -5.778
  214   2HB   ARG  29          2HB       ARG  29 -10.312   6.013  -6.175
  215   1HG   ARG  29          1HG       ARG  29  -9.141   7.829  -4.992
  216   2HG   ARG  29          2HG       ARG  29  -7.819   6.731  -4.602
  217   1HD   ARG  29          1HD       ARG  29  -7.426   6.367  -7.014
  218   2HD   ARG  29          2HD       ARG  29  -8.724   7.488  -7.405
  219    HE   ARG  29           HE       ARG  29  -5.989   8.144  -6.736
  220   1HH1  ARG  29          1HH1      ARG  29  -5.366  10.189  -6.071
  221   2HH1  ARG  29          2HH1      ARG  29  -6.572  11.338  -5.596
  222   1HH2  ARG  29          1HH2      ARG  29  -9.231   9.196  -6.167
  223   2HH2  ARG  29          2HH2      ARG  29  -8.752  10.777  -5.650
  224    H    GLU  30           H        GLU  30 -10.116   2.932  -4.357
  225    HA   GLU  30           HA       GLU  30 -12.689   2.470  -5.495
  226   1HB   GLU  30          1HB       GLU  30 -10.885   0.660  -3.867
  227   2HB   GLU  30          2HB       GLU  30 -12.363   0.103  -4.653
  228   1HG   GLU  30          1HG       GLU  30 -10.125   1.507  -6.130
  229   2HG   GLU  30          2HG       GLU  30 -10.257  -0.248  -6.006
  230    H    LEU  31           H        LEU  31 -11.616   2.208  -2.095
  231    HA   LEU  31           HA       LEU  31 -14.167   1.511  -1.026
  232   1HB   LEU  31          1HB       LEU  31 -12.142   3.256   0.401
  233   2HB   LEU  31          2HB       LEU  31 -13.278   2.105   1.109
  234    HG   LEU  31           HG       LEU  31 -10.886   1.471  -0.623
  235   1HD1  LEU  31          1HD1      LEU  31 -11.576   0.989   2.285
  236   2HD1  LEU  31          2HD1      LEU  31 -10.259   0.150   1.466
  237   3HD1  LEU  31          3HD1      LEU  31 -10.216   1.905   1.638
  238   1HD2  LEU  31          1HD2      LEU  31 -13.184  -0.236   0.360
  239   2HD2  LEU  31          2HD2      LEU  31 -12.516  -0.129  -1.269
  240   3HD2  LEU  31          3HD2      LEU  31 -11.613  -0.946   0.002
  241    H    ASP  32           H        ASP  32 -12.584   4.638  -1.503
  242    HA   ASP  32           HA       ASP  32 -14.670   6.290  -0.499
  243   1HB   ASP  32          1HB       ASP  32 -12.380   7.083  -1.037
  244   2HB   ASP  32          2HB       ASP  32 -12.701   6.818  -2.747
  245    H    LYS  33           H        LYS  33 -14.010   4.969  -3.721
  246    HA   LYS  33           HA       LYS  33 -16.169   6.206  -5.101
  247   1HB   LYS  33          1HB       LYS  33 -14.312   5.035  -6.224
  248   2HB   LYS  33          2HB       LYS  33 -14.874   3.503  -5.569
  249   1HG   LYS  33          1HG       LYS  33 -16.891   5.109  -7.097
  250   2HG   LYS  33          2HG       LYS  33 -15.581   4.410  -8.041
  251   1HD   LYS  33          1HD       LYS  33 -16.141   2.174  -6.904
  252   2HD   LYS  33          2HD       LYS  33 -17.615   2.955  -6.333
  253   1HE   LYS  33          1HE       LYS  33 -16.757   2.753  -9.228
  254   2HE   LYS  33          2HE       LYS  33 -17.978   1.740  -8.459
  255   1HZ   LYS  33          1HZ       LYS  33 -19.057   3.960  -7.831
  256   2HZ   LYS  33          2HZ       LYS  33 -18.075   4.629  -9.045
  257   3HZ   LYS  33          3HZ       LYS  33 -19.208   3.425  -9.433
  258    H    TYR  34           H        TYR  34 -15.977   3.063  -3.409
  259    HA   TYR  34           HA       TYR  34 -18.748   2.405  -3.901
  260   1HB   TYR  34          1HB       TYR  34 -16.749   1.371  -1.873
  261   2HB   TYR  34          2HB       TYR  34 -18.380   0.725  -2.036
  262    HD1  TYR  34           HD1      TYR  34 -19.062   0.215  -4.607
  263    HD2  TYR  34           HD2      TYR  34 -15.053   0.250  -3.047
  264    HE1  TYR  34           HE1      TYR  34 -18.317  -1.229  -6.477
  265    HE2  TYR  34           HE2      TYR  34 -14.315  -1.191  -4.921
  266    HH   TYR  34           HH       TYR  34 -14.919  -2.285  -6.745
  267    H    GLY  35           H        GLY  35 -17.053   4.205  -1.401
  268   1HA   GLY  35          1HA       GLY  35 -19.675   5.125  -0.360
  269   2HA   GLY  35          2HA       GLY  35 -18.109   5.860  -0.017
  270    H    VAL  36           H        VAL  36 -16.874   3.248   0.643
  271    HA   VAL  36           HA       VAL  36 -18.357   2.068   2.829
  272    HB   VAL  36           HB       VAL  36 -15.349   1.932   2.615
  273   1HG1  VAL  36          1HG1      VAL  36 -16.797   0.771   4.416
  274   2HG1  VAL  36          2HG1      VAL  36 -17.328  -0.294   3.116
  275   3HG1  VAL  36          3HG1      VAL  36 -15.621  -0.220   3.555
  276   1HG2  VAL  36          1HG2      VAL  36 -17.385   0.619   0.795
  277   2HG2  VAL  36          2HG2      VAL  36 -16.050   1.669   0.327
  278   3HG2  VAL  36          3HG2      VAL  36 -15.720   0.057   0.956
  279    H    SER  37           H        SER  37 -17.632   2.187   5.127
  280    HA   SER  37           HA       SER  37 -17.512   4.859   6.077
  281   1HB   SER  37          1HB       SER  37 -16.708   2.285   7.462
  282   2HB   SER  37          2HB       SER  37 -16.947   3.829   8.274
  283    HG   SER  37           HG       SER  37 -18.961   3.246   8.349
  284    H    ASP  38           H        ASP  38 -15.725   5.877   7.285
  285    HA   ASP  38           HA       ASP  38 -13.266   5.852   5.787
  286   1HB   ASP  38          1HB       ASP  38 -14.032   7.130   8.420
  287   2HB   ASP  38          2HB       ASP  38 -12.470   7.380   7.640
  288    H    TYR  39           H        TYR  39 -14.407   3.982   8.427
  289    HA   TYR  39           HA       TYR  39 -11.987   3.431   9.809
  290   1HB   TYR  39          1HB       TYR  39 -14.161   2.731  10.678
  291   2HB   TYR  39          2HB       TYR  39 -14.384   1.640   9.309
  292    HD1  TYR  39           HD1      TYR  39 -12.553   2.215  12.456
  293    HD2  TYR  39           HD2      TYR  39 -13.099  -0.416   9.106
  294    HE1  TYR  39           HE1      TYR  39 -11.311   0.432  13.653
  295    HE2  TYR  39           HE2      TYR  39 -11.861  -2.195  10.298
  296    HH   TYR  39           HH       TYR  39 -11.262  -2.156  13.553
  297    H    TYR  40           H        TYR  40 -13.476   1.630   7.079
  298    HA   TYR  40           HA       TYR  40 -11.404  -0.306   6.830
  299   1HB   TYR  40          1HB       TYR  40 -13.138   0.881   4.639
  300   2HB   TYR  40          2HB       TYR  40 -12.232  -0.628   4.531
  301    HD1  TYR  40           HD1      TYR  40 -15.120   1.068   6.025
  302    HD2  TYR  40           HD2      TYR  40 -12.933  -2.619   5.788
  303    HE1  TYR  40           HE1      TYR  40 -17.022  -0.122   7.070
  304    HE2  TYR  40           HE2      TYR  40 -14.838  -3.814   6.839
  305    HH   TYR  40           HH       TYR  40 -16.960  -3.651   7.517
  306    H    LYS  41           H        LYS  41 -11.759   2.924   5.377
  307    HA   LYS  41           HA       LYS  41  -9.414   2.772   3.731
  308   1HB   LYS  41          1HB       LYS  41 -11.030   5.055   4.879
  309   2HB   LYS  41          2HB       LYS  41  -9.571   5.344   3.928
  310   1HG   LYS  41          1HG       LYS  41 -10.543   4.609   1.950
  311   2HG   LYS  41          2HG       LYS  41 -11.595   3.459   2.766
  312   1HD   LYS  41          1HD       LYS  41 -12.925   5.274   1.816
  313   2HD   LYS  41          2HD       LYS  41 -13.009   5.322   3.568
  314   1HE   LYS  41          1HE       LYS  41 -12.543   7.554   3.251
  315   2HE   LYS  41          2HE       LYS  41 -10.880   7.000   3.121
  316   1HZ   LYS  41          1HZ       LYS  41 -12.273   6.693   0.671
  317   2HZ   LYS  41          2HZ       LYS  41 -12.321   8.305   1.203
  318   3HZ   LYS  41          3HZ       LYS  41 -10.830   7.527   0.989
  319    H    ASN  42           H        ASN  42 -10.030   3.865   7.032
  320    HA   ASN  42           HA       ASN  42  -7.393   4.840   7.548
  321   1HB   ASN  42          1HB       ASN  42  -9.554   3.777   9.386
  322   2HB   ASN  42          2HB       ASN  42  -8.045   4.476   9.975
  323   2HD2  ASN  42          2HD2      ASN  42 -10.647   5.670  10.484
  324   1HD2  ASN  42          1HD2      ASN  42 -10.684   7.172   9.692
  325    H    LEU  43           H        LEU  43  -8.905   1.666   7.886
  326    HA   LEU  43           HA       LEU  43  -6.789   0.356   9.244
  327   1HB   LEU  43          1HB       LEU  43  -9.031  -0.627   8.936
  328   2HB   LEU  43          2HB       LEU  43  -8.740  -0.759   7.204
  329    HG   LEU  43           HG       LEU  43  -6.859  -2.298   7.630
  330   1HD1  LEU  43          1HD1      LEU  43  -7.542  -1.651  10.497
  331   2HD1  LEU  43          2HD1      LEU  43  -6.841  -3.219  10.100
  332   3HD1  LEU  43          3HD1      LEU  43  -5.958  -1.742   9.726
  333   1HD2  LEU  43          1HD2      LEU  43  -9.462  -3.027   9.011
  334   2HD2  LEU  43          2HD2      LEU  43  -9.086  -3.251   7.303
  335   3HD2  LEU  43          3HD2      LEU  43  -8.230  -4.191   8.526
  336    H    ILE  44           H        ILE  44  -7.322   0.901   5.758
  337    HA   ILE  44           HA       ILE  44  -5.125  -0.658   4.827
  338    HB   ILE  44           HB       ILE  44  -6.448   1.828   3.705
  339   1HG1  ILE  44          1HG1      ILE  44  -7.669  -0.454   3.919
  340   2HG1  ILE  44          2HG1      ILE  44  -7.712   0.361   2.362
  341   1HG2  ILE  44          1HG2      ILE  44  -4.274   0.091   2.521
  342   2HG2  ILE  44          2HG2      ILE  44  -5.323   1.106   1.533
  343   3HG2  ILE  44          3HG2      ILE  44  -4.265   1.841   2.739
  344   1HD1  ILE  44          1HD1      ILE  44  -5.429  -1.516   2.739
  345   2HD1  ILE  44          2HD1      ILE  44  -7.024  -2.250   2.671
  346   3HD1  ILE  44          3HD1      ILE  44  -6.464  -1.251   1.339
  347    H    ASN  45           H        ASN  45  -5.323   2.725   5.900
  348    HA   ASN  45           HA       ASN  45  -2.631   3.454   5.318
  349   1HB   ASN  45          1HB       ASN  45  -4.581   4.388   7.438
  350   2HB   ASN  45          2HB       ASN  45  -2.985   5.113   7.234
  351   2HD2  ASN  45          2HD2      ASN  45  -3.812   4.150   4.176
  352   1HD2  ASN  45          1HD2      ASN  45  -4.568   5.565   3.623
  353    H    ASN  46           H        ASN  46  -4.081   1.879   8.141
  354    HA   ASN  46           HA       ASN  46  -1.766   1.844   9.799
  355   1HB   ASN  46          1HB       ASN  46  -4.019   1.262  10.618
  356   2HB   ASN  46          2HB       ASN  46  -4.010  -0.190   9.619
  357   2HD2  ASN  46          2HD2      ASN  46  -2.562   1.313  12.493
  358   1HD2  ASN  46          1HD2      ASN  46  -1.868  -0.112  13.101
  359    H    ALA  47           H        ALA  47  -2.869  -0.389   7.264
  360    HA   ALA  47           HA       ALA  47  -1.006  -2.471   7.637
  361   1HB   ALA  47          1HB       ALA  47  -2.077  -1.355   5.028
  362   2HB   ALA  47          2HB       ALA  47  -1.294  -2.923   5.215
  363   3HB   ALA  47          3HB       ALA  47  -2.838  -2.608   6.007
  364    H    LYS  48           H        LYS  48   1.173  -2.594   7.380
  365    HA   LYS  48           HA       LYS  48   2.591  -0.236   6.214
  366   1HB   LYS  48          1HB       LYS  48   4.595  -1.306   7.366
  367   2HB   LYS  48          2HB       LYS  48   3.331  -0.697   8.436
  368   1HG   LYS  48          1HG       LYS  48   2.473  -2.885   8.835
  369   2HG   LYS  48          2HG       LYS  48   3.400  -3.571   7.502
  370   1HD   LYS  48          1HD       LYS  48   4.498  -4.147   9.598
  371   2HD   LYS  48          2HD       LYS  48   5.505  -2.992   8.725
  372   1HE   LYS  48          1HE       LYS  48   4.859  -1.195  10.134
  373   2HE   LYS  48          2HE       LYS  48   3.492  -2.095  10.793
  374   1HZ   LYS  48          1HZ       LYS  48   5.983  -3.448  11.169
  375   2HZ   LYS  48          2HZ       LYS  48   5.976  -1.912  11.894
  376   3HZ   LYS  48          3HZ       LYS  48   4.786  -3.054  12.303
  377    H    THR  49           H        THR  49   1.528  -3.210   5.214
  378    HA   THR  49           HA       THR  49   3.807  -3.497   3.270
  379    HB   THR  49           HB       THR  49   3.196  -5.971   3.280
  380    HG1  THR  49           HG1      THR  49   2.107  -5.461   5.811
  381   1HG2  THR  49          1HG2      THR  49   4.417  -4.549   5.641
  382   2HG2  THR  49          2HG2      THR  49   4.324  -6.309   5.591
  383   3HG2  THR  49          3HG2      THR  49   5.223  -5.439   4.349
  384    H    VAL  50           H        VAL  50   3.198  -3.641   1.144
  385    HA   VAL  50           HA       VAL  50   0.476  -3.010   0.432
  386    HB   VAL  50           HB       VAL  50   2.349  -2.273  -0.940
  387   1HG1  VAL  50          1HG1      VAL  50   3.652  -4.463  -0.501
  388   2HG1  VAL  50          2HG1      VAL  50   2.714  -5.134  -1.836
  389   3HG1  VAL  50          3HG1      VAL  50   3.782  -3.757  -2.112
  390   1HG2  VAL  50          1HG2      VAL  50   0.031  -2.809  -1.910
  391   2HG2  VAL  50          2HG2      VAL  50   1.360  -2.694  -3.062
  392   3HG2  VAL  50          3HG2      VAL  50   0.768  -4.276  -2.554
  393    H    GLU  51           H        GLU  51   2.313  -6.011   0.624
  394    HA   GLU  51           HA       GLU  51   0.569  -7.635  -0.942
  395   1HB   GLU  51          1HB       GLU  51   2.771  -8.426  -0.107
  396   2HB   GLU  51          2HB       GLU  51   2.142  -8.407   1.541
  397   1HG   GLU  51          1HG       GLU  51   0.427 -10.070   0.911
  398   2HG   GLU  51          2HG       GLU  51   1.054 -10.090  -0.738
  399    H    GLY  52           H        GLY  52   0.496  -6.624   2.442
  400   1HA   GLY  52          1HA       GLY  52  -1.216  -6.784   4.043
  401   2HA   GLY  52          2HA       GLY  52  -1.869  -8.140   3.119
  402    H    VAL  53           H        VAL  53  -1.249  -4.915   1.777
  403    HA   VAL  53           HA       VAL  53  -3.889  -3.867   2.109
  404    HB   VAL  53           HB       VAL  53  -1.771  -3.331   0.013
  405   1HG1  VAL  53          1HG1      VAL  53  -4.428  -2.000   0.527
  406   2HG1  VAL  53          2HG1      VAL  53  -3.110  -1.175  -0.300
  407   3HG1  VAL  53          3HG1      VAL  53  -3.810  -2.637  -0.995
  408   1HG2  VAL  53          1HG2      VAL  53  -1.372  -2.791   2.491
  409   2HG2  VAL  53          2HG2      VAL  53  -1.190  -1.449   1.360
  410   3HG2  VAL  53          3HG2      VAL  53  -2.658  -1.597   2.326
  411    H    LYS  54           H        LYS  54  -2.413  -5.562  -0.684
  412    HA   LYS  54           HA       LYS  54  -4.768  -5.578  -2.285
  413   1HB   LYS  54          1HB       LYS  54  -2.528  -6.108  -3.173
  414   2HB   LYS  54          2HB       LYS  54  -2.513  -7.600  -2.231
  415   1HG   LYS  54          1HG       LYS  54  -4.377  -8.491  -3.466
  416   2HG   LYS  54          2HG       LYS  54  -4.656  -6.946  -4.265
  417   1HD   LYS  54          1HD       LYS  54  -3.472  -8.503  -5.767
  418   2HD   LYS  54          2HD       LYS  54  -2.463  -7.112  -5.377
  419   1HE   LYS  54          1HE       LYS  54  -1.401  -9.485  -5.243
  420   2HE   LYS  54          2HE       LYS  54  -1.090  -8.352  -3.928
  421   1HZ   LYS  54          1HZ       LYS  54  -3.383 -10.204  -3.817
  422   2HZ   LYS  54          2HZ       LYS  54  -1.832 -10.718  -3.352
  423   3HZ   LYS  54          3HZ       LYS  54  -2.576  -9.428  -2.539
  424    H    ALA  55           H        ALA  55  -3.544  -7.996   0.040
  425    HA   ALA  55           HA       ALA  55  -5.720  -9.838  -0.383
  426   1HB   ALA  55          1HB       ALA  55  -4.959 -10.830   1.790
  427   2HB   ALA  55          2HB       ALA  55  -3.821  -9.493   1.950
  428   3HB   ALA  55          3HB       ALA  55  -3.660 -10.633   0.614
  429    H    LEU  56           H        LEU  56  -5.171  -7.214   1.924
  430    HA   LEU  56           HA       LEU  56  -7.434  -7.665   3.576
  431   1HB   LEU  56          1HB       LEU  56  -5.669  -6.111   4.226
  432   2HB   LEU  56          2HB       LEU  56  -6.017  -5.085   2.837
  433    HG   LEU  56           HG       LEU  56  -8.235  -4.562   3.739
  434   1HD1  LEU  56          1HD1      LEU  56  -7.436  -6.603   5.818
  435   2HD1  LEU  56          2HD1      LEU  56  -8.623  -5.353   6.192
  436   3HD1  LEU  56          3HD1      LEU  56  -8.935  -6.502   4.894
  437   1HD2  LEU  56          1HD2      LEU  56  -6.111  -3.341   4.499
  438   2HD2  LEU  56          2HD2      LEU  56  -7.520  -3.171   5.546
  439   3HD2  LEU  56          3HD2      LEU  56  -6.224  -4.283   5.981
  440    H    ILE  57           H        ILE  57  -7.044  -5.567   0.724
  441    HA   ILE  57           HA       ILE  57  -9.802  -4.766   0.610
  442    HB   ILE  57           HB       ILE  57  -7.712  -4.912  -1.571
  443   1HG1  ILE  57          1HG1      ILE  57  -7.051  -3.436   0.284
  444   2HG1  ILE  57          2HG1      ILE  57  -7.458  -2.480  -1.134
  445   1HG2  ILE  57          1HG2      ILE  57 -10.440  -3.637  -1.464
  446   2HG2  ILE  57          2HG2      ILE  57  -9.205  -3.137  -2.621
  447   3HG2  ILE  57          3HG2      ILE  57  -9.814  -4.789  -2.640
  448   1HD1  ILE  57          1HD1      ILE  57  -9.875  -2.470   0.016
  449   2HD1  ILE  57          2HD1      ILE  57  -8.919  -2.751   1.464
  450   3HD1  ILE  57          3HD1      ILE  57  -8.638  -1.314   0.484
  451    H    ASP  58           H        ASP  58  -7.972  -7.417  -0.900
  452    HA   ASP  58           HA       ASP  58 -10.045  -8.297  -2.654
  453   1HB   ASP  58          1HB       ASP  58  -7.860  -9.849  -1.251
  454   2HB   ASP  58          2HB       ASP  58  -8.919 -10.555  -2.468
  455    H    GLU  59           H        GLU  59  -9.403  -9.049   0.753
  456    HA   GLU  59           HA       GLU  59 -11.543 -10.974   0.973
  457   1HB   GLU  59          1HB       GLU  59  -9.900  -9.390   2.950
  458   2HB   GLU  59          2HB       GLU  59 -11.273 -10.352   3.495
  459   1HG   GLU  59          1HG       GLU  59  -9.040 -11.549   3.572
  460   2HG   GLU  59          2HG       GLU  59 -10.294 -12.381   2.656
  461    H    ILE  60           H        ILE  60 -11.229  -7.490   1.542
  462    HA   ILE  60           HA       ILE  60 -13.901  -7.163   2.556
  463    HB   ILE  60           HB       ILE  60 -12.001  -5.173   1.292
  464   1HG1  ILE  60          1HG1      ILE  60 -12.743  -5.542   4.204
  465   2HG1  ILE  60          2HG1      ILE  60 -11.367  -6.364   3.472
  466   1HG2  ILE  60          1HG2      ILE  60 -14.658  -4.839   2.698
  467   2HG2  ILE  60          2HG2      ILE  60 -13.493  -3.523   2.553
  468   3HG2  ILE  60          3HG2      ILE  60 -14.195  -4.242   1.104
  469   1HD1  ILE  60          1HD1      ILE  60 -11.782  -3.361   3.469
  470   2HD1  ILE  60          2HD1      ILE  60 -10.712  -4.227   4.572
  471   3HD1  ILE  60          3HD1      ILE  60 -10.375  -4.220   2.841
  472    H    LEU  61           H        LEU  61 -12.461  -6.807  -0.688
  473    HA   LEU  61           HA       LEU  61 -14.830  -5.856  -1.967
  474   1HB   LEU  61          1HB       LEU  61 -12.390  -7.322  -2.980
  475   2HB   LEU  61          2HB       LEU  61 -13.734  -6.952  -4.062
  476    HG   LEU  61           HG       LEU  61 -12.211  -4.905  -2.416
  477   1HD1  LEU  61          1HD1      LEU  61 -10.907  -6.026  -4.266
  478   2HD1  LEU  61          2HD1      LEU  61 -12.114  -5.427  -5.403
  479   3HD1  LEU  61          3HD1      LEU  61 -11.123  -4.289  -4.494
  480   1HD2  LEU  61          1HD2      LEU  61 -14.602  -4.778  -4.230
  481   2HD2  LEU  61          2HD2      LEU  61 -14.214  -3.802  -2.814
  482   3HD2  LEU  61          3HD2      LEU  61 -13.433  -3.465  -4.355
  483    H    ALA  62           H        ALA  62 -13.667  -9.144  -1.322
  484    HA   ALA  62           HA       ALA  62 -15.627 -10.555  -2.809
  485   1HB   ALA  62          1HB       ALA  62 -14.211 -11.247  -0.223
  486   2HB   ALA  62          2HB       ALA  62 -15.259 -12.378  -1.079
  487   3HB   ALA  62          3HB       ALA  62 -13.791 -11.778  -1.851
  488    H    ALA  63           H        ALA  63 -15.908  -8.688   0.089
  489    HA   ALA  63           HA       ALA  63 -18.453  -9.932   0.906
  490   1HB   ALA  63          1HB       ALA  63 -18.411  -8.379   2.744
  491   2HB   ALA  63          2HB       ALA  63 -16.763  -8.972   2.536
  492   3HB   ALA  63          3HB       ALA  63 -17.205  -7.373   1.940
  493    H    LEU  64           H        LEU  64 -17.546  -7.785  -1.468
  494    HA   LEU  64           HA       LEU  64 -20.273  -6.530  -1.527
  495   1HB   LEU  64          1HB       LEU  64 -17.604  -5.266  -2.205
  496   2HB   LEU  64          2HB       LEU  64 -19.165  -4.527  -2.554
  497    HG   LEU  64           HG       LEU  64 -18.550  -5.435   0.259
  498   1HD1  LEU  64          1HD1      LEU  64 -17.598  -2.885  -1.066
  499   2HD1  LEU  64          2HD1      LEU  64 -17.733  -3.073   0.683
  500   3HD1  LEU  64          3HD1      LEU  64 -16.622  -4.092  -0.231
  501   1HD2  LEU  64          1HD2      LEU  64 -20.240  -3.224  -0.962
  502   2HD2  LEU  64          2HD2      LEU  64 -20.828  -4.701  -0.201
  503   3HD2  LEU  64          3HD2      LEU  64 -20.029  -3.467   0.770
  504    HA   PRO  65           HA       PRO  65 -19.251  -8.745  -5.495
  505   1HB   PRO  65          1HB       PRO  65 -21.776 -10.002  -5.617
  506   2HB   PRO  65          2HB       PRO  65 -20.278 -10.730  -5.027
  507   1HG   PRO  65          1HG       PRO  65 -22.625  -9.876  -3.496
  508   2HG   PRO  65          2HG       PRO  65 -21.263 -10.873  -2.975
  509   1HD   PRO  65          1HD       PRO  65 -21.764  -8.109  -2.319
  510   2HD   PRO  65          2HD       PRO  65 -20.354  -9.091  -1.851

  No H/Q in entry =         510
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1  27.715   1.394  17.305
    2    H2   MET   1           H2       MET   1  28.709   0.026  17.130
    3    H3   MET   1           H3       MET   1  27.118  -0.148  17.690
    4    HA   MET   1           HA       MET   1  27.609   0.483  19.785
    5   1HB   MET   1          1HB       MET   1  30.274  -0.359  18.612
    6   2HB   MET   1          2HB       MET   1  29.991  -0.174  20.343
    7   1HG   MET   1          1HG       MET   1  29.632  -2.486  19.886
    8   2HG   MET   1          2HG       MET   1  28.022  -1.788  20.045
    9   1HE   MET   1          1HE       MET   1  27.438  -4.143  18.932
   10   2HE   MET   1          2HE       MET   1  26.328  -2.811  18.625
   11   3HE   MET   1          3HE       MET   1  26.757  -3.909  17.317
   12    H    LYS   2           H        LYS   2  28.198   2.671  17.582
   13    HA   LYS   2           HA       LYS   2  30.348   4.277  18.544
   14   1HB   LYS   2          1HB       LYS   2  27.794   5.013  17.091
   15   2HB   LYS   2          2HB       LYS   2  29.086   6.168  17.423
   16   1HG   LYS   2          1HG       LYS   2  30.682   4.739  16.196
   17   2HG   LYS   2          2HG       LYS   2  29.389   3.587  15.860
   18   1HD   LYS   2          1HD       LYS   2  28.145   5.333  14.637
   19   2HD   LYS   2          2HD       LYS   2  29.437   6.487  14.969
   20   1HE   LYS   2          1HE       LYS   2  31.028   5.124  13.712
   21   2HE   LYS   2          2HE       LYS   2  29.798   3.888  13.449
   22   1HZ   LYS   2          1HZ       LYS   2  28.517   5.985  12.506
   23   2HZ   LYS   2          2HZ       LYS   2  30.105   6.504  12.198
   24   3HZ   LYS   2          3HZ       LYS   2  29.547   5.045  11.538
   25    H    ALA   3           H        ALA   3  26.910   4.177  19.462
   26    HA   ALA   3           HA       ALA   3  27.619   5.654  21.959
   27   1HB   ALA   3          1HB       ALA   3  26.736   7.373  20.495
   28   2HB   ALA   3          2HB       ALA   3  25.358   6.358  20.067
   29   3HB   ALA   3          3HB       ALA   3  25.511   6.992  21.705
   30    H    ILE   4           H        ILE   4  26.657   4.763  23.724
   31    HA   ILE   4           HA       ILE   4  25.251   2.292  23.554
   32    HB   ILE   4           HB       ILE   4  25.447   4.328  25.796
   33   1HG1  ILE   4          1HG1      ILE   4  26.975   2.555  26.742
   34   2HG1  ILE   4          2HG1      ILE   4  26.832   1.687  25.215
   35   1HG2  ILE   4          1HG2      ILE   4  24.206   1.568  25.721
   36   2HG2  ILE   4          2HG2      ILE   4  24.725   2.336  27.222
   37   3HG2  ILE   4          3HG2      ILE   4  23.456   3.076  26.247
   38   1HD1  ILE   4          1HD1      ILE   4  27.678   4.578  25.195
   39   2HD1  ILE   4          2HD1      ILE   4  28.853   3.327  25.595
   40   3HD1  ILE   4          3HD1      ILE   4  28.041   3.300  24.033
   41    H    PHE   5           H        PHE   5  24.108   5.635  23.937
   42    HA   PHE   5           HA       PHE   5  21.367   4.724  23.149
   43   1HB   PHE   5          1HB       PHE   5  20.381   6.254  24.796
   44   2HB   PHE   5          2HB       PHE   5  21.418   5.082  25.611
   45    HD1  PHE   5           HD1      PHE   5  23.570   5.744  26.569
   46    HD2  PHE   5           HD2      PHE   5  21.052   8.593  24.571
   47    HE1  PHE   5           HE1      PHE   5  24.923   7.598  27.509
   48    HE2  PHE   5           HE2      PHE   5  22.403  10.448  25.512
   49    HZ   PHE   5           HZ       PHE   5  24.339   9.950  26.981
   50    H    VAL   6           H        VAL   6  20.077   6.507  22.232
   51    HA   VAL   6           HA       VAL   6  21.741   8.752  21.134
   52    HB   VAL   6           HB       VAL   6  21.425   7.087  19.369
   53   1HG1  VAL   6          1HG1      VAL   6  19.371   6.062  20.431
   54   2HG1  VAL   6          2HG1      VAL   6  18.445   7.424  19.798
   55   3HG1  VAL   6          3HG1      VAL   6  19.248   6.312  18.690
   56   1HG2  VAL   6          1HG2      VAL   6  21.187   9.575  18.892
   57   2HG2  VAL   6          2HG2      VAL   6  20.429   8.508  17.710
   58   3HG2  VAL   6          3HG2      VAL   6  19.440   9.330  18.917
   59    H    LEU   7           H        LEU   7  20.816  10.727  21.412
   60    HA   LEU   7           HA       LEU   7  18.487  11.064  22.997
   61   1HB   LEU   7          1HB       LEU   7  20.203  12.822  22.761
   62   2HB   LEU   7          2HB       LEU   7  19.765  13.028  21.067
   63    HG   LEU   7           HG       LEU   7  17.491  13.726  21.724
   64   1HD1  LEU   7          1HD1      LEU   7  18.528  13.051  24.473
   65   2HD1  LEU   7          2HD1      LEU   7  17.280  14.284  24.283
   66   3HD1  LEU   7          3HD1      LEU   7  16.978  12.638  23.737
   67   1HD2  LEU   7          1HD2      LEU   7  19.764  15.178  23.106
   68   2HD2  LEU   7          2HD2      LEU   7  19.145  15.476  21.481
   69   3HD2  LEU   7          3HD2      LEU   7  18.151  15.858  22.886
   70    H    ASN   8           H        ASN   8  18.931  11.245  19.474
   71    HA   ASN   8           HA       ASN   8  15.993  11.558  19.126
   72   1HB   ASN   8          1HB       ASN   8  17.601  12.996  17.847
   73   2HB   ASN   8          2HB       ASN   8  18.185  11.544  17.033
   74   2HD2  ASN   8          2HD2      ASN   8  15.118  13.333  17.657
   75   1HD2  ASN   8          1HD2      ASN   8  14.391  12.894  16.188
   76    H    ALA   9           H        ALA   9  17.108  10.118  16.392
   77    HA   ALA   9           HA       ALA   9  17.014   7.332  17.302
   78   1HB   ALA   9          1HB       ALA   9  14.812   8.306  15.467
   79   2HB   ALA   9          2HB       ALA   9  14.944   6.739  16.262
   80   3HB   ALA   9          3HB       ALA   9  14.601   8.182  17.212
   81    H    GLN  10           H        GLN  10  18.596   6.463  16.063
   82    HA   GLN  10           HA       GLN  10  19.496   7.647  13.601
   83   1HB   GLN  10          1HB       GLN  10  20.920   5.620  13.414
   84   2HB   GLN  10          2HB       GLN  10  21.015   6.350  15.016
   85   1HG   GLN  10          1HG       GLN  10  19.251   4.710  15.776
   86   2HG   GLN  10          2HG       GLN  10  19.410   3.908  14.212
   87   2HE2  GLN  10          2HE2      GLN  10  20.072   2.400  16.462
   88   1HE2  GLN  10          1HE2      GLN  10  21.755   2.198  16.556
   89    H    HIS  11           H        HIS  11  17.415   4.843  14.299
   90    HA   HIS  11           HA       HIS  11  17.076   4.337  11.398
   91   1HB   HIS  11          1HB       HIS  11  15.566   2.475  12.266
   92   2HB   HIS  11          2HB       HIS  11  17.264   2.357  12.728
   93    HD1  HIS  11           HD1      HIS  11  16.177   0.895  14.786
   94    HD2  HIS  11           HD2      HIS  11  15.476   5.001  14.830
   95    HE1  HIS  11           HE1      HIS  11  15.449   1.472  17.144
   96    H    ASP  12           H        ASP  12  16.075   6.678  11.373
   97    HA   ASP  12           HA       ASP  12  13.506   7.166  12.511
   98   1HB   ASP  12          1HB       ASP  12  14.805   8.249   9.998
   99   2HB   ASP  12          2HB       ASP  12  13.267   8.841  10.624
  100    H    GLU  13           H        GLU  13  14.437   5.733   9.385
  101    HA   GLU  13           HA       GLU  13  11.812   4.387   9.268
  102   1HB   GLU  13          1HB       GLU  13  11.340   5.189   6.976
  103   2HB   GLU  13          2HB       GLU  13  11.363   6.519   8.130
  104   1HG   GLU  13          1HG       GLU  13  13.746   5.744   6.413
  105   2HG   GLU  13          2HG       GLU  13  12.589   6.999   5.981
  106    H    ALA  14           H        ALA  14  11.788   2.698   7.575
  107    HA   ALA  14           HA       ALA  14  14.369   2.044   6.309
  108   1HB   ALA  14          1HB       ALA  14  14.767   0.016   7.441
  109   2HB   ALA  14          2HB       ALA  14  13.136  -0.038   8.113
  110   3HB   ALA  14          3HB       ALA  14  14.309   1.121   8.737
  111    H    VAL  15           H        VAL  15  11.414   2.566   5.685
  112    HA   VAL  15           HA       VAL  15  11.024   0.159   3.935
  113    HB   VAL  15           HB       VAL  15   8.592   0.382   4.273
  114   1HG1  VAL  15          1HG1      VAL  15  10.156   0.217   6.870
  115   2HG1  VAL  15          2HG1      VAL  15   8.519  -0.392   6.621
  116   3HG1  VAL  15          3HG1      VAL  15   9.872  -1.119   5.755
  117   1HG2  VAL  15          1HG2      VAL  15   9.471   2.655   6.068
  118   2HG2  VAL  15          2HG2      VAL  15   8.307   2.702   4.744
  119   3HG2  VAL  15          3HG2      VAL  15   7.897   1.880   6.250
  120    H    ASP  16           H        ASP  16   9.789   0.672   1.956
  121    HA   ASP  16           HA       ASP  16  10.556   3.311   0.907
  122   1HB   ASP  16          1HB       ASP  16  10.803   1.248  -0.462
  123   2HB   ASP  16          2HB       ASP  16   9.052   1.037  -0.428
  124    H    ALA  17           H        ALA  17   9.220   5.037   1.091
  125    HA   ALA  17           HA       ALA  17   6.322   4.583   1.631
  126   1HB   ALA  17          1HB       ALA  17   7.427   6.041   3.218
  127   2HB   ALA  17          2HB       ALA  17   8.094   7.026   1.916
  128   3HB   ALA  17          3HB       ALA  17   6.358   7.029   2.221
  129    H    ASN  18           H        ASN  18   8.049   4.760  -1.062
  130    HA   ASN  18           HA       ASN  18   6.522   6.878  -2.455
  131   1HB   ASN  18          1HB       ASN  18   8.908   6.582  -2.985
  132   2HB   ASN  18          2HB       ASN  18   8.600   4.916  -3.474
  133   2HD2  ASN  18          2HD2      ASN  18   6.604   7.828  -4.163
  134   1HD2  ASN  18          1HD2      ASN  18   6.735   7.703  -5.852
  135    H    SER  19           H        SER  19   7.272   3.629  -3.676
  136    HA   SER  19           HA       SER  19   4.848   3.385  -5.140
  137   1HB   SER  19          1HB       SER  19   5.471   1.076  -5.467
  138   2HB   SER  19          2HB       SER  19   6.951   2.029  -5.472
  139    HG   SER  19           HG       SER  19   7.105   0.169  -4.135
  140    H    LEU  20           H        LEU  20   5.694   2.272  -1.872
  141    HA   LEU  20           HA       LEU  20   3.340   0.761  -1.368
  142   1HB   LEU  20          1HB       LEU  20   5.323   0.724   0.103
  143   2HB   LEU  20          2HB       LEU  20   5.011   2.394   0.570
  144    HG   LEU  20           HG       LEU  20   2.819   1.707   1.517
  145   1HD1  LEU  20          1HD1      LEU  20   3.691  -0.963   0.428
  146   2HD1  LEU  20          2HD1      LEU  20   2.665  -0.902   1.861
  147   3HD1  LEU  20          3HD1      LEU  20   2.107  -0.191   0.349
  148   1HD2  LEU  20          1HD2      LEU  20   5.275   0.219   2.482
  149   2HD2  LEU  20          2HD2      LEU  20   4.692   1.789   3.032
  150   3HD2  LEU  20          3HD2      LEU  20   3.777   0.328   3.408
  151    H    ALA  21           H        ALA  21   3.999   4.232  -0.966
  152    HA   ALA  21           HA       ALA  21   1.591   4.924   0.343
  153   1HB   ALA  21          1HB       ALA  21   3.355   6.498  -1.541
  154   2HB   ALA  21          2HB       ALA  21   3.363   6.540   0.221
  155   3HB   ALA  21          3HB       ALA  21   1.996   7.209  -0.671
  156    H    GLU  22           H        GLU  22   2.311   4.719  -3.150
  157    HA   GLU  22           HA       GLU  22  -0.223   5.691  -4.045
  158   1HB   GLU  22          1HB       GLU  22   1.224   3.504  -5.543
  159   2HB   GLU  22          2HB       GLU  22   0.375   4.915  -6.176
  160   1HG   GLU  22          1HG       GLU  22   3.033   4.855  -4.760
  161   2HG   GLU  22          2HG       GLU  22   2.731   5.285  -6.439
  162    H    ALA  23           H        ALA  23   0.905   2.445  -3.196
  163    HA   ALA  23           HA       ALA  23  -1.385   1.044  -4.046
  164   1HB   ALA  23          1HB       ALA  23  -0.701  -0.611  -2.193
  165   2HB   ALA  23          2HB       ALA  23   0.502  -0.262  -3.434
  166   3HB   ALA  23          3HB       ALA  23   0.618   0.509  -1.852
  167    H    LYS  24           H        LYS  24  -0.632   2.441  -0.846
  168    HA   LYS  24           HA       LYS  24  -3.149   1.729   0.346
  169   1HB   LYS  24          1HB       LYS  24  -1.185   3.951   0.989
  170   2HB   LYS  24          2HB       LYS  24  -2.557   3.515   2.008
  171   1HG   LYS  24          1HG       LYS  24  -1.665   1.223   2.234
  172   2HG   LYS  24          2HG       LYS  24  -0.290   1.661   1.218
  173   1HD   LYS  24          1HD       LYS  24   0.377   3.388   2.853
  174   2HD   LYS  24          2HD       LYS  24  -0.994   2.953   3.872
  175   1HE   LYS  24          1HE       LYS  24  -0.080   0.852   4.415
  176   2HE   LYS  24          2HE       LYS  24   1.022   0.868   3.040
  177   1HZ   LYS  24          1HZ       LYS  24   1.346   3.054   4.909
  178   2HZ   LYS  24          2HZ       LYS  24   1.725   1.518   5.532
  179   3HZ   LYS  24          3HZ       LYS  24   2.518   2.090   4.146
  180    H    VAL  25           H        VAL  25  -1.997   4.599  -1.394
  181    HA   VAL  25           HA       VAL  25  -4.412   6.119  -1.011
  182    HB   VAL  25           HB       VAL  25  -2.187   6.333  -3.040
  183   1HG1  VAL  25          1HG1      VAL  25  -4.620   8.064  -2.588
  184   2HG1  VAL  25          2HG1      VAL  25  -3.163   8.672  -3.375
  185   3HG1  VAL  25          3HG1      VAL  25  -4.069   7.343  -4.099
  186   1HG2  VAL  25          1HG2      VAL  25  -1.748   6.787  -0.573
  187   2HG2  VAL  25          2HG2      VAL  25  -1.392   8.127  -1.663
  188   3HG2  VAL  25          3HG2      VAL  25  -2.876   8.134  -0.710
  189    H    LEU  26           H        LEU  26  -3.198   4.197  -3.783
  190    HA   LEU  26           HA       LEU  26  -5.469   4.608  -5.447
  191   1HB   LEU  26          1HB       LEU  26  -3.519   2.298  -5.279
  192   2HB   LEU  26          2HB       LEU  26  -4.746   2.429  -6.533
  193    HG   LEU  26           HG       LEU  26  -2.676   4.578  -5.979
  194   1HD1  LEU  26          1HD1      LEU  26  -1.627   2.445  -6.707
  195   2HD1  LEU  26          2HD1      LEU  26  -2.667   2.440  -8.131
  196   3HD1  LEU  26          3HD1      LEU  26  -1.465   3.713  -7.921
  197   1HD2  LEU  26          1HD2      LEU  26  -4.825   4.167  -8.058
  198   2HD2  LEU  26          2HD2      LEU  26  -4.389   5.634  -7.184
  199   3HD2  LEU  26          3HD2      LEU  26  -3.364   5.054  -8.490
  200    H    ALA  27           H        ALA  27  -4.845   2.146  -2.962
  201    HA   ALA  27           HA       ALA  27  -7.262   0.654  -3.466
  202   1HB   ALA  27          1HB       ALA  27  -5.394  -0.327  -2.213
  203   2HB   ALA  27          2HB       ALA  27  -5.583   0.889  -0.949
  204   3HB   ALA  27          3HB       ALA  27  -6.847  -0.313  -1.212
  205    H    ASN  28           H        ASN  28  -6.442   3.337  -1.309
  206    HA   ASN  28           HA       ASN  28  -8.859   3.428   0.178
  207   1HB   ASN  28          1HB       ASN  28  -6.833   4.711   0.767
  208   2HB   ASN  28          2HB       ASN  28  -7.058   5.718  -0.661
  209   2HD2  ASN  28          2HD2      ASN  28  -7.150   6.499   2.250
  210   1HD2  ASN  28          1HD2      ASN  28  -8.673   7.218   2.471
  211    H    ARG  29           H        ARG  29  -8.018   4.894  -2.955
  212    HA   ARG  29           HA       ARG  29 -10.374   6.457  -3.287
  213   1HB   ARG  29          1HB       ARG  29  -8.705   5.058  -5.398
  214   2HB   ARG  29          2HB       ARG  29  -9.878   6.329  -5.718
  215   1HG   ARG  29          1HG       ARG  29  -7.528   6.712  -3.851
  216   2HG   ARG  29          2HG       ARG  29  -7.434   7.070  -5.570
  217   1HD   ARG  29          1HD       ARG  29  -9.223   8.388  -3.507
  218   2HD   ARG  29          2HD       ARG  29  -7.942   9.129  -4.453
  219    HE   ARG  29           HE       ARG  29  -9.699   8.184  -6.371
  220   1HH1  ARG  29          1HH1      ARG  29 -11.408   9.430  -7.169
  221   2HH1  ARG  29          2HH1      ARG  29 -12.056  10.709  -6.198
  222   1HH2  ARG  29          1HH2      ARG  29  -9.884  10.157  -3.552
  223   2HH2  ARG  29          2HH2      ARG  29 -11.193  11.121  -4.150
  224    H    GLU  30           H        GLU  30  -9.747   3.039  -4.019
  225    HA   GLU  30           HA       GLU  30 -12.158   2.522  -5.427
  226   1HB   GLU  30          1HB       GLU  30 -10.421   0.758  -3.695
  227   2HB   GLU  30          2HB       GLU  30 -11.821   0.142  -4.569
  228   1HG   GLU  30          1HG       GLU  30 -10.872   0.954  -6.685
  229   2HG   GLU  30          2HG       GLU  30  -9.464   1.572  -5.820
  230    H    LEU  31           H        LEU  31 -11.465   2.508  -1.957
  231    HA   LEU  31           HA       LEU  31 -14.047   1.536  -1.127
  232   1HB   LEU  31          1HB       LEU  31 -12.300   3.465   0.429
  233   2HB   LEU  31          2HB       LEU  31 -13.407   2.248   1.066
  234    HG   LEU  31           HG       LEU  31 -10.852   1.726  -0.466
  235   1HD1  LEU  31          1HD1      LEU  31 -11.661   1.454   2.433
  236   2HD1  LEU  31          2HD1      LEU  31 -10.294   0.565   1.762
  237   3HD1  LEU  31          3HD1      LEU  31 -10.286   2.328   1.759
  238   1HD2  LEU  31          1HD2      LEU  31 -13.061  -0.090   0.528
  239   2HD2  LEU  31          2HD2      LEU  31 -12.326  -0.035  -1.075
  240   3HD2  LEU  31          3HD2      LEU  31 -11.422  -0.695   0.287
  241    H    ASP  32           H        ASP  32 -12.691   4.732  -1.721
  242    HA   ASP  32           HA       ASP  32 -14.836   6.324  -0.791
  243   1HB   ASP  32          1HB       ASP  32 -12.613   7.194  -1.357
  244   2HB   ASP  32          2HB       ASP  32 -12.897   6.837  -3.058
  245    H    LYS  33           H        LYS  33 -14.240   5.138  -4.153
  246    HA   LYS  33           HA       LYS  33 -16.693   6.303  -5.132
  247   1HB   LYS  33          1HB       LYS  33 -16.343   4.844  -7.116
  248   2HB   LYS  33          2HB       LYS  33 -14.893   5.751  -6.686
  249   1HG   LYS  33          1HG       LYS  33 -14.120   3.747  -5.388
  250   2HG   LYS  33          2HG       LYS  33 -15.484   2.854  -6.051
  251   1HD   LYS  33          1HD       LYS  33 -13.313   4.200  -7.687
  252   2HD   LYS  33          2HD       LYS  33 -13.428   2.469  -7.376
  253   1HE   LYS  33          1HE       LYS  33 -14.458   2.638  -9.466
  254   2HE   LYS  33          2HE       LYS  33 -15.848   2.727  -8.385
  255   1HZ   LYS  33          1HZ       LYS  33 -14.658   5.285  -8.813
  256   2HZ   LYS  33          2HZ       LYS  33 -15.134   4.571 -10.276
  257   3HZ   LYS  33          3HZ       LYS  33 -16.270   4.794  -9.032
  258    H    TYR  34           H        TYR  34 -15.870   3.060  -3.907
  259    HA   TYR  34           HA       TYR  34 -18.394   1.834  -4.491
  260   1HB   TYR  34          1HB       TYR  34 -16.602   1.301  -2.101
  261   2HB   TYR  34          2HB       TYR  34 -17.840   0.224  -2.726
  262    HD1  TYR  34           HD1      TYR  34 -16.902   1.015  -5.798
  263    HD2  TYR  34           HD2      TYR  34 -14.980  -0.533  -2.271
  264    HE1  TYR  34           HE1      TYR  34 -15.212  -0.088  -7.201
  265    HE2  TYR  34           HE2      TYR  34 -13.287  -1.634  -3.695
  266    HH   TYR  34           HH       TYR  34 -13.363  -2.493  -6.312
  267    H    GLY  35           H        GLY  35 -17.295   3.784  -1.738
  268   1HA   GLY  35          1HA       GLY  35 -20.126   4.381  -1.114
  269   2HA   GLY  35          2HA       GLY  35 -18.720   5.202  -0.437
  270    H    VAL  36           H        VAL  36 -17.458   2.516   0.164
  271    HA   VAL  36           HA       VAL  36 -19.199   1.154   2.021
  272    HB   VAL  36           HB       VAL  36 -17.065   0.089   2.806
  273   1HG1  VAL  36          1HG1      VAL  36 -17.558   0.210  -0.181
  274   2HG1  VAL  36          2HG1      VAL  36 -16.605  -1.033   0.631
  275   3HG1  VAL  36          3HG1      VAL  36 -18.331  -0.888   0.962
  276   1HG2  VAL  36          1HG2      VAL  36 -15.633   2.096   2.366
  277   2HG2  VAL  36          2HG2      VAL  36 -14.994   0.621   1.641
  278   3HG2  VAL  36          3HG2      VAL  36 -15.825   1.808   0.636
  279    H    SER  37           H        SER  37 -17.834   0.916   4.390
  280    HA   SER  37           HA       SER  37 -18.482   3.410   5.696
  281   1HB   SER  37          1HB       SER  37 -17.762   2.328   7.729
  282   2HB   SER  37          2HB       SER  37 -18.600   1.119   6.761
  283    HG   SER  37           HG       SER  37 -16.721   0.175   7.380
  284    H    ASP  38           H        ASP  38 -17.043   4.910   6.669
  285    HA   ASP  38           HA       ASP  38 -14.590   5.385   5.198
  286   1HB   ASP  38          1HB       ASP  38 -15.804   6.691   7.648
  287   2HB   ASP  38          2HB       ASP  38 -14.308   7.249   6.896
  288    H    TYR  39           H        TYR  39 -15.362   3.570   8.004
  289    HA   TYR  39           HA       TYR  39 -12.957   3.779   9.498
  290   1HB   TYR  39          1HB       TYR  39 -14.878   2.675  10.442
  291   2HB   TYR  39          2HB       TYR  39 -14.902   1.485   9.142
  292    HD1  TYR  39           HD1      TYR  39 -13.278  -0.313   9.041
  293    HD2  TYR  39           HD2      TYR  39 -13.190   2.567  12.224
  294    HE1  TYR  39           HE1      TYR  39 -11.737  -1.769  10.309
  295    HE2  TYR  39           HE2      TYR  39 -11.645   1.106  13.501
  296    HH   TYR  39           HH       TYR  39 -11.016  -2.151  12.578
  297    H    TYR  40           H        TYR  40 -13.770   1.615   6.790
  298    HA   TYR  40           HA       TYR  40 -11.445   0.000   6.870
  299   1HB   TYR  40          1HB       TYR  40 -13.142   0.863   4.514
  300   2HB   TYR  40          2HB       TYR  40 -11.915  -0.400   4.439
  301    HD1  TYR  40           HD1      TYR  40 -12.094  -2.214   6.403
  302    HD2  TYR  40           HD2      TYR  40 -15.343   0.201   4.963
  303    HE1  TYR  40           HE1      TYR  40 -13.718  -3.867   7.290
  304    HE2  TYR  40           HE2      TYR  40 -16.965  -1.449   5.853
  305    HH   TYR  40           HH       TYR  40 -15.895  -4.229   7.768
  306    H    LYS  41           H        LYS  41 -11.883   3.212   5.336
  307    HA   LYS  41           HA       LYS  41  -9.487   3.129   3.812
  308   1HB   LYS  41          1HB       LYS  41  -9.849   5.383   3.376
  309   2HB   LYS  41          2HB       LYS  41 -11.460   4.912   3.904
  310   1HG   LYS  41          1HG       LYS  41 -10.745   5.640   6.254
  311   2HG   LYS  41          2HG       LYS  41  -9.338   6.371   5.494
  312   1HD   LYS  41          1HD       LYS  41 -12.193   6.985   4.672
  313   2HD   LYS  41          2HD       LYS  41 -11.278   7.956   5.823
  314   1HE   LYS  41          1HE       LYS  41  -9.484   8.161   4.004
  315   2HE   LYS  41          2HE       LYS  41 -10.684   7.503   2.893
  316   1HZ   LYS  41          1HZ       LYS  41 -11.180   9.869   4.607
  317   2HZ   LYS  41          2HZ       LYS  41 -10.598   9.977   3.013
  318   3HZ   LYS  41          3HZ       LYS  41 -12.130   9.307   3.318
  319    H    ASN  42           H        ASN  42 -10.093   4.048   7.172
  320    HA   ASN  42           HA       ASN  42  -7.476   4.966   7.778
  321   1HB   ASN  42          1HB       ASN  42  -9.396   5.263   9.306
  322   2HB   ASN  42          2HB       ASN  42  -9.447   3.521   9.575
  323   2HD2  ASN  42          2HD2      ASN  42  -6.693   5.869   9.495
  324   1HD2  ASN  42          1HD2      ASN  42  -6.091   5.425  11.019
  325    H    LEU  43           H        LEU  43  -8.906   1.741   7.783
  326    HA   LEU  43           HA       LEU  43  -6.688   0.365   8.909
  327   1HB   LEU  43          1HB       LEU  43  -8.926  -0.647   8.679
  328   2HB   LEU  43          2HB       LEU  43  -8.758  -0.631   6.926
  329    HG   LEU  43           HG       LEU  43  -6.805  -2.134   7.103
  330   1HD1  LEU  43          1HD1      LEU  43  -7.353  -1.789  10.051
  331   2HD1  LEU  43          2HD1      LEU  43  -6.603  -3.273   9.461
  332   3HD1  LEU  43          3HD1      LEU  43  -5.809  -1.727   9.199
  333   1HD2  LEU  43          1HD2      LEU  43  -9.135  -3.026   6.888
  334   2HD2  LEU  43          2HD2      LEU  43  -8.050  -4.138   7.723
  335   3HD2  LEU  43          3HD2      LEU  43  -9.203  -3.172   8.644
  336    H    ILE  44           H        ILE  44  -7.463   1.246   5.546
  337    HA   ILE  44           HA       ILE  44  -5.333  -0.168   4.268
  338    HB   ILE  44           HB       ILE  44  -6.458   2.557   3.511
  339   1HG1  ILE  44          1HG1      ILE  44  -8.314   1.028   3.633
  340   2HG1  ILE  44          2HG1      ILE  44  -7.902   1.208   1.934
  341   1HG2  ILE  44          1HG2      ILE  44  -5.021   0.431   1.897
  342   2HG2  ILE  44          2HG2      ILE  44  -5.765   1.878   1.217
  343   3HG2  ILE  44          3HG2      ILE  44  -4.398   2.026   2.320
  344   1HD1  ILE  44          1HD1      ILE  44  -6.401  -0.895   2.326
  345   2HD1  ILE  44          2HD1      ILE  44  -7.406  -1.131   3.755
  346   3HD1  ILE  44          3HD1      ILE  44  -8.143  -1.109   2.155
  347    H    ASN  45           H        ASN  45  -5.493   3.009   5.808
  348    HA   ASN  45           HA       ASN  45  -2.887   3.920   5.135
  349   1HB   ASN  45          1HB       ASN  45  -4.609   5.376   6.154
  350   2HB   ASN  45          2HB       ASN  45  -4.490   4.461   7.657
  351   2HD2  ASN  45          2HD2      ASN  45  -3.853   6.782   8.448
  352   1HD2  ASN  45          1HD2      ASN  45  -2.204   7.177   8.372
  353    H    ASN  46           H        ASN  46  -4.043   1.898   7.816
  354    HA   ASN  46           HA       ASN  46  -1.275   1.615   8.847
  355   1HB   ASN  46          1HB       ASN  46  -3.295   1.977  10.346
  356   2HB   ASN  46          2HB       ASN  46  -3.799   0.342   9.919
  357   2HD2  ASN  46          2HD2      ASN  46  -3.444   0.014  12.369
  358   1HD2  ASN  46          1HD2      ASN  46  -1.876  -0.385  12.883
  359    H    ALA  47           H        ALA  47  -2.416   0.324   6.248
  360    HA   ALA  47           HA       ALA  47  -2.606  -2.492   6.660
  361   1HB   ALA  47          1HB       ALA  47  -3.224  -1.658   4.508
  362   2HB   ALA  47          2HB       ALA  47  -1.762  -2.607   4.241
  363   3HB   ALA  47          3HB       ALA  47  -1.672  -0.848   4.297
  364    H    LYS  48           H        LYS  48  -1.028  -4.077   6.874
  365    HA   LYS  48           HA       LYS  48   1.509  -3.348   7.936
  366   1HB   LYS  48          1HB       LYS  48   0.497  -5.958   6.790
  367   2HB   LYS  48          2HB       LYS  48   2.069  -5.786   7.569
  368   1HG   LYS  48          1HG       LYS  48   1.010  -5.046   9.640
  369   2HG   LYS  48          2HG       LYS  48  -0.574  -5.070   8.870
  370   1HD   LYS  48          1HD       LYS  48  -0.515  -7.118  10.033
  371   2HD   LYS  48          2HD       LYS  48  -0.075  -7.575   8.389
  372   1HE   LYS  48          1HE       LYS  48   1.410  -8.610  10.107
  373   2HE   LYS  48          2HE       LYS  48   2.297  -7.585   8.986
  374   1HZ   LYS  48          1HZ       LYS  48   1.263  -6.559  11.559
  375   2HZ   LYS  48          2HZ       LYS  48   2.783  -7.310  11.443
  376   3HZ   LYS  48          3HZ       LYS  48   2.464  -5.889  10.567
  377    H    THR  49           H        THR  49   0.606  -4.372   4.635
  378    HA   THR  49           HA       THR  49   2.905  -2.979   3.541
  379    HB   THR  49           HB       THR  49   3.002  -5.961   3.078
  380    HG1  THR  49           HG1      THR  49   3.616  -6.277   5.038
  381   1HG2  THR  49          1HG2      THR  49   4.384  -4.204   1.799
  382   2HG2  THR  49          2HG2      THR  49   5.266  -3.975   3.308
  383   3HG2  THR  49          3HG2      THR  49   5.270  -5.549   2.513
  384    H    VAL  50           H        VAL  50   2.994  -3.357   1.092
  385    HA   VAL  50           HA       VAL  50   0.443  -3.022  -0.077
  386    HB   VAL  50           HB       VAL  50   2.550  -2.356  -1.161
  387   1HG1  VAL  50          1HG1      VAL  50   3.768  -4.474  -0.461
  388   2HG1  VAL  50          2HG1      VAL  50   2.920  -5.301  -1.767
  389   3HG1  VAL  50          3HG1      VAL  50   4.035  -3.984  -2.134
  390   1HG2  VAL  50          1HG2      VAL  50   0.425  -2.792  -2.462
  391   2HG2  VAL  50          2HG2      VAL  50   1.903  -2.949  -3.411
  392   3HG2  VAL  50          3HG2      VAL  50   1.065  -4.392  -2.841
  393    H    GLU  51           H        GLU  51   2.298  -5.937   0.569
  394    HA   GLU  51           HA       GLU  51   0.841  -7.731  -1.094
  395   1HB   GLU  51          1HB       GLU  51   2.225  -8.163   1.571
  396   2HB   GLU  51          2HB       GLU  51   1.569  -9.474   0.588
  397   1HG   GLU  51          1HG       GLU  51   3.585  -7.462  -0.444
  398   2HG   GLU  51          2HG       GLU  51   4.033  -9.031   0.226
  399    H    GLY  52           H        GLY  52   0.177  -6.358   2.076
  400   1HA   GLY  52          1HA       GLY  52  -1.650  -6.779   3.544
  401   2HA   GLY  52          2HA       GLY  52  -2.239  -8.010   2.427
  402    H    VAL  53           H        VAL  53  -1.400  -5.000   0.943
  403    HA   VAL  53           HA       VAL  53  -3.867  -3.601   1.392
  404    HB   VAL  53           HB       VAL  53  -1.789  -3.392  -0.797
  405   1HG1  VAL  53          1HG1      VAL  53  -4.329  -1.816  -0.321
  406   2HG1  VAL  53          2HG1      VAL  53  -2.954  -1.119  -1.177
  407   3HG1  VAL  53          3HG1      VAL  53  -3.766  -2.545  -1.825
  408   1HG2  VAL  53          1HG2      VAL  53  -1.177  -2.746   1.548
  409   2HG2  VAL  53          2HG2      VAL  53  -1.148  -1.378   0.434
  410   3HG2  VAL  53          3HG2      VAL  53  -2.506  -1.589   1.539
  411    H    LYS  54           H        LYS  54  -2.854  -5.627  -1.434
  412    HA   LYS  54           HA       LYS  54  -5.475  -5.321  -2.631
  413   1HB   LYS  54          1HB       LYS  54  -4.699  -6.588  -4.424
  414   2HB   LYS  54          2HB       LYS  54  -3.215  -5.886  -3.801
  415   1HG   LYS  54          1HG       LYS  54  -4.157  -8.674  -3.038
  416   2HG   LYS  54          2HG       LYS  54  -3.102  -8.343  -4.398
  417   1HD   LYS  54          1HD       LYS  54  -1.459  -7.293  -2.916
  418   2HD   LYS  54          2HD       LYS  54  -2.509  -7.589  -1.531
  419   1HE   LYS  54          1HE       LYS  54  -0.712  -9.329  -1.812
  420   2HE   LYS  54          2HE       LYS  54  -2.345  -9.993  -1.847
  421   1HZ   LYS  54          1HZ       LYS  54  -0.899  -9.208  -4.307
  422   2HZ   LYS  54          2HZ       LYS  54  -0.774 -10.765  -3.642
  423   3HZ   LYS  54          3HZ       LYS  54  -2.280 -10.183  -4.170
  424    H    ALA  55           H        ALA  55  -3.994  -7.855  -0.638
  425    HA   ALA  55           HA       ALA  55  -6.180  -9.709  -0.856
  426   1HB   ALA  55          1HB       ALA  55  -5.232 -10.593   1.344
  427   2HB   ALA  55          2HB       ALA  55  -4.034  -9.302   1.237
  428   3HB   ALA  55          3HB       ALA  55  -4.104 -10.547  -0.010
  429    H    LEU  56           H        LEU  56  -5.551  -6.939   1.191
  430    HA   LEU  56           HA       LEU  56  -7.720  -7.429   3.014
  431   1HB   LEU  56          1HB       LEU  56  -5.890  -5.974   3.647
  432   2HB   LEU  56          2HB       LEU  56  -6.250  -4.883   2.312
  433    HG   LEU  56           HG       LEU  56  -8.427  -4.345   3.306
  434   1HD1  LEU  56          1HD1      LEU  56  -7.611  -6.484   5.274
  435   2HD1  LEU  56          2HD1      LEU  56  -8.728  -5.208   5.757
  436   3HD1  LEU  56          3HD1      LEU  56  -9.147  -6.286   4.429
  437   1HD2  LEU  56          1HD2      LEU  56  -6.242  -3.199   4.028
  438   2HD2  LEU  56          2HD2      LEU  56  -7.624  -3.016   5.108
  439   3HD2  LEU  56          3HD2      LEU  56  -6.351  -4.171   5.497
  440    H    ILE  57           H        ILE  57  -7.370  -5.598   0.001
  441    HA   ILE  57           HA       ILE  57 -10.068  -4.547   0.050
  442    HB   ILE  57           HB       ILE  57  -8.195  -5.056  -2.274
  443   1HG1  ILE  57          1HG1      ILE  57  -7.533  -3.402  -0.354
  444   2HG1  ILE  57          2HG1      ILE  57  -7.393  -2.851  -2.019
  445   1HG2  ILE  57          1HG2      ILE  57 -10.864  -3.684  -2.072
  446   2HG2  ILE  57          2HG2      ILE  57  -9.693  -3.177  -3.291
  447   3HG2  ILE  57          3HG2      ILE  57 -10.286  -4.835  -3.276
  448   1HD1  ILE  57          1HD1      ILE  57 -10.008  -2.359  -0.645
  449   2HD1  ILE  57          2HD1      ILE  57  -8.625  -1.395  -0.128
  450   3HD1  ILE  57          3HD1      ILE  57  -9.142  -1.364  -1.812
  451    H    ASP  58           H        ASP  58  -8.494  -7.406  -1.329
  452    HA   ASP  58           HA       ASP  58 -10.806  -8.367  -2.743
  453   1HB   ASP  58          1HB       ASP  58  -8.341  -9.775  -1.705
  454   2HB   ASP  58          2HB       ASP  58  -9.570 -10.574  -2.682
  455    H    GLU  59           H        GLU  59  -9.598  -9.021   0.561
  456    HA   GLU  59           HA       GLU  59 -11.627 -11.016   1.068
  457   1HB   GLU  59          1HB       GLU  59 -10.837 -11.070   3.303
  458   2HB   GLU  59          2HB       GLU  59  -9.406 -10.680   2.352
  459   1HG   GLU  59          1HG       GLU  59  -9.823  -8.279   2.824
  460   2HG   GLU  59          2HG       GLU  59 -11.117  -8.739   3.920
  461    H    ILE  60           H        ILE  60 -11.376  -7.531   1.534
  462    HA   ILE  60           HA       ILE  60 -13.863  -7.282   2.970
  463    HB   ILE  60           HB       ILE  60 -12.222  -5.296   1.378
  464   1HG1  ILE  60          1HG1      ILE  60 -12.675  -5.543   4.363
  465   2HG1  ILE  60          2HG1      ILE  60 -11.313  -6.289   3.530
  466   1HG2  ILE  60          1HG2      ILE  60 -14.752  -4.925   3.000
  467   2HG2  ILE  60          2HG2      ILE  60 -13.645  -3.595   2.657
  468   3HG2  ILE  60          3HG2      ILE  60 -14.454  -4.431   1.334
  469   1HD1  ILE  60          1HD1      ILE  60 -10.657  -4.039   2.666
  470   2HD1  ILE  60          2HD1      ILE  60 -11.971  -3.327   3.603
  471   3HD1  ILE  60          3HD1      ILE  60 -10.627  -4.118   4.428
  472    H    LEU  61           H        LEU  61 -12.939  -7.019  -0.450
  473    HA   LEU  61           HA       LEU  61 -15.604  -6.363  -1.359
  474   1HB   LEU  61          1HB       LEU  61 -13.143  -7.437  -2.764
  475   2HB   LEU  61          2HB       LEU  61 -14.660  -7.149  -3.619
  476    HG   LEU  61           HG       LEU  61 -13.116  -5.059  -2.047
  477   1HD1  LEU  61          1HD1      LEU  61 -12.075  -5.958  -4.214
  478   2HD1  LEU  61          2HD1      LEU  61 -13.460  -5.254  -5.048
  479   3HD1  LEU  61          3HD1      LEU  61 -12.354  -4.217  -4.150
  480   1HD2  LEU  61          1HD2      LEU  61 -15.750  -5.067  -3.501
  481   2HD2  LEU  61          2HD2      LEU  61 -15.276  -4.191  -2.045
  482   3HD2  LEU  61          3HD2      LEU  61 -14.752  -3.616  -3.622
  483    H    ALA  62           H        ALA  62 -13.784  -9.380  -1.005
  484    HA   ALA  62           HA       ALA  62 -15.715 -11.095  -2.226
  485   1HB   ALA  62          1HB       ALA  62 -13.765 -11.686   0.023
  486   2HB   ALA  62          2HB       ALA  62 -13.431 -11.847  -1.701
  487   3HB   ALA  62          3HB       ALA  62 -14.618 -12.901  -0.930
  488    H    ALA  63           H        ALA  63 -15.473  -9.714   1.006
  489    HA   ALA  63           HA       ALA  63 -17.376 -11.364   2.326
  490   1HB   ALA  63          1HB       ALA  63 -17.574  -9.559   3.941
  491   2HB   ALA  63          2HB       ALA  63 -15.887  -9.679   3.440
  492   3HB   ALA  63          3HB       ALA  63 -16.912  -8.402   2.785
  493    H    LEU  64           H        LEU  64 -17.818  -8.439   0.342
  494    HA   LEU  64           HA       LEU  64 -20.656  -8.269   0.807
  495   1HB   LEU  64          1HB       LEU  64 -18.986  -7.241  -1.511
  496   2HB   LEU  64          2HB       LEU  64 -20.636  -6.739  -1.162
  497    HG   LEU  64           HG       LEU  64 -18.392  -6.466   0.853
  498   1HD1  LEU  64          1HD1      LEU  64 -17.810  -5.195  -1.177
  499   2HD1  LEU  64          2HD1      LEU  64 -19.389  -4.411  -1.142
  500   3HD1  LEU  64          3HD1      LEU  64 -18.226  -4.107   0.148
  501   1HD2  LEU  64          1HD2      LEU  64 -21.205  -5.371   0.596
  502   2HD2  LEU  64          2HD2      LEU  64 -20.495  -6.261   1.943
  503   3HD2  LEU  64          3HD2      LEU  64 -20.008  -4.597   1.632
  504    HA   PRO  65           HA       PRO  65 -22.015 -11.631  -1.788
  505   1HB   PRO  65          1HB       PRO  65 -24.266 -10.329  -2.961
  506   2HB   PRO  65          2HB       PRO  65 -24.257 -11.323  -1.500
  507   1HG   PRO  65          1HG       PRO  65 -24.412  -8.387  -1.752
  508   2HG   PRO  65          2HG       PRO  65 -24.858  -9.417  -0.385
  509   1HD   PRO  65          1HD       PRO  65 -22.590  -7.767  -0.489
  510   2HD   PRO  65          2HD       PRO  65 -22.809  -9.131   0.633

  No H/Q in entry =         510
  Start of MODEL   21
    1    H1   MET   1           H1       MET   1  21.673  16.500 -20.779
    2    H2   MET   1           H2       MET   1  22.061  14.906 -21.219
    3    H3   MET   1           H3       MET   1  20.768  15.201 -20.162
    4    HA   MET   1           HA       MET   1  22.143  15.771 -18.398
    5   1HB   MET   1          1HB       MET   1  22.187  13.348 -18.951
    6   2HB   MET   1          2HB       MET   1  23.601  13.621 -19.969
    7   1HG   MET   1          1HG       MET   1  24.875  14.412 -18.030
    8   2HG   MET   1          2HG       MET   1  23.458  14.220 -17.000
    9   1HE   MET   1          1HE       MET   1  22.671  12.157 -15.958
   10   2HE   MET   1          2HE       MET   1  23.835  10.866 -15.631
   11   3HE   MET   1          3HE       MET   1  24.241  12.539 -15.257
   12    H    LYS   2           H        LYS   2  24.236  16.516 -17.615
   13    HA   LYS   2           HA       LYS   2  25.458  18.495 -19.253
   14   1HB   LYS   2          1HB       LYS   2  25.553  18.495 -16.771
   15   2HB   LYS   2          2HB       LYS   2  26.616  17.090 -16.821
   16   1HG   LYS   2          1HG       LYS   2  28.286  18.394 -18.094
   17   2HG   LYS   2          2HG       LYS   2  27.223  19.800 -18.044
   18   1HD   LYS   2          1HD       LYS   2  27.322  19.784 -15.576
   19   2HD   LYS   2          2HD       LYS   2  28.392  18.384 -15.631
   20   1HE   LYS   2          1HE       LYS   2  28.998  21.077 -16.886
   21   2HE   LYS   2          2HE       LYS   2  29.653  20.508 -15.351
   22   1HZ   LYS   2          1HZ       LYS   2  30.613  18.609 -16.542
   23   2HZ   LYS   2          2HZ       LYS   2  30.050  19.247 -18.009
   24   3HZ   LYS   2          3HZ       LYS   2  31.217  20.093 -17.109
   25    H    ALA   3           H        ALA   3  26.430  15.145 -18.537
   26    HA   ALA   3           HA       ALA   3  27.976  15.065 -21.027
   27   1HB   ALA   3          1HB       ALA   3  29.617  16.077 -19.500
   28   2HB   ALA   3          2HB       ALA   3  30.102  14.431 -19.909
   29   3HB   ALA   3          3HB       ALA   3  29.364  14.770 -18.343
   30    H    ILE   4           H        ILE   4  28.746  12.838 -21.470
   31    HA   ILE   4           HA       ILE   4  26.827  10.846 -20.779
   32    HB   ILE   4           HB       ILE   4  29.678  10.482 -21.755
   33   1HG1  ILE   4          1HG1      ILE   4  28.425  11.887 -23.299
   34   2HG1  ILE   4          2HG1      ILE   4  28.592  10.282 -24.004
   35   1HG2  ILE   4          1HG2      ILE   4  27.292   8.624 -21.689
   36   2HG2  ILE   4          2HG2      ILE   4  28.727   8.325 -22.670
   37   3HG2  ILE   4          3HG2      ILE   4  28.858   8.391 -20.912
   38   1HD1  ILE   4          1HD1      ILE   4  26.252   9.857 -22.835
   39   2HD1  ILE   4          2HD1      ILE   4  26.147  11.616 -22.883
   40   3HD1  ILE   4          3HD1      ILE   4  26.333  10.703 -24.378
   41    H    PHE   5           H        PHE   5  30.069  11.519 -19.474
   42    HA   PHE   5           HA       PHE   5  30.152   9.304 -17.663
   43   1HB   PHE   5          1HB       PHE   5  32.143  10.654 -18.243
   44   2HB   PHE   5          2HB       PHE   5  31.441  12.042 -17.413
   45    HD1  PHE   5           HD1      PHE   5  31.271  12.106 -14.971
   46    HD2  PHE   5           HD2      PHE   5  32.983   8.726 -16.997
   47    HE1  PHE   5           HE1      PHE   5  32.211  11.292 -12.824
   48    HE2  PHE   5           HE2      PHE   5  33.921   7.913 -14.849
   49    HZ   PHE   5           HZ       PHE   5  33.534   9.197 -12.763
   50    H    VAL   6           H        VAL   6  29.348   9.093 -15.561
   51    HA   VAL   6           HA       VAL   6  27.375  11.165 -14.711
   52    HB   VAL   6           HB       VAL   6  27.835   8.363 -13.641
   53   1HG1  VAL   6          1HG1      VAL   6  25.603  10.383 -13.265
   54   2HG1  VAL   6          2HG1      VAL   6  25.537   8.709 -12.712
   55   3HG1  VAL   6          3HG1      VAL   6  26.727   9.817 -12.029
   56   1HG2  VAL   6          1HG2      VAL   6  25.892   9.451 -15.700
   57   2HG2  VAL   6          2HG2      VAL   6  27.122   8.212 -15.949
   58   3HG2  VAL   6          3HG2      VAL   6  25.720   7.872 -14.934
   59    H    LEU   7           H        LEU   7  28.083  12.629 -13.254
   60    HA   LEU   7           HA       LEU   7  30.397  11.969 -11.505
   61   1HB   LEU   7          1HB       LEU   7  29.855  14.540 -10.861
   62   2HB   LEU   7          2HB       LEU   7  30.828  14.113 -12.264
   63    HG   LEU   7           HG       LEU   7  27.842  14.262 -12.625
   64   1HD1  LEU   7          1HD1      LEU   7  29.664  16.683 -12.520
   65   2HD1  LEU   7          2HD1      LEU   7  27.985  16.683 -13.059
   66   3HD1  LEU   7          3HD1      LEU   7  28.371  16.317 -11.378
   67   1HD2  LEU   7          1HD2      LEU   7  29.378  13.558 -14.477
   68   2HD2  LEU   7          2HD2      LEU   7  28.503  15.039 -14.859
   69   3HD2  LEU   7          3HD2      LEU   7  30.191  15.115 -14.356
   70    H    ASN   8           H        ASN   8  26.989  12.953 -11.312
   71    HA   ASN   8           HA       ASN   8  26.800  11.679  -8.658
   72   1HB   ASN   8          1HB       ASN   8  27.480  14.099  -8.263
   73   2HB   ASN   8          2HB       ASN   8  25.944  14.567  -8.997
   74   2HD2  ASN   8          2HD2      ASN   8  24.405  14.982  -7.409
   75   1HD2  ASN   8          1HD2      ASN   8  24.252  14.128  -5.950
   76    H    ALA   9           H        ALA   9  24.528  11.393  -8.026
   77    HA   ALA   9           HA       ALA   9  22.826  10.829 -10.293
   78   1HB   ALA   9          1HB       ALA   9  22.053  10.981  -7.365
   79   2HB   ALA   9          2HB       ALA   9  22.781   9.564  -8.122
   80   3HB   ALA   9          3HB       ALA   9  21.191  10.123  -8.642
   81    H    GLN  10           H        GLN  10  20.927  11.936 -10.945
   82    HA   GLN  10           HA       GLN  10  20.961  14.778 -10.753
   83   1HB   GLN  10          1HB       GLN  10  19.812  13.539 -12.569
   84   2HB   GLN  10          2HB       GLN  10  18.620  12.958 -11.408
   85   1HG   GLN  10          1HG       GLN  10  17.947  15.288 -10.929
   86   2HG   GLN  10          2HG       GLN  10  19.140  15.869 -12.091
   87   2HE2  GLN  10          2HE2      GLN  10  17.939  16.564 -13.878
   88   1HE2  GLN  10          1HE2      GLN  10  16.728  15.651 -14.639
   89    H    HIS  11           H        HIS  11  19.126  12.326  -8.954
   90    HA   HIS  11           HA       HIS  11  18.610  14.355  -6.828
   91   1HB   HIS  11          1HB       HIS  11  16.532  12.593  -8.156
   92   2HB   HIS  11          2HB       HIS  11  16.282  13.359  -6.589
   93    HD1  HIS  11           HD1      HIS  11  15.876  13.971 -10.131
   94    HD2  HIS  11           HD2      HIS  11  16.665  16.347  -6.799
   95    HE1  HIS  11           HE1      HIS  11  15.333  16.351 -10.804
   96    H    ASP  12           H        ASP  12  17.822  13.180  -4.786
   97    HA   ASP  12           HA       ASP  12  19.654  11.019  -4.212
   98   1HB   ASP  12          1HB       ASP  12  17.331  12.201  -2.667
   99   2HB   ASP  12          2HB       ASP  12  18.371  10.929  -2.023
  100    H    GLU  13           H        GLU  13  18.885   9.568  -5.991
  101    HA   GLU  13           HA       GLU  13  16.240   8.349  -5.719
  102   1HB   GLU  13          1HB       GLU  13  17.341   8.578  -7.930
  103   2HB   GLU  13          2HB       GLU  13  18.628   7.501  -7.390
  104   1HG   GLU  13          1HG       GLU  13  16.978   5.693  -7.046
  105   2HG   GLU  13          2HG       GLU  13  15.689   6.770  -7.586
  106    H    ALA  14           H        ALA  14  15.763   6.545  -4.539
  107    HA   ALA  14           HA       ALA  14  17.849   4.611  -3.814
  108   1HB   ALA  14          1HB       ALA  14  16.423   6.213  -1.667
  109   2HB   ALA  14          2HB       ALA  14  17.515   4.857  -1.384
  110   3HB   ALA  14          3HB       ALA  14  18.131   6.356  -2.081
  111    H    VAL  15           H        VAL  15  15.768   4.204  -1.409
  112    HA   VAL  15           HA       VAL  15  14.309   2.102  -2.759
  113    HB   VAL  15           HB       VAL  15  13.954   3.343  -0.013
  114   1HG1  VAL  15          1HG1      VAL  15  12.663   0.951  -1.344
  115   2HG1  VAL  15          2HG1      VAL  15  12.733   1.132   0.409
  116   3HG1  VAL  15          3HG1      VAL  15  11.867   2.320  -0.567
  117   1HG2  VAL  15          1HG2      VAL  15  15.331   0.834  -1.019
  118   2HG2  VAL  15          2HG2      VAL  15  16.098   2.230  -0.261
  119   3HG2  VAL  15          3HG2      VAL  15  15.043   1.180   0.686
  120    H    ASP  16           H        ASP  16  12.332   2.213  -3.733
  121    HA   ASP  16           HA       ASP  16  11.057   4.842  -3.998
  122   1HB   ASP  16          1HB       ASP  16  10.412   2.108  -5.129
  123   2HB   ASP  16          2HB       ASP  16   9.452   3.549  -5.468
  124    H    ALA  17           H        ALA  17  10.522   4.970  -1.647
  125    HA   ALA  17           HA       ALA  17   8.589   3.151  -0.496
  126   1HB   ALA  17          1HB       ALA  17   8.417   4.824   1.299
  127   2HB   ALA  17          2HB       ALA  17   9.285   5.995   0.305
  128   3HB   ALA  17          3HB       ALA  17  10.109   4.547   0.883
  129    H    ASN  18           H        ASN  18   8.399   5.861  -2.622
  130    HA   ASN  18           HA       ASN  18   5.782   6.811  -2.050
  131   1HB   ASN  18          1HB       ASN  18   7.345   6.695  -4.640
  132   2HB   ASN  18          2HB       ASN  18   5.795   7.523  -4.480
  133   2HD2  ASN  18          2HD2      ASN  18   6.053   8.683  -1.924
  134   1HD2  ASN  18          1HD2      ASN  18   7.328   9.804  -1.940
  135    H    SER  19           H        SER  19   6.868   4.115  -4.115
  136    HA   SER  19           HA       SER  19   4.329   3.514  -5.256
  137   1HB   SER  19          1HB       SER  19   5.242   1.332  -5.760
  138   2HB   SER  19          2HB       SER  19   6.535   2.512  -5.956
  139    HG   SER  19           HG       SER  19   7.557   1.625  -4.345
  140    H    LEU  20           H        LEU  20   5.839   2.389  -2.224
  141    HA   LEU  20           HA       LEU  20   3.754   0.608  -1.461
  142   1HB   LEU  20          1HB       LEU  20   5.930   0.667  -0.308
  143   2HB   LEU  20          2HB       LEU  20   5.580   2.286   0.291
  144    HG   LEU  20           HG       LEU  20   3.642   1.409   1.552
  145   1HD1  LEU  20          1HD1      LEU  20   4.430  -1.141   0.149
  146   2HD1  LEU  20          2HD1      LEU  20   3.651  -1.219   1.729
  147   3HD1  LEU  20          3HD1      LEU  20   2.824  -0.446   0.379
  148   1HD2  LEU  20          1HD2      LEU  20   6.344   0.115   1.958
  149   2HD2  LEU  20          2HD2      LEU  20   5.638   1.477   2.827
  150   3HD2  LEU  20          3HD2      LEU  20   5.017  -0.153   3.088
  151    H    ALA  21           H        ALA  21   4.255   4.043  -0.642
  152    HA   ALA  21           HA       ALA  21   1.790   4.308   0.787
  153   1HB   ALA  21          1HB       ALA  21   3.808   5.846   0.927
  154   2HB   ALA  21          2HB       ALA  21   3.288   6.530  -0.612
  155   3HB   ALA  21          3HB       ALA  21   2.247   6.659   0.807
  156    H    GLU  22           H        GLU  22   2.706   4.886  -2.593
  157    HA   GLU  22           HA       GLU  22   0.284   6.124  -3.439
  158   1HB   GLU  22          1HB       GLU  22   2.384   5.953  -4.815
  159   2HB   GLU  22          2HB       GLU  22   2.012   4.249  -5.079
  160   1HG   GLU  22          1HG       GLU  22  -0.099   4.831  -6.147
  161   2HG   GLU  22          2HG       GLU  22   0.172   6.542  -5.812
  162    H    ALA  23           H        ALA  23   1.166   2.677  -3.160
  163    HA   ALA  23           HA       ALA  23  -1.158   1.606  -4.396
  164   1HB   ALA  23          1HB       ALA  23  -0.750  -0.349  -2.735
  165   2HB   ALA  23          2HB       ALA  23   0.540   0.036  -3.874
  166   3HB   ALA  23          3HB       ALA  23   0.652   0.584  -2.204
  167    H    LYS  24           H        LYS  24  -0.576   2.709  -1.078
  168    HA   LYS  24           HA       LYS  24  -3.158   1.942  -0.061
  169   1HB   LYS  24          1HB       LYS  24  -1.207   4.086   0.840
  170   2HB   LYS  24          2HB       LYS  24  -2.632   3.586   1.756
  171   1HG   LYS  24          1HG       LYS  24  -1.776   1.269   1.834
  172   2HG   LYS  24          2HG       LYS  24  -0.351   1.768   0.924
  173   1HD   LYS  24          1HD       LYS  24   0.267   3.330   2.733
  174   2HD   LYS  24          2HD       LYS  24  -1.157   2.830   3.645
  175   1HE   LYS  24          1HE       LYS  24   0.821   1.613   4.443
  176   2HE   LYS  24          2HE       LYS  24  -0.308   0.500   3.670
  177   1HZ   LYS  24          1HZ       LYS  24   1.895   1.768   2.163
  178   2HZ   LYS  24          2HZ       LYS  24   2.129   0.327   3.027
  179   3HZ   LYS  24          3HZ       LYS  24   0.998   0.383   1.761
  180    H    VAL  25           H        VAL  25  -1.892   4.903  -1.565
  181    HA   VAL  25           HA       VAL  25  -4.256   6.493  -1.217
  182    HB   VAL  25           HB       VAL  25  -2.001   6.619  -3.237
  183   1HG1  VAL  25          1HG1      VAL  25  -4.321   8.502  -2.753
  184   2HG1  VAL  25          2HG1      VAL  25  -2.844   8.990  -3.582
  185   3HG1  VAL  25          3HG1      VAL  25  -3.866   7.729  -4.271
  186   1HG2  VAL  25          1HG2      VAL  25  -1.461   7.017  -0.830
  187   2HG2  VAL  25          2HG2      VAL  25  -1.217   8.454  -1.824
  188   3HG2  VAL  25          3HG2      VAL  25  -2.653   8.317  -0.809
  189    H    LEU  26           H        LEU  26  -3.127   4.454  -3.929
  190    HA   LEU  26           HA       LEU  26  -5.385   4.921  -5.628
  191   1HB   LEU  26          1HB       LEU  26  -3.468   2.586  -5.392
  192   2HB   LEU  26          2HB       LEU  26  -4.708   2.673  -6.640
  193    HG   LEU  26           HG       LEU  26  -2.559   4.775  -6.205
  194   1HD1  LEU  26          1HD1      LEU  26  -2.744   2.476  -8.180
  195   2HD1  LEU  26          2HD1      LEU  26  -1.561   3.780  -8.284
  196   3HD1  LEU  26          3HD1      LEU  26  -1.535   2.674  -6.911
  197   1HD2  LEU  26          1HD2      LEU  26  -4.782   4.384  -8.218
  198   2HD2  LEU  26          2HD2      LEU  26  -4.293   5.860  -7.384
  199   3HD2  LEU  26          3HD2      LEU  26  -3.309   5.227  -8.695
  200    H    ALA  27           H        ALA  27  -4.758   2.480  -3.126
  201    HA   ALA  27           HA       ALA  27  -7.260   1.082  -3.513
  202   1HB   ALA  27          1HB       ALA  27  -5.178   0.182  -2.346
  203   2HB   ALA  27          2HB       ALA  27  -5.625   1.184  -0.966
  204   3HB   ALA  27          3HB       ALA  27  -6.702  -0.105  -1.506
  205    H    ASN  28           H        ASN  28  -6.208   3.798  -1.540
  206    HA   ASN  28           HA       ASN  28  -8.430   3.972   0.222
  207   1HB   ASN  28          1HB       ASN  28  -6.355   5.298   0.482
  208   2HB   ASN  28          2HB       ASN  28  -6.775   6.226  -0.957
  209   2HD2  ASN  28          2HD2      ASN  28  -7.602   5.682   2.435
  210   1HD2  ASN  28          1HD2      ASN  28  -8.647   7.013   2.581
  211    H    ARG  29           H        ARG  29  -7.934   5.480  -2.992
  212    HA   ARG  29           HA       ARG  29 -10.519   6.766  -2.998
  213   1HB   ARG  29          1HB       ARG  29  -8.612   6.067  -5.251
  214   2HB   ARG  29          2HB       ARG  29 -10.100   6.985  -5.484
  215   1HG   ARG  29          1HG       ARG  29  -9.258   8.607  -3.725
  216   2HG   ARG  29          2HG       ARG  29  -7.711   7.762  -3.795
  217   1HD   ARG  29          1HD       ARG  29  -9.107   9.149  -6.102
  218   2HD   ARG  29          2HD       ARG  29  -7.639   9.692  -5.289
  219    HE   ARG  29           HE       ARG  29  -6.954   7.178  -6.178
  220   1HH1  ARG  29          1HH1      ARG  29  -6.085   6.792  -8.237
  221   2HH1  ARG  29          2HH1      ARG  29  -6.418   7.904  -9.523
  222   1HH2  ARG  29          1HH2      ARG  29  -8.363  10.001  -7.565
  223   2HH2  ARG  29          2HH2      ARG  29  -7.707   9.720  -9.143
  224    H    GLU  30           H        GLU  30  -9.395   3.569  -3.876
  225    HA   GLU  30           HA       GLU  30 -11.546   2.777  -5.560
  226   1HB   GLU  30          1HB       GLU  30  -9.488   1.439  -5.247
  227   2HB   GLU  30          2HB       GLU  30  -9.970   1.093  -3.587
  228   1HG   GLU  30          1HG       GLU  30 -12.001  -0.042  -4.401
  229   2HG   GLU  30          2HG       GLU  30 -11.542   0.322  -6.065
  230    H    LEU  31           H        LEU  31 -11.267   2.754  -2.011
  231    HA   LEU  31           HA       LEU  31 -13.706   1.377  -1.457
  232   1HB   LEU  31          1HB       LEU  31 -12.595   3.683   0.163
  233   2HB   LEU  31          2HB       LEU  31 -13.572   2.336   0.741
  234    HG   LEU  31           HG       LEU  31 -10.766   2.185  -0.360
  235   1HD1  LEU  31          1HD1      LEU  31 -11.975   1.984   2.406
  236   2HD1  LEU  31          2HD1      LEU  31 -10.415   1.254   2.039
  237   3HD1  LEU  31          3HD1      LEU  31 -10.633   2.992   1.862
  238   1HD2  LEU  31          1HD2      LEU  31 -12.777   0.063   0.428
  239   2HD2  LEU  31          2HD2      LEU  31 -11.779   0.148  -1.025
  240   3HD2  LEU  31          3HD2      LEU  31 -11.045  -0.257   0.524
  241    H    ASP  32           H        ASP  32 -13.006   4.752  -2.108
  242    HA   ASP  32           HA       ASP  32 -15.499   5.881  -1.438
  243   1HB   ASP  32          1HB       ASP  32 -13.415   7.125  -1.925
  244   2HB   ASP  32          2HB       ASP  32 -13.593   6.717  -3.631
  245    H    LYS  33           H        LYS  33 -14.471   4.430  -4.566
  246    HA   LYS  33           HA       LYS  33 -16.853   5.232  -5.942
  247   1HB   LYS  33          1HB       LYS  33 -16.154   3.883  -7.722
  248   2HB   LYS  33          2HB       LYS  33 -14.651   4.347  -6.940
  249   1HG   LYS  33          1HG       LYS  33 -14.222   2.090  -7.070
  250   2HG   LYS  33          2HG       LYS  33 -15.141   2.057  -5.581
  251   1HD   LYS  33          1HD       LYS  33 -16.304   0.434  -6.751
  252   2HD   LYS  33          2HD       LYS  33 -17.213   1.848  -7.277
  253   1HE   LYS  33          1HE       LYS  33 -14.953   0.478  -8.759
  254   2HE   LYS  33          2HE       LYS  33 -16.649   0.540  -9.234
  255   1HZ   LYS  33          1HZ       LYS  33 -15.064   3.002  -8.857
  256   2HZ   LYS  33          2HZ       LYS  33 -15.051   2.165 -10.331
  257   3HZ   LYS  33          3HZ       LYS  33 -16.509   2.794  -9.725
  258    H    TYR  34           H        TYR  34 -16.110   2.303  -4.058
  259    HA   TYR  34           HA       TYR  34 -18.653   1.042  -4.646
  260   1HB   TYR  34          1HB       TYR  34 -16.594   0.575  -2.477
  261   2HB   TYR  34          2HB       TYR  34 -18.061  -0.394  -2.636
  262    HD1  TYR  34           HD1      TYR  34 -18.502  -1.604  -4.825
  263    HD2  TYR  34           HD2      TYR  34 -14.714   0.176  -3.879
  264    HE1  TYR  34           HE1      TYR  34 -17.420  -2.970  -6.588
  265    HE2  TYR  34           HE2      TYR  34 -13.630  -1.185  -5.643
  266    HH   TYR  34           HH       TYR  34 -13.939  -2.642  -7.288
  267    H    GLY  35           H        GLY  35 -17.444   3.126  -2.049
  268   1HA   GLY  35          1HA       GLY  35 -20.241   3.765  -1.315
  269   2HA   GLY  35          2HA       GLY  35 -18.801   4.623  -0.765
  270    H    VAL  36           H        VAL  36 -17.459   2.035  -0.058
  271    HA   VAL  36           HA       VAL  36 -19.075   0.700   1.925
  272    HB   VAL  36           HB       VAL  36 -16.809  -0.158   2.713
  273   1HG1  VAL  36          1HG1      VAL  36 -18.264  -1.308   1.030
  274   2HG1  VAL  36          2HG1      VAL  36 -17.405  -0.443  -0.244
  275   3HG1  VAL  36          3HG1      VAL  36 -16.544  -1.599   0.772
  276   1HG2  VAL  36          1HG2      VAL  36 -15.631   1.929   1.804
  277   2HG2  VAL  36          2HG2      VAL  36 -14.865   0.381   1.448
  278   3HG2  VAL  36          3HG2      VAL  36 -15.810   1.202   0.207
  279    H    SER  37           H        SER  37 -17.652   0.631   4.241
  280    HA   SER  37           HA       SER  37 -18.358   3.138   5.483
  281   1HB   SER  37          1HB       SER  37 -18.438   1.004   6.711
  282   2HB   SER  37          2HB       SER  37 -16.693   0.836   6.546
  283    HG   SER  37           HG       SER  37 -17.670   3.222   7.603
  284    H    ASP  38           H        ASP  38 -16.951   4.712   6.401
  285    HA   ASP  38           HA       ASP  38 -14.447   5.093   4.906
  286   1HB   ASP  38          1HB       ASP  38 -14.373   7.269   6.020
  287   2HB   ASP  38          2HB       ASP  38 -15.998   6.992   5.393
  288    H    TYR  39           H        TYR  39 -15.178   3.233   7.477
  289    HA   TYR  39           HA       TYR  39 -12.963   3.961   9.254
  290   1HB   TYR  39          1HB       TYR  39 -14.910   2.980  10.278
  291   2HB   TYR  39          2HB       TYR  39 -14.877   1.612   9.167
  292    HD1  TYR  39           HD1      TYR  39 -13.306   3.146  12.131
  293    HD2  TYR  39           HD2      TYR  39 -13.234  -0.162   9.394
  294    HE1  TYR  39           HE1      TYR  39 -11.809   1.902  13.669
  295    HE2  TYR  39           HE2      TYR  39 -11.743  -1.403  10.925
  296    HH   TYR  39           HH       TYR  39 -10.061  -0.778  12.766
  297    H    TYR  40           H        TYR  40 -13.652   1.404   6.887
  298    HA   TYR  40           HA       TYR  40 -11.305  -0.150   7.258
  299   1HB   TYR  40          1HB       TYR  40 -12.875   0.331   4.705
  300   2HB   TYR  40          2HB       TYR  40 -11.744  -0.993   4.980
  301    HD1  TYR  40           HD1      TYR  40 -15.146  -0.156   5.023
  302    HD2  TYR  40           HD2      TYR  40 -12.203  -2.301   7.312
  303    HE1  TYR  40           HE1      TYR  40 -16.942  -1.495   6.085
  304    HE2  TYR  40           HE2      TYR  40 -14.004  -3.635   8.372
  305    HH   TYR  40           HH       TYR  40 -17.433  -3.056   7.578
  306    H    LYS  41           H        LYS  41 -11.778   2.865   5.483
  307    HA   LYS  41           HA       LYS  41  -9.431   2.749   3.886
  308   1HB   LYS  41          1HB       LYS  41  -9.694   5.112   3.578
  309   2HB   LYS  41          2HB       LYS  41 -11.317   4.443   3.710
  310   1HG   LYS  41          1HG       LYS  41 -11.645   6.089   5.271
  311   2HG   LYS  41          2HG       LYS  41 -10.783   5.008   6.350
  312   1HD   LYS  41          1HD       LYS  41  -9.571   6.981   6.629
  313   2HD   LYS  41          2HD       LYS  41  -8.634   6.188   5.366
  314   1HE   LYS  41          1HE       LYS  41  -8.978   8.461   4.656
  315   2HE   LYS  41          2HE       LYS  41 -10.042   7.455   3.674
  316   1HZ   LYS  41          1HZ       LYS  41 -10.895   8.819   6.166
  317   2HZ   LYS  41          2HZ       LYS  41 -11.119   9.467   4.615
  318   3HZ   LYS  41          3HZ       LYS  41 -11.886   8.013   5.046
  319    H    ASN  42           H        ASN  42  -9.957   3.607   7.252
  320    HA   ASN  42           HA       ASN  42  -7.313   4.643   7.698
  321   1HB   ASN  42          1HB       ASN  42  -9.410   3.541   9.581
  322   2HB   ASN  42          2HB       ASN  42  -7.878   4.215  10.136
  323   2HD2  ASN  42          2HD2      ASN  42 -10.942   5.151  10.059
  324   1HD2  ASN  42          1HD2      ASN  42 -10.792   6.782   9.612
  325    H    LEU  43           H        LEU  43  -8.806   1.455   7.987
  326    HA   LEU  43           HA       LEU  43  -6.644   0.125   9.255
  327   1HB   LEU  43          1HB       LEU  43  -8.879  -0.881   8.987
  328   2HB   LEU  43          2HB       LEU  43  -8.644  -0.956   7.243
  329    HG   LEU  43           HG       LEU  43  -6.745  -2.482   7.549
  330   1HD1  LEU  43          1HD1      LEU  43  -7.283  -1.912  10.458
  331   2HD1  LEU  43          2HD1      LEU  43  -6.602  -3.471   9.994
  332   3HD1  LEU  43          3HD1      LEU  43  -5.741  -1.984   9.604
  333   1HD2  LEU  43          1HD2      LEU  43  -9.234  -3.325   9.065
  334   2HD2  LEU  43          2HD2      LEU  43  -9.006  -3.424   7.319
  335   3HD2  LEU  43          3HD2      LEU  43  -8.030  -4.425   8.393
  336    H    ILE  44           H        ILE  44  -7.278   0.730   5.790
  337    HA   ILE  44           HA       ILE  44  -5.057  -0.763   4.791
  338    HB   ILE  44           HB       ILE  44  -6.463   1.693   3.708
  339   1HG1  ILE  44          1HG1      ILE  44  -6.519  -1.200   2.817
  340   2HG1  ILE  44          2HG1      ILE  44  -7.692  -0.508   3.938
  341   1HG2  ILE  44          1HG2      ILE  44  -4.292  -0.035   2.501
  342   2HG2  ILE  44          2HG2      ILE  44  -5.361   0.967   1.523
  343   3HG2  ILE  44          3HG2      ILE  44  -4.283   1.716   2.701
  344   1HD1  ILE  44          1HD1      ILE  44  -8.085   1.277   2.104
  345   2HD1  ILE  44          2HD1      ILE  44  -7.251   0.153   1.031
  346   3HD1  ILE  44          3HD1      ILE  44  -8.740  -0.338   1.835
  347    H    ASN  45           H        ASN  45  -5.331   2.574   5.952
  348    HA   ASN  45           HA       ASN  45  -2.696   3.418   5.285
  349   1HB   ASN  45          1HB       ASN  45  -4.549   4.244   7.536
  350   2HB   ASN  45          2HB       ASN  45  -3.014   5.048   7.201
  351   2HD2  ASN  45          2HD2      ASN  45  -5.596   6.365   6.952
  352   1HD2  ASN  45          1HD2      ASN  45  -5.810   6.760   5.315
  353    H    ASN  46           H        ASN  46  -3.973   1.698   8.107
  354    HA   ASN  46           HA       ASN  46  -1.499   1.720   9.587
  355   1HB   ASN  46          1HB       ASN  46  -3.951  -0.054   9.714
  356   2HB   ASN  46          2HB       ASN  46  -2.606  -0.182  10.849
  357   2HD2  ASN  46          2HD2      ASN  46  -5.395   0.682  11.468
  358   1HD2  ASN  46          1HD2      ASN  46  -5.268   2.255  12.093
  359    H    ALA  47           H        ALA  47  -2.634  -0.175   6.902
  360    HA   ALA  47           HA       ALA  47  -1.124  -2.562   7.317
  361   1HB   ALA  47          1HB       ALA  47  -1.767  -1.208   4.677
  362   2HB   ALA  47          2HB       ALA  47  -1.324  -2.901   4.898
  363   3HB   ALA  47          3HB       ALA  47  -2.852  -2.298   5.540
  364    H    LYS  48           H        LYS  48   1.032  -3.044   6.934
  365    HA   LYS  48           HA       LYS  48   2.812  -0.738   6.232
  366   1HB   LYS  48          1HB       LYS  48   4.578  -2.095   7.385
  367   2HB   LYS  48          2HB       LYS  48   3.245  -1.620   8.439
  368   1HG   LYS  48          1HG       LYS  48   2.196  -3.828   8.115
  369   2HG   LYS  48          2HG       LYS  48   3.527  -4.306   7.065
  370   1HD   LYS  48          1HD       LYS  48   5.113  -3.948   8.944
  371   2HD   LYS  48          2HD       LYS  48   3.749  -3.553   9.991
  372   1HE   LYS  48          1HE       LYS  48   4.398  -5.915  10.264
  373   2HE   LYS  48          2HE       LYS  48   2.780  -5.786   9.571
  374   1HZ   LYS  48          1HZ       LYS  48   5.181  -6.020   7.864
  375   2HZ   LYS  48          2HZ       LYS  48   4.395  -7.394   8.479
  376   3HZ   LYS  48          3HZ       LYS  48   3.560  -6.327   7.460
  377    H    THR  49           H        THR  49   1.481  -3.378   4.732
  378    HA   THR  49           HA       THR  49   3.792  -3.550   2.833
  379    HB   THR  49           HB       THR  49   3.221  -6.013   2.558
  380    HG1  THR  49           HG1      THR  49   2.138  -5.873   5.129
  381   1HG2  THR  49          1HG2      THR  49   4.475  -4.836   5.024
  382   2HG2  THR  49          2HG2      THR  49   4.312  -6.585   4.883
  383   3HG2  THR  49          3HG2      THR  49   5.239  -5.687   3.682
  384    H    VAL  50           H        VAL  50   3.181  -3.709   0.673
  385    HA   VAL  50           HA       VAL  50   0.480  -2.891   0.016
  386    HB   VAL  50           HB       VAL  50   2.358  -2.173  -1.353
  387   1HG1  VAL  50          1HG1      VAL  50   3.726  -4.244  -1.026
  388   2HG1  VAL  50          2HG1      VAL  50   2.642  -5.089  -2.133
  389   3HG1  VAL  50          3HG1      VAL  50   3.627  -3.746  -2.715
  390   1HG2  VAL  50          1HG2      VAL  50   0.076  -2.525  -2.378
  391   2HG2  VAL  50          2HG2      VAL  50   1.406  -2.617  -3.531
  392   3HG2  VAL  50          3HG2      VAL  50   0.642  -4.095  -2.949
  393    H    GLU  51           H        GLU  51   2.159  -5.974   0.133
  394    HA   GLU  51           HA       GLU  51   0.373  -7.477  -1.498
  395   1HB   GLU  51          1HB       GLU  51   1.966  -8.274   0.959
  396   2HB   GLU  51          2HB       GLU  51   1.082  -9.426  -0.042
  397   1HG   GLU  51          1HG       GLU  51   2.396  -8.731  -2.011
  398   2HG   GLU  51          2HG       GLU  51   3.285  -7.580  -1.011
  399    H    GLY  52           H        GLY  52   0.259  -6.535   1.907
  400   1HA   GLY  52          1HA       GLY  52  -1.491  -6.659   3.467
  401   2HA   GLY  52          2HA       GLY  52  -2.181  -7.961   2.496
  402    H    VAL  53           H        VAL  53  -1.428  -4.754   1.182
  403    HA   VAL  53           HA       VAL  53  -3.984  -3.551   1.564
  404    HB   VAL  53           HB       VAL  53  -1.941  -3.185  -0.643
  405   1HG1  VAL  53          1HG1      VAL  53  -4.482  -1.682   0.000
  406   2HG1  VAL  53          2HG1      VAL  53  -3.159  -0.948  -0.907
  407   3HG1  VAL  53          3HG1      VAL  53  -3.986  -2.368  -1.547
  408   1HG2  VAL  53          1HG2      VAL  53  -1.334  -2.655   1.771
  409   2HG2  VAL  53          2HG2      VAL  53  -1.197  -1.304   0.646
  410   3HG2  VAL  53          3HG2      VAL  53  -2.586  -1.417   1.725
  411    H    LYS  54           H        LYS  54  -2.733  -5.411  -1.227
  412    HA   LYS  54           HA       LYS  54  -5.205  -5.350  -2.690
  413   1HB   LYS  54          1HB       LYS  54  -3.027  -5.884  -3.738
  414   2HB   LYS  54          2HB       LYS  54  -2.959  -7.378  -2.803
  415   1HG   LYS  54          1HG       LYS  54  -4.899  -8.262  -3.910
  416   2HG   LYS  54          2HG       LYS  54  -5.238  -6.711  -4.677
  417   1HD   LYS  54          1HD       LYS  54  -4.183  -8.204  -6.298
  418   2HD   LYS  54          2HD       LYS  54  -3.083  -6.882  -5.913
  419   1HE   LYS  54          1HE       LYS  54  -2.937  -9.470  -4.375
  420   2HE   LYS  54          2HE       LYS  54  -2.147  -9.318  -5.943
  421   1HZ   LYS  54          1HZ       LYS  54  -1.600  -7.047  -4.355
  422   2HZ   LYS  54          2HZ       LYS  54  -1.196  -8.455  -3.496
  423   3HZ   LYS  54          3HZ       LYS  54  -0.516  -8.166  -5.025
  424    H    ALA  55           H        ALA  55  -3.828  -7.667  -0.379
  425    HA   ALA  55           HA       ALA  55  -5.996  -9.571  -0.681
  426   1HB   ALA  55          1HB       ALA  55  -5.013 -10.645   1.317
  427   2HB   ALA  55          2HB       ALA  55  -3.962  -9.247   1.546
  428   3HB   ALA  55          3HB       ALA  55  -3.775 -10.268   0.119
  429    H    LEU  56           H        LEU  56  -5.804  -6.556   0.851
  430    HA   LEU  56           HA       LEU  56  -7.663  -7.220   3.024
  431   1HB   LEU  56          1HB       LEU  56  -5.890  -5.362   3.133
  432   2HB   LEU  56          2HB       LEU  56  -6.946  -4.440   2.065
  433    HG   LEU  56           HG       LEU  56  -8.806  -4.995   3.827
  434   1HD1  LEU  56          1HD1      LEU  56  -6.268  -5.475   5.419
  435   2HD1  LEU  56          2HD1      LEU  56  -7.828  -5.117   6.154
  436   3HD1  LEU  56          3HD1      LEU  56  -7.618  -6.587   5.209
  437   1HD2  LEU  56          1HD2      LEU  56  -6.544  -3.036   4.242
  438   2HD2  LEU  56          2HD2      LEU  56  -8.121  -2.742   3.505
  439   3HD2  LEU  56          3HD2      LEU  56  -7.998  -3.027   5.241
  440    H    ILE  57           H        ILE  57  -7.756  -5.273   0.045
  441    HA   ILE  57           HA       ILE  57 -10.518  -4.604   0.169
  442    HB   ILE  57           HB       ILE  57  -8.924  -5.036  -2.362
  443   1HG1  ILE  57          1HG1      ILE  57  -7.741  -3.574  -0.615
  444   2HG1  ILE  57          2HG1      ILE  57  -8.033  -2.829  -2.179
  445   1HG2  ILE  57          1HG2      ILE  57 -11.311  -3.332  -1.638
  446   2HG2  ILE  57          2HG2      ILE  57 -10.406  -3.147  -3.140
  447   3HG2  ILE  57          3HG2      ILE  57 -11.242  -4.659  -2.796
  448   1HD1  ILE  57          1HD1      ILE  57  -9.809  -2.451   0.256
  449   2HD1  ILE  57          2HD1      ILE  57  -8.575  -1.318  -0.274
  450   3HD1  ILE  57          3HD1      ILE  57  -9.973  -1.630  -1.294
  451    H    ASP  58           H        ASP  58  -8.892  -7.346  -1.466
  452    HA   ASP  58           HA       ASP  58 -11.257  -8.360  -2.695
  453   1HB   ASP  58          1HB       ASP  58 -10.066 -10.518  -2.832
  454   2HB   ASP  58          2HB       ASP  58  -9.016  -9.179  -3.296
  455    H    GLU  59           H        GLU  59  -9.922  -8.945   0.551
  456    HA   GLU  59           HA       GLU  59 -11.935 -10.895   1.258
  457   1HB   GLU  59          1HB       GLU  59  -9.957  -9.230   2.809
  458   2HB   GLU  59          2HB       GLU  59 -11.183 -10.174   3.654
  459   1HG   GLU  59          1HG       GLU  59  -8.946 -11.346   3.298
  460   2HG   GLU  59          2HG       GLU  59 -10.364 -12.229   2.739
  461    H    ILE  60           H        ILE  60 -11.601  -7.396   1.638
  462    HA   ILE  60           HA       ILE  60 -13.982  -7.038   3.180
  463    HB   ILE  60           HB       ILE  60 -12.440  -5.176   1.361
  464   1HG1  ILE  60          1HG1      ILE  60 -12.706  -5.182   4.375
  465   2HG1  ILE  60          2HG1      ILE  60 -11.442  -6.083   3.536
  466   1HG2  ILE  60          1HG2      ILE  60 -14.851  -4.665   3.116
  467   2HG2  ILE  60          2HG2      ILE  60 -13.749  -3.379   2.624
  468   3HG2  ILE  60          3HG2      ILE  60 -14.656  -4.277   1.407
  469   1HD1  ILE  60          1HD1      ILE  60 -11.920  -3.116   3.142
  470   2HD1  ILE  60          2HD1      ILE  60 -10.750  -3.768   4.291
  471   3HD1  ILE  60          3HD1      ILE  60 -10.549  -4.062   2.563
  472    H    LEU  61           H        LEU  61 -13.369  -6.710  -0.327
  473    HA   LEU  61           HA       LEU  61 -16.146  -6.228  -0.957
  474   1HB   LEU  61          1HB       LEU  61 -13.804  -7.142  -2.654
  475   2HB   LEU  61          2HB       LEU  61 -15.403  -6.808  -3.316
  476    HG   LEU  61           HG       LEU  61 -13.702  -4.817  -1.780
  477   1HD1  LEU  61          1HD1      LEU  61 -12.929  -5.555  -4.128
  478   2HD1  LEU  61          2HD1      LEU  61 -14.381  -4.751  -4.723
  479   3HD1  LEU  61          3HD1      LEU  61 -13.150  -3.824  -3.866
  480   1HD2  LEU  61          1HD2      LEU  61 -16.477  -4.742  -2.940
  481   2HD2  LEU  61          2HD2      LEU  61 -15.861  -4.000  -1.464
  482   3HD2  LEU  61          3HD2      LEU  61 -15.502  -3.276  -3.028
  483    H    ALA  62           H        ALA  62 -14.108  -9.133  -0.895
  484    HA   ALA  62           HA       ALA  62 -16.047 -10.915  -2.008
  485   1HB   ALA  62          1HB       ALA  62 -13.707 -11.579  -1.776
  486   2HB   ALA  62          2HB       ALA  62 -13.820 -11.451  -0.020
  487   3HB   ALA  62          3HB       ALA  62 -14.724 -12.701  -0.875
  488    H    ALA  63           H        ALA  63 -15.738  -9.476   1.149
  489    HA   ALA  63           HA       ALA  63 -17.236 -11.343   2.685
  490   1HB   ALA  63          1HB       ALA  63 -17.699  -9.431   4.191
  491   2HB   ALA  63          2HB       ALA  63 -16.003  -9.476   3.710
  492   3HB   ALA  63          3HB       ALA  63 -17.104  -8.324   2.955
  493    H    LEU  64           H        LEU  64 -18.251  -8.726   0.536
  494    HA   LEU  64           HA       LEU  64 -21.082  -9.683   0.805
  495   1HB   LEU  64          1HB       LEU  64 -21.844  -7.402   0.658
  496   2HB   LEU  64          2HB       LEU  64 -20.566  -7.434   1.862
  497    HG   LEU  64           HG       LEU  64 -18.977  -6.860  -0.135
  498   1HD1  LEU  64          1HD1      LEU  64 -21.544  -6.787  -1.498
  499   2HD1  LEU  64          2HD1      LEU  64 -20.824  -5.181  -1.520
  500   3HD1  LEU  64          3HD1      LEU  64 -19.929  -6.556  -2.155
  501   1HD2  LEU  64          1HD2      LEU  64 -20.935  -4.848   1.020
  502   2HD2  LEU  64          2HD2      LEU  64 -19.408  -5.355   1.742
  503   3HD2  LEU  64          3HD2      LEU  64 -19.410  -4.432   0.239
  504    HA   PRO  65           HA       PRO  65 -20.777 -10.327  -3.598
  505   1HB   PRO  65          1HB       PRO  65 -23.394  -9.489  -4.321
  506   2HB   PRO  65          2HB       PRO  65 -22.897 -11.125  -3.877
  507   1HG   PRO  65          1HG       PRO  65 -24.395  -9.136  -2.286
  508   2HG   PRO  65          2HG       PRO  65 -24.322 -10.893  -2.100
  509   1HD   PRO  65          1HD       PRO  65 -23.058  -9.042  -0.414
  510   2HD   PRO  65          2HD       PRO  65 -22.624 -10.763  -0.545

  No H/Q in entry =         510
  Start of MODEL   22
    1    H1   MET   1           H1       MET   1  41.503  -2.679 -16.651
    2    H2   MET   1           H2       MET   1  41.100  -3.358 -18.155
    3    H3   MET   1           H3       MET   1  39.915  -2.558 -17.243
    4    HA   MET   1           HA       MET   1  39.471  -4.811 -16.903
    5   1HB   MET   1          1HB       MET   1  41.334  -6.358 -16.188
    6   2HB   MET   1          2HB       MET   1  41.491  -5.752 -17.838
    7   1HG   MET   1          1HG       MET   1  43.049  -4.005 -17.051
    8   2HG   MET   1          2HG       MET   1  42.894  -4.611 -15.401
    9   1HE   MET   1          1HE       MET   1  45.391  -4.437 -15.570
   10   2HE   MET   1          2HE       MET   1  46.462  -5.651 -16.264
   11   3HE   MET   1          3HE       MET   1  45.759  -4.395 -17.292
   12    H    LYS   2           H        LYS   2  40.579  -2.259 -15.220
   13    HA   LYS   2           HA       LYS   2  40.955  -3.349 -12.576
   14   1HB   LYS   2          1HB       LYS   2  41.723  -1.077 -13.208
   15   2HB   LYS   2          2HB       LYS   2  40.041  -0.575 -13.395
   16   1HG   LYS   2          1HG       LYS   2  39.586  -0.937 -11.062
   17   2HG   LYS   2          2HG       LYS   2  41.145  -1.724 -10.822
   18   1HD   LYS   2          1HD       LYS   2  41.235   0.576  -9.982
   19   2HD   LYS   2          2HD       LYS   2  42.289   0.406 -11.383
   20   1HE   LYS   2          1HE       LYS   2  39.441   1.326 -11.736
   21   2HE   LYS   2          2HE       LYS   2  40.695   2.470 -11.259
   22   1HZ   LYS   2          1HZ       LYS   2  41.592   0.830 -13.388
   23   2HZ   LYS   2          2HZ       LYS   2  40.134   1.586 -13.809
   24   3HZ   LYS   2          3HZ       LYS   2  41.464   2.522 -13.318
   25    H    ALA   3           H        ALA   3  39.442  -3.554 -10.888
   26    HA   ALA   3           HA       ALA   3  36.793  -4.314 -11.591
   27   1HB   ALA   3          1HB       ALA   3  37.942  -3.474  -8.914
   28   2HB   ALA   3          2HB       ALA   3  37.803  -5.118  -9.533
   29   3HB   ALA   3          3HB       ALA   3  36.351  -4.205  -9.124
   30    H    ILE   4           H        ILE   4  34.867  -3.206 -11.603
   31    HA   ILE   4           HA       ILE   4  34.966  -0.243 -11.104
   32    HB   ILE   4           HB       ILE   4  33.295  -1.807 -13.098
   33   1HG1  ILE   4          1HG1      ILE   4  35.500   0.214 -13.595
   34   2HG1  ILE   4          2HG1      ILE   4  35.762  -1.531 -13.609
   35   1HG2  ILE   4          1HG2      ILE   4  33.429   1.123 -12.361
   36   2HG2  ILE   4          2HG2      ILE   4  32.764   0.564 -13.895
   37   3HG2  ILE   4          3HG2      ILE   4  32.013   0.071 -12.379
   38   1HD1  ILE   4          1HD1      ILE   4  33.940  -1.702 -15.354
   39   2HD1  ILE   4          2HD1      ILE   4  33.937   0.059 -15.433
   40   3HD1  ILE   4          3HD1      ILE   4  35.383  -0.840 -15.892
   41    H    PHE   5           H        PHE   5  33.618   0.417  -9.481
   42    HA   PHE   5           HA       PHE   5  31.802  -1.519  -8.241
   43   1HB   PHE   5          1HB       PHE   5  33.080   0.095  -6.864
   44   2HB   PHE   5          2HB       PHE   5  32.234   1.428  -7.650
   45    HD1  PHE   5           HD1      PHE   5  29.860   1.855  -7.213
   46    HD2  PHE   5           HD2      PHE   5  31.936  -1.367  -5.274
   47    HE1  PHE   5           HE1      PHE   5  27.998   1.632  -5.589
   48    HE2  PHE   5           HE2      PHE   5  30.073  -1.592  -3.653
   49    HZ   PHE   5           HZ       PHE   5  28.104  -0.093  -3.810
   50    H    VAL   6           H        VAL   6  29.900  -1.899  -9.280
   51    HA   VAL   6           HA       VAL   6  28.129   0.398  -9.849
   52    HB   VAL   6           HB       VAL   6  29.393  -0.016 -11.970
   53   1HG1  VAL   6          1HG1      VAL   6  29.577  -2.536 -11.446
   54   2HG1  VAL   6          2HG1      VAL   6  27.945  -2.662 -12.106
   55   3HG1  VAL   6          3HG1      VAL   6  29.266  -2.077 -13.119
   56   1HG2  VAL   6          1HG2      VAL   6  26.913   0.717 -11.820
   57   2HG2  VAL   6          2HG2      VAL   6  27.484   0.102 -13.369
   58   3HG2  VAL   6          3HG2      VAL   6  26.533  -0.937 -12.307
   59    H    LEU   7           H        LEU   7  25.994  -0.157  -9.485
   60    HA   LEU   7           HA       LEU   7  25.119  -2.934  -9.565
   61   1HB   LEU   7          1HB       LEU   7  24.634  -3.227  -7.224
   62   2HB   LEU   7          2HB       LEU   7  26.323  -2.779  -7.371
   63    HG   LEU   7           HG       LEU   7  25.471  -1.516  -5.547
   64   1HD1  LEU   7          1HD1      LEU   7  26.854  -0.291  -7.299
   65   2HD1  LEU   7          2HD1      LEU   7  25.343   0.451  -7.831
   66   3HD1  LEU   7          3HD1      LEU   7  25.926   0.714  -6.191
   67   1HD2  LEU   7          1HD2      LEU   7  22.973  -1.740  -6.671
   68   2HD2  LEU   7          2HD2      LEU   7  23.372  -0.671  -5.331
   69   3HD2  LEU   7          3HD2      LEU   7  23.325  -0.040  -6.972
   70    H    ASN   8           H        ASN   8  22.770  -3.113  -9.110
   71    HA   ASN   8           HA       ASN   8  21.269  -0.582  -8.925
   72   1HB   ASN   8          1HB       ASN   8  21.215  -2.328 -11.405
   73   2HB   ASN   8          2HB       ASN   8  20.042  -1.055 -11.063
   74   2HD2  ASN   8          2HD2      ASN   8  21.492   1.065 -10.171
   75   1HD2  ASN   8          1HD2      ASN   8  22.687   1.525 -11.287
   76    H    ALA   9           H        ALA   9  21.631  -3.744  -8.137
   77    HA   ALA   9           HA       ALA   9  18.757  -4.456  -8.115
   78   1HB   ALA   9          1HB       ALA   9  20.487  -6.166  -8.654
   79   2HB   ALA   9          2HB       ALA   9  19.518  -6.609  -7.248
   80   3HB   ALA   9          3HB       ALA   9  21.149  -5.973  -7.032
   81    H    GLN  10           H        GLN  10  21.123  -4.981  -5.511
   82    HA   GLN  10           HA       GLN  10  19.103  -4.121  -3.543
   83   1HB   GLN  10          1HB       GLN  10  21.912  -5.232  -3.265
   84   2HB   GLN  10          2HB       GLN  10  20.909  -4.772  -1.889
   85   1HG   GLN  10          1HG       GLN  10  20.051  -6.768  -4.003
   86   2HG   GLN  10          2HG       GLN  10  20.789  -7.222  -2.467
   87   2HE2  GLN  10          2HE2      GLN  10  19.558  -5.584  -0.619
   88   1HE2  GLN  10          1HE2      GLN  10  17.877  -5.823  -0.630
   89    H    HIS  11           H        HIS  11  19.389  -2.323  -2.133
   90    HA   HIS  11           HA       HIS  11  21.748  -0.613  -2.409
   91   1HB   HIS  11          1HB       HIS  11  20.056  -0.151  -4.380
   92   2HB   HIS  11          2HB       HIS  11  19.126   0.693  -3.146
   93    HD1  HIS  11           HD1      HIS  11  20.798   2.432  -1.654
   94    HD2  HIS  11           HD2      HIS  11  21.878   1.524  -5.576
   95    HE1  HIS  11           HE1      HIS  11  22.416   4.236  -2.387
   96    H    ASP  12           H        ASP  12  21.409   1.422  -1.023
   97    HA   ASP  12           HA       ASP  12  20.680   0.705   1.606
   98   1HB   ASP  12          1HB       ASP  12  22.110   2.675   0.877
   99   2HB   ASP  12          2HB       ASP  12  20.610   3.524   0.499
  100    H    GLU  13           H        GLU  13  18.688   1.740  -1.044
  101    HA   GLU  13           HA       GLU  13  16.501   2.920   0.248
  102   1HB   GLU  13          1HB       GLU  13  15.160   2.244  -1.627
  103   2HB   GLU  13          2HB       GLU  13  16.781   2.543  -2.247
  104   1HG   GLU  13          1HG       GLU  13  17.219   0.050  -1.961
  105   2HG   GLU  13          2HG       GLU  13  15.489  -0.132  -1.669
  106    H    ALA  14           H        ALA  14  14.785   2.172   1.446
  107    HA   ALA  14           HA       ALA  14  14.532  -0.753   1.939
  108   1HB   ALA  14          1HB       ALA  14  15.009   1.398   3.997
  109   2HB   ALA  14          2HB       ALA  14  14.223  -0.124   4.420
  110   3HB   ALA  14          3HB       ALA  14  15.873  -0.123   3.792
  111    H    VAL  15           H        VAL  15  13.184   2.356   2.997
  112    HA   VAL  15           HA       VAL  15  10.427   1.258   2.519
  113    HB   VAL  15           HB       VAL  15  11.325   3.466   4.398
  114   1HG1  VAL  15          1HG1      VAL  15   8.632   2.136   3.969
  115   2HG1  VAL  15          2HG1      VAL  15   8.998   3.287   5.254
  116   3HG1  VAL  15          3HG1      VAL  15   9.040   3.805   3.569
  117   1HG2  VAL  15          1HG2      VAL  15  10.428   0.615   4.924
  118   2HG2  VAL  15          2HG2      VAL  15  12.061   1.243   5.146
  119   3HG2  VAL  15          3HG2      VAL  15  10.746   1.823   6.169
  120    H    ASP  16           H        ASP  16   9.424   2.153   0.797
  121    HA   ASP  16           HA       ASP  16  10.331   4.842  -0.177
  122   1HB   ASP  16          1HB       ASP  16   9.316   4.151  -2.339
  123   2HB   ASP  16          2HB       ASP  16  10.591   3.047  -1.822
  124    H    ALA  17           H        ALA  17   8.844   6.485  -0.362
  125    HA   ALA  17           HA       ALA  17   6.152   5.995   0.816
  126   1HB   ALA  17          1HB       ALA  17   7.710   7.866   1.623
  127   2HB   ALA  17          2HB       ALA  17   7.368   8.668   0.090
  128   3HB   ALA  17          3HB       ALA  17   6.058   8.339   1.227
  129    H    ASN  18           H        ASN  18   7.482   5.923  -2.194
  130    HA   ASN  18           HA       ASN  18   5.354   7.453  -3.568
  131   1HB   ASN  18          1HB       ASN  18   7.664   7.490  -4.457
  132   2HB   ASN  18          2HB       ASN  18   7.588   5.743  -4.700
  133   2HD2  ASN  18          2HD2      ASN  18   6.528   4.974  -6.579
  134   1HD2  ASN  18          1HD2      ASN  18   5.748   5.983  -7.700
  135    H    SER  19           H        SER  19   6.585   4.246  -4.472
  136    HA   SER  19           HA       SER  19   4.081   3.335  -5.449
  137   1HB   SER  19          1HB       SER  19   6.493   1.790  -4.473
  138   2HB   SER  19          2HB       SER  19   5.125   1.049  -5.298
  139    HG   SER  19           HG       SER  19   6.897   1.665  -6.689
  140    H    LEU  20           H        LEU  20   5.596   2.926  -2.259
  141    HA   LEU  20           HA       LEU  20   3.685   1.117  -1.183
  142   1HB   LEU  20          1HB       LEU  20   5.947   1.959  -0.208
  143   2HB   LEU  20          2HB       LEU  20   5.011   3.305   0.428
  144    HG   LEU  20           HG       LEU  20   5.234   1.563   2.124
  145   1HD1  LEU  20          1HD1      LEU  20   3.034   2.885   1.748
  146   2HD1  LEU  20          2HD1      LEU  20   2.390   1.349   1.167
  147   3HD1  LEU  20          3HD1      LEU  20   2.998   1.483   2.814
  148   1HD2  LEU  20          1HD2      LEU  20   5.288  -0.271   0.166
  149   2HD2  LEU  20          2HD2      LEU  20   4.793  -0.680   1.805
  150   3HD2  LEU  20          3HD2      LEU  20   3.574  -0.392   0.569
  151    H    ALA  21           H        ALA  21   3.823   4.680  -0.950
  152    HA   ALA  21           HA       ALA  21   1.283   4.962   0.317
  153   1HB   ALA  21          1HB       ALA  21   2.579   7.008  -1.491
  154   2HB   ALA  21          2HB       ALA  21   3.133   6.709   0.157
  155   3HB   ALA  21          3HB       ALA  21   1.496   7.301  -0.129
  156    H    GLU  22           H        GLU  22   2.270   4.932  -3.087
  157    HA   GLU  22           HA       GLU  22  -0.207   5.748  -4.209
  158   1HB   GLU  22          1HB       GLU  22   1.953   5.504  -5.468
  159   2HB   GLU  22          2HB       GLU  22   1.733   3.755  -5.407
  160   1HG   GLU  22          1HG       GLU  22  -0.417   3.976  -6.582
  161   2HG   GLU  22          2HG       GLU  22  -0.214   5.724  -6.644
  162    H    ALA  23           H        ALA  23   0.941   2.524  -3.239
  163    HA   ALA  23           HA       ALA  23  -1.239   1.033  -4.292
  164   1HB   ALA  23          1HB       ALA  23   0.382   0.526  -1.777
  165   2HB   ALA  23          2HB       ALA  23   0.783  -0.045  -3.397
  166   3HB   ALA  23          3HB       ALA  23  -0.652  -0.660  -2.576
  167    H    LYS  24           H        LYS  24  -0.840   2.562  -1.073
  168    HA   LYS  24           HA       LYS  24  -3.464   1.768  -0.158
  169   1HB   LYS  24          1HB       LYS  24  -1.587   3.967   0.743
  170   2HB   LYS  24          2HB       LYS  24  -3.110   3.599   1.552
  171   1HG   LYS  24          1HG       LYS  24  -2.303   1.220   1.813
  172   2HG   LYS  24          2HG       LYS  24  -0.736   1.743   1.203
  173   1HD   LYS  24          1HD       LYS  24  -2.020   3.148   3.550
  174   2HD   LYS  24          2HD       LYS  24  -1.090   1.671   3.783
  175   1HE   LYS  24          1HE       LYS  24   0.853   2.722   2.676
  176   2HE   LYS  24          2HE       LYS  24  -0.071   4.208   2.467
  177   1HZ   LYS  24          1HZ       LYS  24  -0.393   3.752   5.077
  178   2HZ   LYS  24          2HZ       LYS  24   1.164   3.119   4.846
  179   3HZ   LYS  24          3HZ       LYS  24   0.834   4.733   4.431
  180    H    VAL  25           H        VAL  25  -2.185   4.694  -1.745
  181    HA   VAL  25           HA       VAL  25  -4.602   6.208  -1.564
  182    HB   VAL  25           HB       VAL  25  -2.334   6.314  -3.560
  183   1HG1  VAL  25          1HG1      VAL  25  -4.810   8.017  -3.286
  184   2HG1  VAL  25          2HG1      VAL  25  -3.335   8.649  -4.015
  185   3HG1  VAL  25          3HG1      VAL  25  -4.154   7.267  -4.742
  186   1HG2  VAL  25          1HG2      VAL  25  -1.914   6.916  -1.137
  187   2HG2  VAL  25          2HG2      VAL  25  -1.613   8.230  -2.275
  188   3HG2  VAL  25          3HG2      VAL  25  -3.097   8.210  -1.323
  189    H    LEU  26           H        LEU  26  -3.348   4.143  -4.220
  190    HA   LEU  26           HA       LEU  26  -5.639   4.464  -5.891
  191   1HB   LEU  26          1HB       LEU  26  -3.651   2.186  -5.665
  192   2HB   LEU  26          2HB       LEU  26  -4.904   2.251  -6.902
  193    HG   LEU  26           HG       LEU  26  -2.758   4.354  -6.476
  194   1HD1  LEU  26          1HD1      LEU  26  -3.062   2.160  -8.553
  195   2HD1  LEU  26          2HD1      LEU  26  -1.863   3.452  -8.633
  196   3HD1  LEU  26          3HD1      LEU  26  -1.805   2.268  -7.325
  197   1HD2  LEU  26          1HD2      LEU  26  -5.151   4.135  -8.283
  198   2HD2  LEU  26          2HD2      LEU  26  -4.430   5.564  -7.541
  199   3HD2  LEU  26          3HD2      LEU  26  -3.680   4.840  -8.958
  200    H    ALA  27           H        ALA  27  -4.921   2.091  -3.338
  201    HA   ALA  27           HA       ALA  27  -7.352   0.590  -3.755
  202   1HB   ALA  27          1HB       ALA  27  -5.325  -0.268  -2.540
  203   2HB   ALA  27          2HB       ALA  27  -5.726   0.818  -1.208
  204   3HB   ALA  27          3HB       ALA  27  -6.831  -0.482  -1.651
  205    H    ASN  28           H        ASN  28  -6.451   3.267  -1.601
  206    HA   ASN  28           HA       ASN  28  -8.864   3.376  -0.084
  207   1HB   ASN  28          1HB       ASN  28  -6.823   4.647   0.495
  208   2HB   ASN  28          2HB       ASN  28  -7.039   5.646  -0.943
  209   2HD2  ASN  28          2HD2      ASN  28  -7.408   5.933   2.254
  210   1HD2  ASN  28          1HD2      ASN  28  -8.814   6.880   2.338
  211    H    ARG  29           H        ARG  29  -7.976   4.812  -3.202
  212    HA   ARG  29           HA       ARG  29 -10.312   6.390  -3.584
  213   1HB   ARG  29          1HB       ARG  29  -8.476   5.012  -5.564
  214   2HB   ARG  29          2HB       ARG  29  -9.752   6.125  -6.047
  215   1HG   ARG  29          1HG       ARG  29  -7.710   6.962  -3.990
  216   2HG   ARG  29          2HG       ARG  29  -7.318   7.046  -5.699
  217   1HD   ARG  29          1HD       ARG  29  -9.636   8.435  -4.326
  218   2HD   ARG  29          2HD       ARG  29  -8.184   9.209  -4.936
  219    HE   ARG  29           HE       ARG  29 -10.557   8.533  -6.436
  220   1HH1  ARG  29          1HH1      ARG  29 -10.567   8.357  -8.673
  221   2HH1  ARG  29          2HH1      ARG  29  -9.064   8.300  -9.532
  222   1HH2  ARG  29          1HH2      ARG  29  -7.113   8.542  -6.681
  223   2HH2  ARG  29          2HH2      ARG  29  -7.114   8.405  -8.407
  224    H    GLU  30           H        GLU  30  -9.653   2.977  -4.329
  225    HA   GLU  30           HA       GLU  30 -12.054   2.451  -5.755
  226   1HB   GLU  30          1HB       GLU  30 -10.109   0.884  -5.586
  227   2HB   GLU  30          2HB       GLU  30 -10.561   0.557  -3.915
  228   1HG   GLU  30          1HG       GLU  30 -11.473  -1.196  -5.335
  229   2HG   GLU  30          2HG       GLU  30 -12.802  -0.216  -4.719
  230    H    LEU  31           H        LEU  31 -11.359   2.095  -2.271
  231    HA   LEU  31           HA       LEU  31 -13.992   1.260  -1.506
  232   1HB   LEU  31          1HB       LEU  31 -12.043   2.901   0.141
  233   2HB   LEU  31          2HB       LEU  31 -13.319   1.846   0.750
  234    HG   LEU  31           HG       LEU  31 -10.927   0.983  -0.874
  235   1HD1  LEU  31          1HD1      LEU  31 -11.584   0.905   2.070
  236   2HD1  LEU  31          2HD1      LEU  31 -10.528  -0.323   1.371
  237   3HD1  LEU  31          3HD1      LEU  31 -10.081   1.376   1.276
  238   1HD2  LEU  31          1HD2      LEU  31 -13.393  -0.448   0.117
  239   2HD2  LEU  31          2HD2      LEU  31 -12.575  -0.585  -1.440
  240   3HD2  LEU  31          3HD2      LEU  31 -11.875  -1.338  -0.009
  241    H    ASP  32           H        ASP  32 -12.476   4.391  -1.867
  242    HA   ASP  32           HA       ASP  32 -14.517   6.014  -0.763
  243   1HB   ASP  32          1HB       ASP  32 -12.249   6.794  -1.337
  244   2HB   ASP  32          2HB       ASP  32 -12.609   6.574  -3.046
  245    H    LYS  33           H        LYS  33 -14.073   4.683  -4.028
  246    HA   LYS  33           HA       LYS  33 -16.232   6.038  -5.299
  247   1HB   LYS  33          1HB       LYS  33 -14.538   4.709  -6.525
  248   2HB   LYS  33          2HB       LYS  33 -15.181   3.236  -5.801
  249   1HG   LYS  33          1HG       LYS  33 -17.310   3.542  -6.904
  250   2HG   LYS  33          2HG       LYS  33 -16.832   5.136  -7.486
  251   1HD   LYS  33          1HD       LYS  33 -16.608   3.478  -9.283
  252   2HD   LYS  33          2HD       LYS  33 -15.023   4.096  -8.824
  253   1HE   LYS  33          1HE       LYS  33 -16.084   1.606  -7.501
  254   2HE   LYS  33          2HE       LYS  33 -15.363   1.505  -9.108
  255   1HZ   LYS  33          1HZ       LYS  33 -13.735   3.108  -7.476
  256   2HZ   LYS  33          2HZ       LYS  33 -14.057   1.657  -6.653
  257   3HZ   LYS  33          3HZ       LYS  33 -13.365   1.623  -8.205
  258    H    TYR  34           H        TYR  34 -16.155   2.845  -3.668
  259    HA   TYR  34           HA       TYR  34 -18.960   2.332  -3.988
  260   1HB   TYR  34          1HB       TYR  34 -16.844   1.268  -2.110
  261   2HB   TYR  34          2HB       TYR  34 -18.531   0.781  -1.936
  262    HD1  TYR  34           HD1      TYR  34 -19.666  -0.508  -3.692
  263    HD2  TYR  34           HD2      TYR  34 -15.532   0.588  -4.047
  264    HE1  TYR  34           HE1      TYR  34 -19.393  -2.135  -5.545
  265    HE2  TYR  34           HE2      TYR  34 -15.258  -1.032  -5.899
  266    HH   TYR  34           HH       TYR  34 -17.333  -3.471  -6.528
  267    H    GLY  35           H        GLY  35 -17.099   3.921  -1.409
  268   1HA   GLY  35          1HA       GLY  35 -19.633   5.157  -0.450
  269   2HA   GLY  35          2HA       GLY  35 -18.005   5.719  -0.073
  270    H    VAL  36           H        VAL  36 -17.381   2.695   0.419
  271    HA   VAL  36           HA       VAL  36 -18.916   1.803   2.631
  272    HB   VAL  36           HB       VAL  36 -17.118   0.521   1.315
  273   1HG1  VAL  36          1HG1      VAL  36 -15.366   2.319   1.784
  274   2HG1  VAL  36          2HG1      VAL  36 -15.277   1.663   3.417
  275   3HG1  VAL  36          3HG1      VAL  36 -14.855   0.650   2.037
  276   1HG2  VAL  36          1HG2      VAL  36 -17.113   0.381   4.340
  277   2HG2  VAL  36          2HG2      VAL  36 -18.271  -0.412   3.276
  278   3HG2  VAL  36          3HG2      VAL  36 -16.577  -0.901   3.259
  279    H    SER  37           H        SER  37 -18.120   1.767   4.961
  280    HA   SER  37           HA       SER  37 -17.852   4.385   5.986
  281   1HB   SER  37          1HB       SER  37 -16.978   1.782   7.274
  282   2HB   SER  37          2HB       SER  37 -17.237   3.305   8.121
  283    HG   SER  37           HG       SER  37 -19.329   3.029   7.971
  284    H    ASP  38           H        ASP  38 -16.038   5.517   6.836
  285    HA   ASP  38           HA       ASP  38 -13.614   5.224   5.307
  286   1HB   ASP  38          1HB       ASP  38 -12.784   7.094   6.628
  287   2HB   ASP  38          2HB       ASP  38 -14.467   7.402   6.198
  288    H    TYR  39           H        TYR  39 -14.729   3.523   7.957
  289    HA   TYR  39           HA       TYR  39 -12.416   3.252   9.584
  290   1HB   TYR  39          1HB       TYR  39 -14.568   2.386  10.312
  291   2HB   TYR  39          2HB       TYR  39 -14.615   1.261   8.956
  292    HD1  TYR  39           HD1      TYR  39 -13.189  -0.707   8.892
  293    HD2  TYR  39           HD2      TYR  39 -13.055   2.017  12.209
  294    HE1  TYR  39           HE1      TYR  39 -11.922  -2.376  10.208
  295    HE2  TYR  39           HE2      TYR  39 -11.787   0.345  13.531
  296    HH   TYR  39           HH       TYR  39 -11.493  -2.908  12.578
  297    H    TYR  40           H        TYR  40 -13.476   1.271   6.794
  298    HA   TYR  40           HA       TYR  40 -11.267  -0.512   6.812
  299   1HB   TYR  40          1HB       TYR  40 -12.868   0.479   4.435
  300   2HB   TYR  40          2HB       TYR  40 -11.841  -0.955   4.453
  301    HD1  TYR  40           HD1      TYR  40 -15.048   0.460   5.407
  302    HD2  TYR  40           HD2      TYR  40 -12.422  -2.890   5.948
  303    HE1  TYR  40           HE1      TYR  40 -16.935  -0.867   6.310
  304    HE2  TYR  40           HE2      TYR  40 -14.306  -4.220   6.860
  305    HH   TYR  40           HH       TYR  40 -16.426  -4.049   7.727
  306    H    LYS  41           H        LYS  41 -11.608   2.686   5.221
  307    HA   LYS  41           HA       LYS  41  -9.067   2.510   3.864
  308   1HB   LYS  41          1HB       LYS  41 -10.751   4.891   4.681
  309   2HB   LYS  41          2HB       LYS  41  -9.265   5.031   3.741
  310   1HG   LYS  41          1HG       LYS  41 -10.220   3.558   2.013
  311   2HG   LYS  41          2HG       LYS  41 -11.712   3.430   2.938
  312   1HD   LYS  41          1HD       LYS  41 -10.599   6.114   2.117
  313   2HD   LYS  41          2HD       LYS  41 -11.610   5.180   1.019
  314   1HE   LYS  41          1HE       LYS  41 -13.311   5.067   2.937
  315   2HE   LYS  41          2HE       LYS  41 -12.335   6.312   3.719
  316   1HZ   LYS  41          1HZ       LYS  41 -13.290   6.613   0.942
  317   2HZ   LYS  41          2HZ       LYS  41 -14.253   7.070   2.265
  318   3HZ   LYS  41          3HZ       LYS  41 -12.747   7.813   2.010
  319    H    ASN  42           H        ASN  42 -10.124   3.782   6.980
  320    HA   ASN  42           HA       ASN  42  -7.620   4.900   7.746
  321   1HB   ASN  42          1HB       ASN  42  -9.879   3.733   9.396
  322   2HB   ASN  42          2HB       ASN  42  -8.483   4.546  10.107
  323   2HD2  ASN  42          2HD2      ASN  42 -11.175   5.579  10.355
  324   1HD2  ASN  42          1HD2      ASN  42 -11.243   7.054   9.518
  325    H    LEU  43           H        LEU  43  -8.974   1.643   8.037
  326    HA   LEU  43           HA       LEU  43  -6.864   0.519   9.574
  327   1HB   LEU  43          1HB       LEU  43  -9.007  -0.645   9.179
  328   2HB   LEU  43          2HB       LEU  43  -8.610  -0.802   7.470
  329    HG   LEU  43           HG       LEU  43  -6.667  -2.193   8.023
  330   1HD1  LEU  43          1HD1      LEU  43  -7.450  -1.463  10.841
  331   2HD1  LEU  43          2HD1      LEU  43  -6.643  -3.001  10.536
  332   3HD1  LEU  43          3HD1      LEU  43  -5.848  -1.489  10.104
  333   1HD2  LEU  43          1HD2      LEU  43  -9.279  -3.014   9.322
  334   2HD2  LEU  43          2HD2      LEU  43  -8.741  -3.382   7.687
  335   3HD2  LEU  43          3HD2      LEU  43  -7.934  -4.125   9.065
  336    H    ILE  44           H        ILE  44  -7.246   0.946   6.058
  337    HA   ILE  44           HA       ILE  44  -4.868  -0.458   5.302
  338    HB   ILE  44           HB       ILE  44  -6.356   1.823   3.965
  339   1HG1  ILE  44          1HG1      ILE  44  -6.161  -1.117   3.268
  340   2HG1  ILE  44          2HG1      ILE  44  -7.458  -0.435   4.252
  341   1HG2  ILE  44          1HG2      ILE  44  -3.982   0.183   3.052
  342   2HG2  ILE  44          2HG2      ILE  44  -5.044   1.016   1.916
  343   3HG2  ILE  44          3HG2      ILE  44  -4.125   1.941   3.103
  344   1HD1  ILE  44          1HD1      ILE  44  -7.908   1.172   2.332
  345   2HD1  ILE  44          2HD1      ILE  44  -6.805   0.192   1.366
  346   3HD1  ILE  44          3HD1      ILE  44  -8.285  -0.520   2.005
  347    H    ASN  45           H        ASN  45  -5.455   2.950   6.127
  348    HA   ASN  45           HA       ASN  45  -2.922   4.014   5.578
  349   1HB   ASN  45          1HB       ASN  45  -4.829   4.617   7.856
  350   2HB   ASN  45          2HB       ASN  45  -3.390   5.579   7.519
  351   2HD2  ASN  45          2HD2      ASN  45  -3.461   5.530   4.661
  352   1HD2  ASN  45          1HD2      ASN  45  -4.837   6.376   4.142
  353    H    ASN  46           H        ASN  46  -3.915   1.840   8.128
  354    HA   ASN  46           HA       ASN  46  -1.275   2.098   9.487
  355   1HB   ASN  46          1HB       ASN  46  -3.737   0.485  10.219
  356   2HB   ASN  46          2HB       ASN  46  -2.283   0.639  11.204
  357   2HD2  ASN  46          2HD2      ASN  46  -1.665   3.281  11.217
  358   1HD2  ASN  46          1HD2      ASN  46  -2.963   4.230  11.764
  359    H    ALA  47           H        ALA  47  -2.101   0.636   6.791
  360    HA   ALA  47           HA       ALA  47  -1.665  -2.150   7.179
  361   1HB   ALA  47          1HB       ALA  47  -2.478  -1.147   5.054
  362   2HB   ALA  47          2HB       ALA  47  -1.104  -2.221   4.803
  363   3HB   ALA  47          3HB       ALA  47  -0.872  -0.473   4.779
  364    H    LYS  48           H        LYS  48   0.199  -3.375   7.335
  365    HA   LYS  48           HA       LYS  48   2.802  -1.885   7.525
  366   1HB   LYS  48          1HB       LYS  48   3.489  -3.569   9.161
  367   2HB   LYS  48          2HB       LYS  48   1.989  -2.803   9.685
  368   1HG   LYS  48          1HG       LYS  48   0.744  -4.718   8.587
  369   2HG   LYS  48          2HG       LYS  48   2.302  -5.511   8.366
  370   1HD   LYS  48          1HD       LYS  48   1.187  -4.606  11.037
  371   2HD   LYS  48          2HD       LYS  48   1.141  -6.263  10.439
  372   1HE   LYS  48          1HE       LYS  48   3.072  -6.279  11.763
  373   2HE   LYS  48          2HE       LYS  48   3.738  -5.954  10.163
  374   1HZ   LYS  48          1HZ       LYS  48   2.965  -3.523  11.325
  375   2HZ   LYS  48          2HZ       LYS  48   3.905  -4.371  12.458
  376   3HZ   LYS  48          3HZ       LYS  48   4.528  -4.044  10.915
  377    H    THR  49           H        THR  49   1.357  -3.478   5.253
  378    HA   THR  49           HA       THR  49   3.832  -4.834   4.374
  379    HB   THR  49           HB       THR  49   1.278  -6.430   4.192
  380    HG1  THR  49           HG1      THR  49   1.381  -6.986   6.218
  381   1HG2  THR  49          1HG2      THR  49   3.566  -6.962   3.064
  382   2HG2  THR  49          2HG2      THR  49   4.082  -7.413   4.689
  383   3HG2  THR  49          3HG2      THR  49   2.735  -8.258   3.925
  384    H    VAL  50           H        VAL  50   3.728  -5.363   2.033
  385    HA   VAL  50           HA       VAL  50   2.216  -3.318   0.585
  386    HB   VAL  50           HB       VAL  50   3.860  -5.561  -0.585
  387   1HG1  VAL  50          1HG1      VAL  50   3.045  -2.805  -1.547
  388   2HG1  VAL  50          2HG1      VAL  50   4.221  -3.825  -2.376
  389   3HG1  VAL  50          3HG1      VAL  50   2.547  -4.357  -2.222
  390   1HG2  VAL  50          1HG2      VAL  50   4.712  -2.887   0.555
  391   2HG2  VAL  50          2HG2      VAL  50   5.302  -4.487   1.006
  392   3HG2  VAL  50          3HG2      VAL  50   5.713  -3.807  -0.568
  393    H    GLU  51           H        GLU  51   2.534  -6.816  -0.098
  394    HA   GLU  51           HA       GLU  51   0.163  -6.967  -1.643
  395   1HB   GLU  51          1HB       GLU  51   0.312  -9.417  -1.308
  396   2HB   GLU  51          2HB       GLU  51   1.874  -8.720  -1.724
  397   1HG   GLU  51          1HG       GLU  51   1.051  -9.172   1.157
  398   2HG   GLU  51          2HG       GLU  51   1.836 -10.425   0.202
  399    H    GLY  52           H        GLY  52   0.652  -6.990   1.798
  400   1HA   GLY  52          1HA       GLY  52  -0.896  -7.042   3.559
  401   2HA   GLY  52          2HA       GLY  52  -1.839  -8.163   2.573
  402    H    VAL  53           H        VAL  53  -0.951  -4.973   1.392
  403    HA   VAL  53           HA       VAL  53  -3.351  -3.626   2.268
  404    HB   VAL  53           HB       VAL  53  -1.360  -3.028   0.067
  405   1HG1  VAL  53          1HG1      VAL  53  -3.846  -1.531   0.919
  406   2HG1  VAL  53          2HG1      VAL  53  -2.480  -0.701   0.174
  407   3HG1  VAL  53          3HG1      VAL  53  -3.336  -1.963  -0.713
  408   1HG2  VAL  53          1HG2      VAL  53  -0.823  -2.871   2.595
  409   2HG2  VAL  53          2HG2      VAL  53  -0.461  -1.462   1.601
  410   3HG2  VAL  53          3HG2      VAL  53  -1.909  -1.487   2.609
  411    H    LYS  54           H        LYS  54  -2.496  -5.007  -0.945
  412    HA   LYS  54           HA       LYS  54  -5.115  -4.462  -2.024
  413   1HB   LYS  54          1HB       LYS  54  -4.421  -5.942  -3.881
  414   2HB   LYS  54          2HB       LYS  54  -3.181  -4.750  -3.490
  415   1HG   LYS  54          1HG       LYS  54  -2.107  -6.507  -2.019
  416   2HG   LYS  54          2HG       LYS  54  -3.228  -7.676  -2.714
  417   1HD   LYS  54          1HD       LYS  54  -1.245  -5.979  -4.263
  418   2HD   LYS  54          2HD       LYS  54  -1.076  -7.699  -3.921
  419   1HE   LYS  54          1HE       LYS  54  -3.057  -6.329  -5.734
  420   2HE   LYS  54          2HE       LYS  54  -1.962  -7.659  -6.104
  421   1HZ   LYS  54          1HZ       LYS  54  -3.283  -8.946  -4.380
  422   2HZ   LYS  54          2HZ       LYS  54  -4.451  -7.720  -4.514
  423   3HZ   LYS  54          3HZ       LYS  54  -4.041  -8.650  -5.871
  424    H    ALA  55           H        ALA  55  -3.777  -7.194  -0.262
  425    HA   ALA  55           HA       ALA  55  -5.869  -9.061  -0.936
  426   1HB   ALA  55          1HB       ALA  55  -5.049 -10.081   1.374
  427   2HB   ALA  55          2HB       ALA  55  -3.760  -8.890   1.196
  428   3HB   ALA  55          3HB       ALA  55  -3.996 -10.125  -0.041
  429    H    LEU  56           H        LEU  56  -5.583  -6.532   1.479
  430    HA   LEU  56           HA       LEU  56  -7.694  -7.326   3.209
  431   1HB   LEU  56          1HB       LEU  56  -6.106  -5.500   3.744
  432   2HB   LEU  56          2HB       LEU  56  -6.798  -4.524   2.456
  433    HG   LEU  56           HG       LEU  56  -9.036  -4.700   3.643
  434   1HD1  LEU  56          1HD1      LEU  56  -7.260  -6.061   5.668
  435   2HD1  LEU  56          2HD1      LEU  56  -8.700  -5.183   6.179
  436   3HD1  LEU  56          3HD1      LEU  56  -8.848  -6.552   5.082
  437   1HD2  LEU  56          1HD2      LEU  56  -6.670  -3.388   5.001
  438   2HD2  LEU  56          2HD2      LEU  56  -7.765  -2.680   3.816
  439   3HD2  LEU  56          3HD2      LEU  56  -8.348  -3.058   5.430
  440    H    ILE  57           H        ILE  57  -7.728  -5.174   0.363
  441    HA   ILE  57           HA       ILE  57 -10.530  -4.684   0.362
  442    HB   ILE  57           HB       ILE  57  -8.530  -4.735  -1.904
  443   1HG1  ILE  57          1HG1      ILE  57  -8.827  -2.245  -1.736
  444   2HG1  ILE  57          2HG1      ILE  57  -9.856  -2.500  -0.330
  445   1HG2  ILE  57          1HG2      ILE  57 -11.444  -3.957  -1.878
  446   2HG2  ILE  57          2HG2      ILE  57 -10.320  -3.376  -3.106
  447   3HG2  ILE  57          3HG2      ILE  57 -10.635  -5.101  -2.947
  448   1HD1  ILE  57          1HD1      ILE  57  -7.087  -3.659  -0.402
  449   2HD1  ILE  57          2HD1      ILE  57  -7.328  -1.975   0.039
  450   3HD1  ILE  57          3HD1      ILE  57  -8.079  -3.244   0.997
  451    H    ASP  58           H        ASP  58  -8.595  -7.326  -0.994
  452    HA   ASP  58           HA       ASP  58 -10.690  -8.537  -2.516
  453   1HB   ASP  58          1HB       ASP  58  -8.314  -9.760  -1.083
  454   2HB   ASP  58          2HB       ASP  58  -9.383 -10.675  -2.146
  455    H    GLU  59           H        GLU  59  -9.801  -8.819   0.908
  456    HA   GLU  59           HA       GLU  59 -11.793 -10.830   1.511
  457   1HB   GLU  59          1HB       GLU  59 -10.277  -8.866   3.254
  458   2HB   GLU  59          2HB       GLU  59 -11.387 -10.077   3.896
  459   1HG   GLU  59          1HG       GLU  59 -10.051 -11.865   2.844
  460   2HG   GLU  59          2HG       GLU  59  -8.938 -10.656   2.202
  461    H    ILE  60           H        ILE  60 -11.674  -7.292   1.669
  462    HA   ILE  60           HA       ILE  60 -14.256  -7.000   2.893
  463    HB   ILE  60           HB       ILE  60 -12.666  -5.048   1.212
  464   1HG1  ILE  60          1HG1      ILE  60 -12.916  -5.248   4.225
  465   2HG1  ILE  60          2HG1      ILE  60 -11.581  -5.956   3.321
  466   1HG2  ILE  60          1HG2      ILE  60 -15.054  -4.693   3.041
  467   2HG2  ILE  60          2HG2      ILE  60 -14.052  -3.356   2.474
  468   3HG2  ILE  60          3HG2      ILE  60 -14.967  -4.324   1.319
  469   1HD1  ILE  60          1HD1      ILE  60 -12.344  -3.027   3.206
  470   2HD1  ILE  60          2HD1      ILE  60 -11.062  -3.678   4.226
  471   3HD1  ILE  60          3HD1      ILE  60 -10.927  -3.776   2.472
  472    H    LEU  61           H        LEU  61 -13.163  -6.985  -0.496
  473    HA   LEU  61           HA       LEU  61 -15.871  -6.458  -1.474
  474   1HB   LEU  61          1HB       LEU  61 -13.270  -7.186  -2.837
  475   2HB   LEU  61          2HB       LEU  61 -14.786  -7.042  -3.730
  476    HG   LEU  61           HG       LEU  61 -13.569  -4.854  -2.016
  477   1HD1  LEU  61          1HD1      LEU  61 -12.433  -5.602  -4.301
  478   2HD1  LEU  61          2HD1      LEU  61 -13.773  -4.712  -5.016
  479   3HD1  LEU  61          3HD1      LEU  61 -12.649  -3.893  -3.933
  480   1HD2  LEU  61          1HD2      LEU  61 -16.123  -5.116  -3.569
  481   2HD2  LEU  61          2HD2      LEU  61 -15.802  -4.238  -2.073
  482   3HD2  LEU  61          3HD2      LEU  61 -15.306  -3.554  -3.616
  483    H    ALA  62           H        ALA  62 -14.255  -9.189  -0.318
  484    HA   ALA  62           HA       ALA  62 -15.259 -11.233  -2.030
  485   1HB   ALA  62          1HB       ALA  62 -14.818 -11.361   0.970
  486   2HB   ALA  62          2HB       ALA  62 -14.926 -12.742  -0.121
  487   3HB   ALA  62          3HB       ALA  62 -13.569 -11.623  -0.247
  488    H    ALA  63           H        ALA  63 -16.644  -9.856   0.969
  489    HA   ALA  63           HA       ALA  63 -19.064 -11.359   0.919
  490   1HB   ALA  63          1HB       ALA  63 -18.268 -10.000   2.862
  491   2HB   ALA  63          2HB       ALA  63 -19.944  -9.659   2.433
  492   3HB   ALA  63          3HB       ALA  63 -18.667  -8.538   1.962
  493    H    LEU  64           H        LEU  64 -18.367  -8.083  -0.338
  494    HA   LEU  64           HA       LEU  64 -20.980  -7.785  -1.527
  495   1HB   LEU  64          1HB       LEU  64 -18.431  -6.337  -2.301
  496   2HB   LEU  64          2HB       LEU  64 -20.083  -5.762  -2.508
  497    HG   LEU  64           HG       LEU  64 -18.650  -6.225   0.122
  498   1HD1  LEU  64          1HD1      LEU  64 -18.067  -4.152  -1.154
  499   2HD1  LEU  64          2HD1      LEU  64 -19.770  -3.696  -1.121
  500   3HD1  LEU  64          3HD1      LEU  64 -18.860  -3.815   0.385
  501   1HD2  LEU  64          1HD2      LEU  64 -21.536  -5.626  -0.546
  502   2HD2  LEU  64          2HD2      LEU  64 -20.891  -6.816   0.584
  503   3HD2  LEU  64          3HD2      LEU  64 -20.840  -5.101   0.986
  504    HA   PRO  65           HA       PRO  65 -20.311 -10.231  -5.206
  505   1HB   PRO  65          1HB       PRO  65 -21.665  -8.546  -7.053
  506   2HB   PRO  65          2HB       PRO  65 -22.370  -9.871  -6.121
  507   1HG   PRO  65          1HG       PRO  65 -22.615  -6.958  -5.695
  508   2HG   PRO  65          2HG       PRO  65 -23.661  -8.265  -5.124
  509   1HD   PRO  65          1HD       PRO  65 -21.876  -6.811  -3.519
  510   2HD   PRO  65          2HD       PRO  65 -22.569  -8.395  -3.098

  No H/Q in entry =         510
  Start of MODEL   23
    1    H1   MET   1           H1       MET   1  26.945  -5.223   2.089
    2    H2   MET   1           H2       MET   1  27.652  -6.004   3.422
    3    H3   MET   1           H3       MET   1  26.509  -6.820   2.471
    4    HA   MET   1           HA       MET   1  24.798  -5.979   3.584
    5   1HB   MET   1          1HB       MET   1  27.095  -5.055   5.329
    6   2HB   MET   1          2HB       MET   1  25.405  -4.973   5.829
    7   1HG   MET   1          1HG       MET   1  25.186  -7.409   5.494
    8   2HG   MET   1          2HG       MET   1  26.875  -7.492   4.997
    9   1HE   MET   1          1HE       MET   1  24.352  -6.486   7.468
   10   2HE   MET   1          2HE       MET   1  25.039  -6.731   9.070
   11   3HE   MET   1          3HE       MET   1  25.386  -5.247   8.173
   12    H    LYS   2           H        LYS   2  26.114  -4.130   1.564
   13    HA   LYS   2           HA       LYS   2  25.863  -1.432   2.555
   14   1HB   LYS   2          1HB       LYS   2  25.783  -2.590  -0.245
   15   2HB   LYS   2          2HB       LYS   2  25.743  -0.860   0.096
   16   1HG   LYS   2          1HG       LYS   2  27.901  -0.948   1.174
   17   2HG   LYS   2          2HG       LYS   2  27.917  -2.709   1.102
   18   1HD   LYS   2          1HD       LYS   2  29.309  -1.897  -0.697
   19   2HD   LYS   2          2HD       LYS   2  27.829  -2.537  -1.409
   20   1HE   LYS   2          1HE       LYS   2  26.954  -0.375  -1.820
   21   2HE   LYS   2          2HE       LYS   2  28.099   0.391  -0.717
   22   1HZ   LYS   2          1HZ       LYS   2  29.335  -1.103  -2.843
   23   2HZ   LYS   2          2HZ       LYS   2  28.404   0.205  -3.388
   24   3HZ   LYS   2          3HZ       LYS   2  29.666   0.466  -2.280
   25    H    ALA   3           H        ALA   3  24.059  -0.078   2.555
   26    HA   ALA   3           HA       ALA   3  21.592  -0.908   1.189
   27   1HB   ALA   3          1HB       ALA   3  20.307  -0.735   3.407
   28   2HB   ALA   3          2HB       ALA   3  21.872  -0.925   4.198
   29   3HB   ALA   3          3HB       ALA   3  21.250  -2.203   3.155
   30    H    ILE   4           H        ILE   4  22.824   1.263   3.762
   31    HA   ILE   4           HA       ILE   4  21.677   3.570   2.235
   32    HB   ILE   4           HB       ILE   4  20.118   2.935   4.052
   33   1HG1  ILE   4          1HG1      ILE   4  21.587   5.469   4.815
   34   2HG1  ILE   4          2HG1      ILE   4  20.582   5.358   3.368
   35   1HG2  ILE   4          1HG2      ILE   4  22.006   1.994   5.500
   36   2HG2  ILE   4          2HG2      ILE   4  22.337   3.660   5.972
   37   3HG2  ILE   4          3HG2      ILE   4  20.773   2.934   6.341
   38   1HD1  ILE   4          1HD1      ILE   4  18.675   4.613   4.808
   39   2HD1  ILE   4          2HD1      ILE   4  19.686   4.890   6.226
   40   3HD1  ILE   4          3HD1      ILE   4  19.231   6.242   5.189
   41    H    PHE   5           H        PHE   5  23.102   5.226   2.044
   42    HA   PHE   5           HA       PHE   5  25.687   5.032   3.483
   43   1HB   PHE   5          1HB       PHE   5  24.695   6.471   1.045
   44   2HB   PHE   5          2HB       PHE   5  26.016   7.226   1.929
   45    HD1  PHE   5           HD1      PHE   5  28.172   6.074   2.216
   46    HD2  PHE   5           HD2      PHE   5  25.020   4.385  -0.165
   47    HE1  PHE   5           HE1      PHE   5  29.796   4.517   1.175
   48    HE2  PHE   5           HE2      PHE   5  26.646   2.826  -1.205
   49    HZ   PHE   5           HZ       PHE   5  29.032   2.893  -0.534
   50    H    VAL   6           H        VAL   6  26.422   7.649   3.726
   51    HA   VAL   6           HA       VAL   6  25.212   8.447   6.166
   52    HB   VAL   6           HB       VAL   6  26.872   9.979   4.149
   53   1HG1  VAL   6          1HG1      VAL   6  25.878  10.758   6.894
   54   2HG1  VAL   6          2HG1      VAL   6  27.307  11.493   6.167
   55   3HG1  VAL   6          3HG1      VAL   6  25.734  11.663   5.386
   56   1HG2  VAL   6          1HG2      VAL   6  27.525   8.657   6.801
   57   2HG2  VAL   6          2HG2      VAL   6  28.001   8.074   5.206
   58   3HG2  VAL   6          3HG2      VAL   6  28.663   9.586   5.826
   59    H    LEU   7           H        LEU   7  24.631   9.540   2.820
   60    HA   LEU   7           HA       LEU   7  22.079  10.789   3.766
   61   1HB   LEU   7          1HB       LEU   7  23.754  12.580   3.474
   62   2HB   LEU   7          2HB       LEU   7  24.062  12.029   1.830
   63    HG   LEU   7           HG       LEU   7  21.714  12.522   1.224
   64   1HD1  LEU   7          1HD1      LEU   7  21.553  13.198   4.159
   65   2HD1  LEU   7          2HD1      LEU   7  20.501  14.027   3.009
   66   3HD1  LEU   7          3HD1      LEU   7  20.424  12.275   3.167
   67   1HD2  LEU   7          1HD2      LEU   7  23.542  14.251   1.054
   68   2HD2  LEU   7          2HD2      LEU   7  21.926  14.937   1.232
   69   3HD2  LEU   7          3HD2      LEU   7  23.018  14.880   2.615
   70    H    ASN   8           H        ASN   8  20.375  10.145   2.561
   71    HA   ASN   8           HA       ASN   8  20.692   9.482  -0.288
   72   1HB   ASN   8          1HB       ASN   8  19.800   7.398   1.732
   73   2HB   ASN   8          2HB       ASN   8  19.744   7.206  -0.022
   74   2HD2  ASN   8          2HD2      ASN   8  22.084   7.919  -1.031
   75   1HD2  ASN   8          1HD2      ASN   8  23.404   7.176  -0.265
   76    H    ALA   9           H        ALA   9  19.105  10.939  -0.874
   77    HA   ALA   9           HA       ALA   9  16.535  11.001   0.596
   78   1HB   ALA   9          1HB       ALA   9  17.609  12.615  -1.736
   79   2HB   ALA   9          2HB       ALA   9  17.469  13.145  -0.060
   80   3HB   ALA   9          3HB       ALA   9  16.015  12.856  -1.019
   81    H    GLN  10           H        GLN  10  16.326  11.670  -2.745
   82    HA   GLN  10           HA       GLN  10  14.466   9.447  -3.127
   83   1HB   GLN  10          1HB       GLN  10  14.194  10.405  -5.415
   84   2HB   GLN  10          2HB       GLN  10  13.930  11.597  -4.145
   85   1HG   GLN  10          1HG       GLN  10  16.652  11.275  -5.428
   86   2HG   GLN  10          2HG       GLN  10  15.410  12.280  -6.167
   87   2HE2  GLN  10          2HE2      GLN  10  18.054  12.950  -4.675
   88   1HE2  GLN  10          1HE2      GLN  10  17.578  14.117  -3.537
   89    H    HIS  11           H        HIS  11  14.748   7.752  -4.690
   90    HA   HIS  11           HA       HIS  11  17.537   7.359  -5.710
   91   1HB   HIS  11          1HB       HIS  11  16.912   6.079  -3.511
   92   2HB   HIS  11          2HB       HIS  11  15.928   5.069  -4.567
   93    HD1  HIS  11           HD1      HIS  11  19.221   6.515  -5.692
   94    HD2  HIS  11           HD2      HIS  11  17.695   2.848  -4.420
   95    HE1  HIS  11           HE1      HIS  11  21.021   4.792  -6.148
   96    H    ASP  12           H        ASP  12  17.140   7.501  -7.887
   97    HA   ASP  12           HA       ASP  12  14.654   6.688  -9.102
   98   1HB   ASP  12          1HB       ASP  12  15.809   7.101 -11.233
   99   2HB   ASP  12          2HB       ASP  12  16.126   8.408 -10.091
  100    H    GLU  13           H        GLU  13  17.552   4.969  -8.271
  101    HA   GLU  13           HA       GLU  13  17.454   2.880 -10.197
  102   1HB   GLU  13          1HB       GLU  13  18.390   2.895  -7.322
  103   2HB   GLU  13          2HB       GLU  13  18.613   1.520  -8.402
  104   1HG   GLU  13          1HG       GLU  13  19.850   2.956  -9.981
  105   2HG   GLU  13          2HG       GLU  13  19.634   4.333  -8.901
  106    H    ALA  14           H        ALA  14  15.745   3.243  -7.090
  107    HA   ALA  14           HA       ALA  14  13.757   1.250  -8.016
  108   1HB   ALA  14          1HB       ALA  14  15.058   0.943  -5.303
  109   2HB   ALA  14          2HB       ALA  14  13.962  -0.178  -6.110
  110   3HB   ALA  14          3HB       ALA  14  15.603   0.046  -6.720
  111    H    VAL  15           H        VAL  15  11.796   1.300  -6.686
  112    HA   VAL  15           HA       VAL  15  11.309   3.998  -5.556
  113    HB   VAL  15           HB       VAL  15   9.304   1.757  -5.899
  114   1HG1  VAL  15          1HG1      VAL  15   9.067   4.781  -5.854
  115   2HG1  VAL  15          2HG1      VAL  15   7.727   3.655  -6.075
  116   3HG1  VAL  15          3HG1      VAL  15   8.608   3.693  -4.546
  117   1HG2  VAL  15          1HG2      VAL  15  10.204   3.834  -7.922
  118   2HG2  VAL  15          2HG2      VAL  15  10.414   2.089  -8.057
  119   3HG2  VAL  15          3HG2      VAL  15   8.797   2.791  -8.114
  120    H    ASP  16           H        ASP  16  10.231   4.200  -3.425
  121    HA   ASP  16           HA       ASP  16  10.591   1.839  -1.620
  122   1HB   ASP  16          1HB       ASP  16  11.648   3.232   0.068
  123   2HB   ASP  16          2HB       ASP  16  12.580   3.321  -1.426
  124    H    ALA  17           H        ALA  17  10.076   3.951   0.578
  125    HA   ALA  17           HA       ALA  17   7.501   3.421   1.289
  126   1HB   ALA  17          1HB       ALA  17   8.837   4.786   2.737
  127   2HB   ALA  17          2HB       ALA  17   8.943   6.066   1.527
  128   3HB   ALA  17          3HB       ALA  17   7.406   5.732   2.323
  129    H    ASN  18           H        ASN  18   8.417   5.610  -1.303
  130    HA   ASN  18           HA       ASN  18   5.924   6.948  -1.615
  131   1HB   ASN  18          1HB       ASN  18   7.973   7.626  -2.812
  132   2HB   ASN  18          2HB       ASN  18   7.917   6.136  -3.756
  133   2HD2  ASN  18          2HD2      ASN  18   7.112   6.583  -5.806
  134   1HD2  ASN  18          1HD2      ASN  18   5.840   7.653  -6.144
  135    H    SER  19           H        SER  19   7.080   3.827  -2.856
  136    HA   SER  19           HA       SER  19   4.872   3.233  -4.547
  137   1HB   SER  19          1HB       SER  19   6.954   1.920  -4.537
  138   2HB   SER  19          2HB       SER  19   6.591   1.343  -2.913
  139    HG   SER  19           HG       SER  19   5.017   0.941  -5.251
  140    H    LEU  20           H        LEU  20   5.328   2.641  -1.057
  141    HA   LEU  20           HA       LEU  20   2.954   1.121  -0.655
  142   1HB   LEU  20          1HB       LEU  20   4.434   3.022   1.186
  143   2HB   LEU  20          2HB       LEU  20   3.100   2.003   1.719
  144    HG   LEU  20           HG       LEU  20   5.587   0.910   0.369
  145   1HD1  LEU  20          1HD1      LEU  20   6.083   2.074   2.546
  146   2HD1  LEU  20          2HD1      LEU  20   4.970   0.958   3.337
  147   3HD1  LEU  20          3HD1      LEU  20   6.434   0.348   2.567
  148   1HD2  LEU  20          1HD2      LEU  20   3.167  -0.296   1.712
  149   2HD2  LEU  20          2HD2      LEU  20   3.949  -0.764   0.204
  150   3HD2  LEU  20          3HD2      LEU  20   4.698  -1.164   1.746
  151    H    ALA  21           H        ALA  21   3.513   4.624  -0.634
  152    HA   ALA  21           HA       ALA  21   0.913   5.396   0.173
  153   1HB   ALA  21          1HB       ALA  21   2.837   6.837  -1.671
  154   2HB   ALA  21          2HB       ALA  21   2.805   6.967   0.086
  155   3HB   ALA  21          3HB       ALA  21   1.451   7.574  -0.866
  156    H    GLU  22           H        GLU  22   2.235   4.896  -3.121
  157    HA   GLU  22           HA       GLU  22  -0.142   5.621  -4.512
  158   1HB   GLU  22          1HB       GLU  22   2.096   5.239  -5.580
  159   2HB   GLU  22          2HB       GLU  22   1.860   3.506  -5.347
  160   1HG   GLU  22          1HG       GLU  22  -0.178   3.581  -6.710
  161   2HG   GLU  22          2HG       GLU  22   0.016   5.320  -6.929
  162    H    ALA  23           H        ALA  23   0.958   2.391  -3.425
  163    HA   ALA  23           HA       ALA  23  -1.332   0.975  -4.358
  164   1HB   ALA  23          1HB       ALA  23   0.375   0.402  -1.914
  165   2HB   ALA  23          2HB       ALA  23   0.722  -0.155  -3.550
  166   3HB   ALA  23          3HB       ALA  23  -0.708  -0.746  -2.702
  167    H    LYS  24           H        LYS  24  -0.650   2.554  -1.246
  168    HA   LYS  24           HA       LYS  24  -3.207   1.895  -0.076
  169   1HB   LYS  24          1HB       LYS  24  -1.140   4.014   0.563
  170   2HB   LYS  24          2HB       LYS  24  -2.586   3.743   1.538
  171   1HG   LYS  24          1HG       LYS  24  -1.908   1.401   1.900
  172   2HG   LYS  24          2HG       LYS  24  -0.460   1.668   0.929
  173   1HD   LYS  24          1HD       LYS  24   0.287   3.404   2.515
  174   2HD   LYS  24          2HD       LYS  24  -1.157   3.136   3.489
  175   1HE   LYS  24          1HE       LYS  24  -0.411   0.678   3.616
  176   2HE   LYS  24          2HE       LYS  24   1.144   1.239   3.003
  177   1HZ   LYS  24          1HZ       LYS  24   1.021   2.929   4.881
  178   2HZ   LYS  24          2HZ       LYS  24  -0.202   1.948   5.537
  179   3HZ   LYS  24          3HZ       LYS  24   1.361   1.322   5.304
  180    H    VAL  25           H        VAL  25  -1.946   4.715  -1.856
  181    HA   VAL  25           HA       VAL  25  -4.314   6.309  -1.527
  182    HB   VAL  25           HB       VAL  25  -2.098   6.394  -3.577
  183   1HG1  VAL  25          1HG1      VAL  25  -4.551   8.118  -3.250
  184   2HG1  VAL  25          2HG1      VAL  25  -3.069   8.777  -3.944
  185   3HG1  VAL  25          3HG1      VAL  25  -3.882   7.420  -4.724
  186   1HG2  VAL  25          1HG2      VAL  25  -1.852   7.000  -0.997
  187   2HG2  VAL  25          2HG2      VAL  25  -1.122   8.033  -2.225
  188   3HG2  VAL  25          3HG2      VAL  25  -2.655   8.489  -1.486
  189    H    LEU  26           H        LEU  26  -3.245   4.119  -4.148
  190    HA   LEU  26           HA       LEU  26  -5.493   4.570  -5.844
  191   1HB   LEU  26          1HB       LEU  26  -3.730   2.134  -5.475
  192   2HB   LEU  26          2HB       LEU  26  -4.975   2.236  -6.719
  193    HG   LEU  26           HG       LEU  26  -2.697   4.216  -6.411
  194   1HD1  LEU  26          1HD1      LEU  26  -3.035   1.880  -8.317
  195   2HD1  LEU  26          2HD1      LEU  26  -1.737   3.073  -8.393
  196   3HD1  LEU  26          3HD1      LEU  26  -1.858   1.985  -7.009
  197   1HD2  LEU  26          1HD2      LEU  26  -5.008   3.917  -8.320
  198   2HD2  LEU  26          2HD2      LEU  26  -4.303   5.380  -7.638
  199   3HD2  LEU  26          3HD2      LEU  26  -3.480   4.539  -8.943
  200    H    ALA  27           H        ALA  27  -5.015   2.270  -3.174
  201    HA   ALA  27           HA       ALA  27  -7.656   1.092  -3.505
  202   1HB   ALA  27          1HB       ALA  27  -6.103  -0.342  -2.465
  203   2HB   ALA  27          2HB       ALA  27  -5.510   0.929  -1.395
  204   3HB   ALA  27          3HB       ALA  27  -7.097   0.216  -1.119
  205    H    ASN  28           H        ASN  28  -6.349   3.845  -1.821
  206    HA   ASN  28           HA       ASN  28  -8.321   4.176   0.203
  207   1HB   ASN  28          1HB       ASN  28  -6.214   5.498   0.036
  208   2HB   ASN  28          2HB       ASN  28  -6.884   6.344  -1.359
  209   2HD2  ASN  28          2HD2      ASN  28  -7.145   5.965   2.153
  210   1HD2  ASN  28          1HD2      ASN  28  -8.166   7.298   2.398
  211    H    ARG  29           H        ARG  29  -8.250   5.526  -3.129
  212    HA   ARG  29           HA       ARG  29 -10.895   6.662  -2.847
  213   1HB   ARG  29          1HB       ARG  29 -10.760   6.901  -5.362
  214   2HB   ARG  29          2HB       ARG  29  -9.471   7.689  -4.457
  215   1HG   ARG  29          1HG       ARG  29  -7.906   5.971  -4.996
  216   2HG   ARG  29          2HG       ARG  29  -9.173   4.888  -5.551
  217   1HD   ARG  29          1HD       ARG  29  -9.064   5.737  -7.657
  218   2HD   ARG  29          2HD       ARG  29  -9.268   7.383  -7.079
  219    HE   ARG  29           HE       ARG  29  -6.851   6.228  -8.056
  220   1HH1  ARG  29          1HH1      ARG  29  -4.832   7.100  -7.619
  221   2HH1  ARG  29          2HH1      ARG  29  -4.633   8.167  -6.269
  222   1HH2  ARG  29          1HH2      ARG  29  -7.960   8.019  -5.321
  223   2HH2  ARG  29          2HH2      ARG  29  -6.402   8.686  -4.970
  224    H    GLU  30           H        GLU  30  -9.695   3.531  -3.877
  225    HA   GLU  30           HA       GLU  30 -11.983   2.643  -5.327
  226   1HB   GLU  30          1HB       GLU  30  -9.792   1.419  -5.177
  227   2HB   GLU  30          2HB       GLU  30 -10.206   0.963  -3.527
  228   1HG   GLU  30          1HG       GLU  30 -10.814  -0.865  -5.008
  229   2HG   GLU  30          2HG       GLU  30 -12.292  -0.117  -4.407
  230    H    LEU  31           H        LEU  31 -11.292   2.568  -1.825
  231    HA   LEU  31           HA       LEU  31 -13.757   1.197  -1.132
  232   1HB   LEU  31          1HB       LEU  31 -12.088   3.090   0.560
  233   2HB   LEU  31          2HB       LEU  31 -13.246   1.905   1.157
  234    HG   LEU  31           HG       LEU  31 -10.716   1.316  -0.371
  235   1HD1  LEU  31          1HD1      LEU  31 -11.505   1.107   2.535
  236   2HD1  LEU  31          2HD1      LEU  31 -10.224   0.091   1.871
  237   3HD1  LEU  31          3HD1      LEU  31 -10.067   1.845   1.831
  238   1HD2  LEU  31          1HD2      LEU  31 -13.043  -0.395   0.491
  239   2HD2  LEU  31          2HD2      LEU  31 -12.112  -0.452  -1.005
  240   3HD2  LEU  31          3HD2      LEU  31 -11.430  -1.102   0.482
  241    H    ASP  32           H        ASP  32 -12.709   4.530  -1.368
  242    HA   ASP  32           HA       ASP  32 -15.150   5.738  -0.456
  243   1HB   ASP  32          1HB       ASP  32 -12.808   6.765  -0.708
  244   2HB   ASP  32          2HB       ASP  32 -13.179   6.911  -2.424
  245    H    LYS  33           H        LYS  33 -13.909   4.638  -3.552
  246    HA   LYS  33           HA       LYS  33 -15.886   5.742  -5.269
  247   1HB   LYS  33          1HB       LYS  33 -13.791   4.711  -6.060
  248   2HB   LYS  33          2HB       LYS  33 -14.349   3.137  -5.504
  249   1HG   LYS  33          1HG       LYS  33 -16.250   3.251  -7.071
  250   2HG   LYS  33          2HG       LYS  33 -15.688   4.829  -7.632
  251   1HD   LYS  33          1HD       LYS  33 -13.556   3.819  -8.350
  252   2HD   LYS  33          2HD       LYS  33 -14.112   2.241  -7.793
  253   1HE   LYS  33          1HE       LYS  33 -15.882   2.207  -9.417
  254   2HE   LYS  33          2HE       LYS  33 -15.583   3.886  -9.861
  255   1HZ   LYS  33          1HZ       LYS  33 -13.182   2.503 -10.126
  256   2HZ   LYS  33          2HZ       LYS  33 -14.374   1.563 -10.882
  257   3HZ   LYS  33          3HZ       LYS  33 -14.138   3.177 -11.358
  258    H    TYR  34           H        TYR  34 -15.792   2.553  -3.618
  259    HA   TYR  34           HA       TYR  34 -18.424   1.800  -4.562
  260   1HB   TYR  34          1HB       TYR  34 -16.666   0.775  -2.325
  261   2HB   TYR  34          2HB       TYR  34 -18.265   0.102  -2.650
  262    HD1  TYR  34           HD1      TYR  34 -18.722  -0.463  -5.210
  263    HD2  TYR  34           HD2      TYR  34 -14.828  -0.189  -3.417
  264    HE1  TYR  34           HE1      TYR  34 -17.784  -1.855  -7.034
  265    HE2  TYR  34           HE2      TYR  34 -13.894  -1.585  -5.243
  266    HH   TYR  34           HH       TYR  34 -15.615  -3.468  -7.184
  267    H    GLY  35           H        GLY  35 -17.198   3.558  -1.776
  268   1HA   GLY  35          1HA       GLY  35 -19.997   4.314  -1.094
  269   2HA   GLY  35          2HA       GLY  35 -18.545   5.176  -0.592
  270    H    VAL  36           H        VAL  36 -17.399   2.357   0.094
  271    HA   VAL  36           HA       VAL  36 -19.014   1.392   2.281
  272    HB   VAL  36           HB       VAL  36 -17.142  -0.010   2.829
  273   1HG1  VAL  36          1HG1      VAL  36 -17.390   0.440  -0.153
  274   2HG1  VAL  36          2HG1      VAL  36 -16.595  -0.957   0.568
  275   3HG1  VAL  36          3HG1      VAL  36 -18.320  -0.691   0.825
  276   1HG2  VAL  36          1HG2      VAL  36 -15.581   1.948   1.139
  277   2HG2  VAL  36          2HG2      VAL  36 -15.318   1.535   2.833
  278   3HG2  VAL  36          3HG2      VAL  36 -14.957   0.358   1.572
  279    H    SER  37           H        SER  37 -18.220   1.456   4.591
  280    HA   SER  37           HA       SER  37 -18.109   4.059   5.596
  281   1HB   SER  37          1HB       SER  37 -17.021   1.489   6.768
  282   2HB   SER  37          2HB       SER  37 -17.099   3.001   7.668
  283    HG   SER  37           HG       SER  37 -19.009   2.094   8.102
  284    H    ASP  38           H        ASP  38 -16.473   5.513   6.073
  285    HA   ASP  38           HA       ASP  38 -14.017   5.299   4.575
  286   1HB   ASP  38          1HB       ASP  38 -13.430   7.435   5.644
  287   2HB   ASP  38          2HB       ASP  38 -15.102   7.473   5.082
  288    H    TYR  39           H        TYR  39 -14.956   4.009   7.548
  289    HA   TYR  39           HA       TYR  39 -12.569   4.217   9.090
  290   1HB   TYR  39          1HB       TYR  39 -14.581   3.349  10.115
  291   2HB   TYR  39          2HB       TYR  39 -14.673   2.034   8.942
  292    HD1  TYR  39           HD1      TYR  39 -12.991   3.276  11.968
  293    HD2  TYR  39           HD2      TYR  39 -13.086   0.178   8.998
  294    HE1  TYR  39           HE1      TYR  39 -11.533   1.862  13.392
  295    HE2  TYR  39           HE2      TYR  39 -11.636  -1.232  10.413
  296    HH   TYR  39           HH       TYR  39 -11.232  -1.010  13.435
  297    H    TYR  40           H        TYR  40 -13.543   1.919   6.570
  298    HA   TYR  40           HA       TYR  40 -11.363   0.120   6.795
  299   1HB   TYR  40          1HB       TYR  40 -13.038   0.951   4.412
  300   2HB   TYR  40          2HB       TYR  40 -11.844  -0.346   4.346
  301    HD1  TYR  40           HD1      TYR  40 -15.133   0.681   5.618
  302    HD2  TYR  40           HD2      TYR  40 -12.129  -2.395   5.688
  303    HE1  TYR  40           HE1      TYR  40 -16.762  -0.893   6.626
  304    HE2  TYR  40           HE2      TYR  40 -13.763  -3.969   6.688
  305    HH   TYR  40           HH       TYR  40 -15.918  -3.712   8.118
  306    H    LYS  41           H        LYS  41 -11.592   3.243   5.090
  307    HA   LYS  41           HA       LYS  41  -9.160   3.014   3.624
  308   1HB   LYS  41          1HB       LYS  41 -10.563   5.434   4.791
  309   2HB   LYS  41          2HB       LYS  41  -9.149   5.545   3.739
  310   1HG   LYS  41          1HG       LYS  41 -10.482   4.129   2.065
  311   2HG   LYS  41          2HG       LYS  41 -11.892   4.464   3.072
  312   1HD   LYS  41          1HD       LYS  41 -10.099   6.538   1.790
  313   2HD   LYS  41          2HD       LYS  41 -11.717   6.104   1.248
  314   1HE   LYS  41          1HE       LYS  41 -12.465   6.723   3.640
  315   2HE   LYS  41          2HE       LYS  41 -10.900   7.515   3.780
  316   1HZ   LYS  41          1HZ       LYS  41 -11.622   8.528   1.496
  317   2HZ   LYS  41          2HZ       LYS  41 -13.183   8.192   2.077
  318   3HZ   LYS  41          3HZ       LYS  41 -12.153   9.210   2.959
  319    H    ASN  42           H        ASN  42  -9.867   4.200   6.879
  320    HA   ASN  42           HA       ASN  42  -7.215   4.968   7.535
  321   1HB   ASN  42          1HB       ASN  42  -9.155   5.556   8.952
  322   2HB   ASN  42          2HB       ASN  42  -9.354   3.855   9.377
  323   2HD2  ASN  42          2HD2      ASN  42  -6.645   6.255   9.321
  324   1HD2  ASN  42          1HD2      ASN  42  -6.015   5.791  10.828
  325    H    LEU  43           H        LEU  43  -8.874   1.842   7.753
  326    HA   LEU  43           HA       LEU  43  -6.802   0.428   9.096
  327   1HB   LEU  43          1HB       LEU  43  -9.066  -0.507   8.766
  328   2HB   LEU  43          2HB       LEU  43  -8.778  -0.601   7.030
  329    HG   LEU  43           HG       LEU  43  -6.910  -2.172   7.425
  330   1HD1  LEU  43          1HD1      LEU  43  -7.586  -1.576  10.299
  331   2HD1  LEU  43          2HD1      LEU  43  -6.933  -3.159   9.880
  332   3HD1  LEU  43          3HD1      LEU  43  -6.004  -1.704   9.529
  333   1HD2  LEU  43          1HD2      LEU  43  -9.330  -2.924   7.174
  334   2HD2  LEU  43          2HD2      LEU  43  -8.262  -4.079   7.970
  335   3HD2  LEU  43          3HD2      LEU  43  -9.371  -3.098   8.929
  336    H    ILE  44           H        ILE  44  -7.319   1.126   5.641
  337    HA   ILE  44           HA       ILE  44  -5.179  -0.457   4.616
  338    HB   ILE  44           HB       ILE  44  -6.407   2.138   3.640
  339   1HG1  ILE  44          1HG1      ILE  44  -7.679  -0.168   3.716
  340   2HG1  ILE  44          2HG1      ILE  44  -7.779   0.831   2.271
  341   1HG2  ILE  44          1HG2      ILE  44  -4.267   0.415   2.393
  342   2HG2  ILE  44          2HG2      ILE  44  -5.306   1.455   1.419
  343   3HG2  ILE  44          3HG2      ILE  44  -4.258   2.159   2.652
  344   1HD1  ILE  44          1HD1      ILE  44  -5.623  -1.263   2.505
  345   2HD1  ILE  44          2HD1      ILE  44  -7.252  -1.711   2.000
  346   3HD1  ILE  44          3HD1      ILE  44  -6.321  -0.550   1.055
  347    H    ASN  45           H        ASN  45  -5.262   2.852   5.886
  348    HA   ASN  45           HA       ASN  45  -2.570   3.555   5.305
  349   1HB   ASN  45          1HB       ASN  45  -4.433   4.427   7.530
  350   2HB   ASN  45          2HB       ASN  45  -2.845   5.149   7.260
  351   2HD2  ASN  45          2HD2      ASN  45  -5.309   6.643   6.970
  352   1HD2  ASN  45          1HD2      ASN  45  -5.463   7.074   5.335
  353    H    ASN  46           H        ASN  46  -3.990   1.828   8.059
  354    HA   ASN  46           HA       ASN  46  -1.391   1.599   9.411
  355   1HB   ASN  46          1HB       ASN  46  -4.084   0.339  10.008
  356   2HB   ASN  46          2HB       ASN  46  -2.669   0.252  11.059
  357   2HD2  ASN  46          2HD2      ASN  46  -1.656   2.749  11.196
  358   1HD2  ASN  46          1HD2      ASN  46  -2.815   3.885  11.692
  359    H    ALA  47           H        ALA  47  -2.495   0.110   6.721
  360    HA   ALA  47           HA       ALA  47  -2.321  -2.662   7.130
  361   1HB   ALA  47          1HB       ALA  47  -2.798  -1.445   4.942
  362   2HB   ALA  47          2HB       ALA  47  -1.758  -2.862   4.808
  363   3HB   ALA  47          3HB       ALA  47  -1.054  -1.247   4.774
  364    H    LYS  48           H        LYS  48  -0.647  -4.090   7.510
  365    HA   LYS  48           HA       LYS  48   2.063  -2.906   7.985
  366   1HB   LYS  48          1HB       LYS  48   0.710  -5.373   9.100
  367   2HB   LYS  48          2HB       LYS  48   2.409  -4.984   9.376
  368   1HG   LYS  48          1HG       LYS  48   1.740  -2.811  10.360
  369   2HG   LYS  48          2HG       LYS  48   0.046  -3.235  10.124
  370   1HD   LYS  48          1HD       LYS  48   1.991  -4.874  11.778
  371   2HD   LYS  48          2HD       LYS  48   0.888  -3.678  12.454
  372   1HE   LYS  48          1HE       LYS  48  -0.374  -5.620  12.704
  373   2HE   LYS  48          2HE       LYS  48  -0.942  -5.077  11.127
  374   1HZ   LYS  48          1HZ       LYS  48   1.385  -6.576  10.747
  375   2HZ   LYS  48          2HZ       LYS  48   0.373  -7.462  11.780
  376   3HZ   LYS  48          3HZ       LYS  48  -0.199  -6.955  10.262
  377    H    THR  49           H        THR  49   0.659  -4.273   5.464
  378    HA   THR  49           HA       THR  49   3.170  -5.639   4.664
  379    HB   THR  49           HB       THR  49   0.514  -7.011   4.222
  380    HG1  THR  49           HG1      THR  49   1.513  -8.381   5.999
  381   1HG2  THR  49          1HG2      THR  49   2.426  -7.630   2.790
  382   2HG2  THR  49          2HG2      THR  49   3.387  -7.967   4.229
  383   3HG2  THR  49          3HG2      THR  49   1.970  -8.954   3.860
  384    H    VAL  50           H        VAL  50   3.486  -5.648   2.412
  385    HA   VAL  50           HA       VAL  50   2.155  -3.540   0.950
  386    HB   VAL  50           HB       VAL  50   3.776  -5.767  -0.287
  387   1HG1  VAL  50          1HG1      VAL  50   3.491  -2.808  -0.887
  388   2HG1  VAL  50          2HG1      VAL  50   4.502  -3.939  -1.787
  389   3HG1  VAL  50          3HG1      VAL  50   2.748  -4.123  -1.799
  390   1HG2  VAL  50          1HG2      VAL  50   4.696  -3.476   1.454
  391   2HG2  VAL  50          2HG2      VAL  50   5.166  -5.173   1.531
  392   3HG2  VAL  50          3HG2      VAL  50   5.752  -4.154   0.217
  393    H    GLU  51           H        GLU  51   2.269  -7.072   0.422
  394    HA   GLU  51           HA       GLU  51   0.227  -7.134  -1.559
  395   1HB   GLU  51          1HB       GLU  51   1.188  -9.235   0.399
  396   2HB   GLU  51          2HB       GLU  51   0.025  -9.567  -0.886
  397   1HG   GLU  51          1HG       GLU  51   1.657  -8.802  -2.569
  398   2HG   GLU  51          2HG       GLU  51   2.824  -8.469  -1.287
  399    H    GLY  52           H        GLY  52   0.117  -7.380   1.963
  400   1HA   GLY  52          1HA       GLY  52  -1.693  -7.023   3.418
  401   2HA   GLY  52          2HA       GLY  52  -2.555  -8.117   2.335
  402    H    VAL  53           H        VAL  53  -1.248  -5.128   1.061
  403    HA   VAL  53           HA       VAL  53  -3.507  -3.444   1.576
  404    HB   VAL  53           HB       VAL  53  -1.492  -3.404  -0.686
  405   1HG1  VAL  53          1HG1      VAL  53  -3.711  -1.493   0.046
  406   2HG1  VAL  53          2HG1      VAL  53  -2.286  -0.960  -0.845
  407   3HG1  VAL  53          3HG1      VAL  53  -3.344  -2.192  -1.531
  408   1HG2  VAL  53          1HG2      VAL  53  -1.746  -1.954   1.961
  409   2HG2  VAL  53          2HG2      VAL  53  -0.425  -2.991   1.422
  410   3HG2  VAL  53          3HG2      VAL  53  -0.666  -1.410   0.678
  411    H    LYS  54           H        LYS  54  -2.759  -5.427  -1.340
  412    HA   LYS  54           HA       LYS  54  -5.356  -4.796  -2.505
  413   1HB   LYS  54          1HB       LYS  54  -4.734  -6.449  -4.244
  414   2HB   LYS  54          2HB       LYS  54  -3.466  -5.255  -3.978
  415   1HG   LYS  54          1HG       LYS  54  -2.268  -6.844  -2.528
  416   2HG   LYS  54          2HG       LYS  54  -3.531  -8.045  -2.790
  417   1HD   LYS  54          1HD       LYS  54  -3.053  -8.017  -5.209
  418   2HD   LYS  54          2HD       LYS  54  -1.782  -6.822  -4.942
  419   1HE   LYS  54          1HE       LYS  54  -0.554  -8.402  -3.531
  420   2HE   LYS  54          2HE       LYS  54  -1.844  -9.593  -3.709
  421   1HZ   LYS  54          1HZ       LYS  54  -1.446  -9.550  -6.120
  422   2HZ   LYS  54          2HZ       LYS  54  -0.137  -8.499  -5.877
  423   3HZ   LYS  54          3HZ       LYS  54  -0.086 -10.076  -5.247
  424    H    ALA  55           H        ALA  55  -4.006  -7.555  -0.731
  425    HA   ALA  55           HA       ALA  55  -6.234  -9.312  -1.151
  426   1HB   ALA  55          1HB       ALA  55  -5.383 -10.506   0.857
  427   2HB   ALA  55          2HB       ALA  55  -4.282  -9.163   1.164
  428   3HB   ALA  55          3HB       ALA  55  -4.094 -10.142  -0.289
  429    H    LEU  56           H        LEU  56  -5.706  -6.614   0.951
  430    HA   LEU  56           HA       LEU  56  -7.796  -7.224   2.819
  431   1HB   LEU  56          1HB       LEU  56  -6.018  -5.683   3.407
  432   2HB   LEU  56          2HB       LEU  56  -6.494  -4.593   2.110
  433    HG   LEU  56           HG       LEU  56  -8.652  -4.188   3.203
  434   1HD1  LEU  56          1HD1      LEU  56  -7.645  -6.320   5.093
  435   2HD1  LEU  56          2HD1      LEU  56  -8.814  -5.119   5.641
  436   3HD1  LEU  56          3HD1      LEU  56  -9.221  -6.196   4.308
  437   1HD2  LEU  56          1HD2      LEU  56  -6.560  -2.908   3.861
  438   2HD2  LEU  56          2HD2      LEU  56  -7.830  -2.912   5.081
  439   3HD2  LEU  56          3HD2      LEU  56  -6.432  -3.972   5.257
  440    H    ILE  57           H        ILE  57  -7.645  -5.578  -0.283
  441    HA   ILE  57           HA       ILE  57 -10.389  -4.585  -0.108
  442    HB   ILE  57           HB       ILE  57  -8.856  -5.050  -2.675
  443   1HG1  ILE  57          1HG1      ILE  57  -7.266  -3.902  -1.287
  444   2HG1  ILE  57          2HG1      ILE  57  -7.996  -2.681  -2.326
  445   1HG2  ILE  57          1HG2      ILE  57 -11.280  -4.288  -2.643
  446   2HG2  ILE  57          2HG2      ILE  57 -10.724  -2.808  -1.861
  447   3HG2  ILE  57          3HG2      ILE  57 -10.170  -3.210  -3.487
  448   1HD1  ILE  57          1HD1      ILE  57  -9.676  -2.337  -0.378
  449   2HD1  ILE  57          2HD1      ILE  57  -8.492  -3.197   0.603
  450   3HD1  ILE  57          3HD1      ILE  57  -8.053  -1.687  -0.189
  451    H    ASP  58           H        ASP  58  -8.695  -7.362  -1.498
  452    HA   ASP  58           HA       ASP  58 -10.981  -8.475  -2.856
  453   1HB   ASP  58          1HB       ASP  58  -8.411  -9.720  -1.859
  454   2HB   ASP  58          2HB       ASP  58  -9.611 -10.604  -2.799
  455    H    GLU  59           H        GLU  59  -9.637  -9.000   0.405
  456    HA   GLU  59           HA       GLU  59 -11.499 -11.115   1.030
  457   1HB   GLU  59          1HB       GLU  59 -10.662 -10.990   3.266
  458   2HB   GLU  59          2HB       GLU  59  -9.285 -10.627   2.227
  459   1HG   GLU  59          1HG       GLU  59  -9.830  -8.197   2.525
  460   2HG   GLU  59          2HG       GLU  59 -10.980  -8.663   3.771
  461    H    ILE  60           H        ILE  60 -11.476  -7.609   1.454
  462    HA   ILE  60           HA       ILE  60 -13.922  -7.527   2.968
  463    HB   ILE  60           HB       ILE  60 -12.470  -5.431   1.336
  464   1HG1  ILE  60          1HG1      ILE  60 -12.824  -5.709   4.332
  465   2HG1  ILE  60          2HG1      ILE  60 -11.443  -6.377   3.463
  466   1HG2  ILE  60          1HG2      ILE  60 -14.974  -5.242   3.029
  467   2HG2  ILE  60          2HG2      ILE  60 -13.967  -3.839   2.672
  468   3HG2  ILE  60          3HG2      ILE  60 -14.754  -4.717   1.359
  469   1HD1  ILE  60          1HD1      ILE  60 -10.985  -4.075   2.559
  470   2HD1  ILE  60          2HD1      ILE  60 -12.262  -3.463   3.607
  471   3HD1  ILE  60          3HD1      ILE  60 -10.818  -4.191   4.311
  472    H    LEU  61           H        LEU  61 -13.168  -7.259  -0.498
  473    HA   LEU  61           HA       LEU  61 -15.890  -6.693  -1.283
  474   1HB   LEU  61          1HB       LEU  61 -13.499  -7.755  -2.809
  475   2HB   LEU  61          2HB       LEU  61 -15.058  -7.462  -3.575
  476    HG   LEU  61           HG       LEU  61 -13.516  -5.349  -2.037
  477   1HD1  LEU  61          1HD1      LEU  61 -13.611  -5.960  -5.006
  478   2HD1  LEU  61          2HD1      LEU  61 -12.953  -4.473  -4.325
  479   3HD1  LEU  61          3HD1      LEU  61 -12.193  -6.021  -3.960
  480   1HD2  LEU  61          1HD2      LEU  61 -16.042  -5.374  -3.692
  481   2HD2  LEU  61          2HD2      LEU  61 -15.731  -4.578  -2.149
  482   3HD2  LEU  61          3HD2      LEU  61 -15.060  -3.911  -3.632
  483    H    ALA  62           H        ALA  62 -14.035  -9.653  -0.798
  484    HA   ALA  62           HA       ALA  62 -15.855 -11.473  -2.017
  485   1HB   ALA  62          1HB       ALA  62 -13.979 -11.806   0.340
  486   2HB   ALA  62          2HB       ALA  62 -14.877 -13.142  -0.381
  487   3HB   ALA  62          3HB       ALA  62 -13.681 -12.266  -1.337
  488    H    ALA  63           H        ALA  63 -15.769 -10.069   1.241
  489    HA   ALA  63           HA       ALA  63 -17.975 -11.603   2.274
  490   1HB   ALA  63          1HB       ALA  63 -18.065  -9.818   4.024
  491   2HB   ALA  63          2HB       ALA  63 -16.442 -10.466   3.790
  492   3HB   ALA  63          3HB       ALA  63 -16.874  -8.900   3.101
  493    H    LEU  64           H        LEU  64 -17.886  -9.292  -0.138
  494    HA   LEU  64           HA       LEU  64 -20.803  -8.670   0.218
  495   1HB   LEU  64          1HB       LEU  64 -18.695  -6.810  -0.919
  496   2HB   LEU  64          2HB       LEU  64 -20.404  -6.445  -0.701
  497    HG   LEU  64           HG       LEU  64 -18.533  -7.170   1.573
  498   1HD1  LEU  64          1HD1      LEU  64 -19.471  -4.456   0.596
  499   2HD1  LEU  64          2HD1      LEU  64 -18.608  -4.738   2.107
  500   3HD1  LEU  64          3HD1      LEU  64 -17.816  -5.063   0.565
  501   1HD2  LEU  64          1HD2      LEU  64 -21.401  -6.224   1.382
  502   2HD2  LEU  64          2HD2      LEU  64 -20.755  -7.599   2.276
  503   3HD2  LEU  64          3HD2      LEU  64 -20.455  -5.960   2.846
  504    HA   PRO  65           HA       PRO  65 -19.853 -10.839  -3.836
  505   1HB   PRO  65          1HB       PRO  65 -22.624 -11.806  -3.491
  506   2HB   PRO  65          2HB       PRO  65 -21.139 -12.735  -3.725
  507   1HG   PRO  65          1HG       PRO  65 -22.538 -12.583  -1.333
  508   2HG   PRO  65          2HG       PRO  65 -20.835 -13.036  -1.474
  509   1HD   PRO  65          1HD       PRO  65 -22.009 -10.528  -0.429
  510   2HD   PRO  65          2HD       PRO  65 -20.371 -11.185  -0.191

  No H/Q in entry =         510
  Start of MODEL   24
    1    H1   MET   1           H1       MET   1  42.593  -5.834  -2.822
    2    H2   MET   1           H2       MET   1  43.896  -6.411  -1.896
    3    H3   MET   1           H3       MET   1  42.402  -6.097  -1.155
    4    HA   MET   1           HA       MET   1  43.259  -4.125  -0.605
    5   1HB   MET   1          1HB       MET   1  45.503  -5.109  -1.407
    6   2HB   MET   1          2HB       MET   1  45.202  -4.258  -2.921
    7   1HG   MET   1          1HG       MET   1  46.511  -2.759  -1.617
    8   2HG   MET   1          2HG       MET   1  44.858  -2.157  -1.493
    9   1HE   MET   1          1HE       MET   1  45.850  -0.767   0.486
   10   2HE   MET   1          2HE       MET   1  44.161  -1.234   0.655
   11   3HE   MET   1          3HE       MET   1  45.247  -1.304   2.052
   12    H    LYS   2           H        LYS   2  43.560  -4.321  -4.165
   13    HA   LYS   2           HA       LYS   2  42.023  -1.797  -4.418
   14   1HB   LYS   2          1HB       LYS   2  42.679  -1.949  -6.814
   15   2HB   LYS   2          2HB       LYS   2  44.069  -1.991  -5.732
   16   1HG   LYS   2          1HG       LYS   2  44.275  -4.384  -5.964
   17   2HG   LYS   2          2HG       LYS   2  42.750  -4.487  -6.840
   18   1HD   LYS   2          1HD       LYS   2  44.653  -4.598  -8.396
   19   2HD   LYS   2          2HD       LYS   2  43.703  -3.140  -8.672
   20   1HE   LYS   2          1HE       LYS   2  46.062  -3.049  -6.802
   21   2HE   LYS   2          2HE       LYS   2  46.315  -2.955  -8.543
   22   1HZ   LYS   2          1HZ       LYS   2  44.185  -1.262  -7.770
   23   2HZ   LYS   2          2HZ       LYS   2  45.563  -0.906  -6.848
   24   3HZ   LYS   2          3HZ       LYS   2  45.643  -0.861  -8.544
   25    H    ALA   3           H        ALA   3  41.143  -4.885  -3.992
   26    HA   ALA   3           HA       ALA   3  39.484  -5.659  -6.110
   27   1HB   ALA   3          1HB       ALA   3  38.062  -6.770  -4.392
   28   2HB   ALA   3          2HB       ALA   3  38.917  -5.875  -3.136
   29   3HB   ALA   3          3HB       ALA   3  39.781  -7.057  -4.119
   30    H    ILE   4           H        ILE   4  37.273  -5.210  -6.630
   31    HA   ILE   4           HA       ILE   4  36.492  -2.459  -6.282
   32    HB   ILE   4           HB       ILE   4  34.853  -4.835  -7.226
   33   1HG1  ILE   4          1HG1      ILE   4  36.299  -2.742  -8.872
   34   2HG1  ILE   4          2HG1      ILE   4  37.011  -4.308  -8.477
   35   1HG2  ILE   4          1HG2      ILE   4  34.457  -1.838  -7.390
   36   2HG2  ILE   4          2HG2      ILE   4  33.598  -2.968  -8.434
   37   3HG2  ILE   4          3HG2      ILE   4  33.366  -3.031  -6.688
   38   1HD1  ILE   4          1HD1      ILE   4  34.349  -3.941  -9.879
   39   2HD1  ILE   4          2HD1      ILE   4  35.868  -4.303 -10.699
   40   3HD1  ILE   4          3HD1      ILE   4  35.173  -5.471  -9.574
   41    H    PHE   5           H        PHE   5  35.216  -1.556  -4.703
   42    HA   PHE   5           HA       PHE   5  34.586  -3.077  -2.335
   43   1HB   PHE   5          1HB       PHE   5  33.735  -0.313  -3.243
   44   2HB   PHE   5          2HB       PHE   5  33.367  -0.978  -1.653
   45    HD1  PHE   5           HD1      PHE   5  36.025   0.262  -3.875
   46    HD2  PHE   5           HD2      PHE   5  35.128  -1.347   0.006
   47    HE1  PHE   5           HE1      PHE   5  38.269   0.948  -3.071
   48    HE2  PHE   5           HE2      PHE   5  37.373  -0.661   0.809
   49    HZ   PHE   5           HZ       PHE   5  38.943   0.486  -0.731
   50    H    VAL   6           H        VAL   6  32.536  -3.717  -1.554
   51    HA   VAL   6           HA       VAL   6  30.310  -3.767  -3.575
   52    HB   VAL   6           HB       VAL   6  31.002  -5.871  -1.498
   53   1HG1  VAL   6          1HG1      VAL   6  28.867  -5.713  -3.644
   54   2HG1  VAL   6          2HG1      VAL   6  29.262  -7.185  -2.755
   55   3HG1  VAL   6          3HG1      VAL   6  28.612  -5.785  -1.900
   56   1HG2  VAL   6          1HG2      VAL   6  32.601  -5.781  -3.403
   57   2HG2  VAL   6          2HG2      VAL   6  31.641  -7.259  -3.418
   58   3HG2  VAL   6          3HG2      VAL   6  31.249  -5.942  -4.524
   59    H    LEU   7           H        LEU   7  28.430  -2.856  -2.836
   60    HA   LEU   7           HA       LEU   7  28.290  -1.458  -0.379
   61   1HB   LEU   7          1HB       LEU   7  26.163  -2.482  -2.269
   62   2HB   LEU   7          2HB       LEU   7  25.727  -1.622  -0.794
   63    HG   LEU   7           HG       LEU   7  27.257   0.255  -1.554
   64   1HD1  LEU   7          1HD1      LEU   7  27.256  -1.446  -4.061
   65   2HD1  LEU   7          2HD1      LEU   7  27.665   0.269  -4.062
   66   3HD1  LEU   7          3HD1      LEU   7  28.654  -0.871  -3.154
   67   1HD2  LEU   7          1HD2      LEU   7  24.776   0.282  -1.825
   68   2HD2  LEU   7          2HD2      LEU   7  25.605   1.169  -3.104
   69   3HD2  LEU   7          3HD2      LEU   7  24.971  -0.446  -3.420
   70    H    ASN   8           H        ASN   8  27.969  -2.161   1.676
   71    HA   ASN   8           HA       ASN   8  27.709  -4.978   2.254
   72   1HB   ASN   8          1HB       ASN   8  28.855  -3.256   3.715
   73   2HB   ASN   8          2HB       ASN   8  27.253  -2.665   4.157
   74   2HD2  ASN   8          2HD2      ASN   8  27.941  -3.397   6.414
   75   1HD2  ASN   8          1HD2      ASN   8  27.718  -5.028   6.828
   76    H    ALA   9           H        ALA   9  25.462  -2.229   2.335
   77    HA   ALA   9           HA       ALA   9  23.227  -4.064   3.066
   78   1HB   ALA   9          1HB       ALA   9  21.936  -1.966   3.365
   79   2HB   ALA   9          2HB       ALA   9  23.400  -1.981   4.349
   80   3HB   ALA   9          3HB       ALA   9  23.350  -1.040   2.858
   81    H    GLN  10           H        GLN  10  21.123  -3.575   1.843
   82    HA   GLN  10           HA       GLN  10  21.565  -4.013  -0.976
   83   1HB   GLN  10          1HB       GLN  10  19.069  -3.429   0.638
   84   2HB   GLN  10          2HB       GLN  10  19.043  -3.781  -1.091
   85   1HG   GLN  10          1HG       GLN  10  19.989  -5.967  -0.739
   86   2HG   GLN  10          2HG       GLN  10  20.314  -5.612   0.959
   87   2HE2  GLN  10          2HE2      GLN  10  18.667  -7.838   0.119
   88   1HE2  GLN  10          1HE2      GLN  10  17.086  -7.544   0.659
   89    H    HIS  11           H        HIS  11  21.033  -2.592  -2.723
   90    HA   HIS  11           HA       HIS  11  21.789   0.126  -2.374
   91   1HB   HIS  11          1HB       HIS  11  20.956   0.452  -4.677
   92   2HB   HIS  11          2HB       HIS  11  21.903  -1.030  -4.549
   93    HD1  HIS  11           HD1      HIS  11  20.350  -3.273  -4.076
   94    HD2  HIS  11           HD2      HIS  11  18.447   0.034  -5.757
   95    HE1  HIS  11           HE1      HIS  11  18.199  -4.130  -5.103
   96    H    ASP  12           H        ASP  12  18.570  -1.384  -2.529
   97    HA   ASP  12           HA       ASP  12  17.314   1.272  -1.971
   98   1HB   ASP  12          1HB       ASP  12  16.175  -1.400  -2.836
   99   2HB   ASP  12          2HB       ASP  12  15.178  -0.008  -2.408
  100    H    GLU  13           H        GLU  13  17.549   1.576   0.242
  101    HA   GLU  13           HA       GLU  13  17.418  -0.471   2.219
  102   1HB   GLU  13          1HB       GLU  13  18.295   1.820   2.633
  103   2HB   GLU  13          2HB       GLU  13  16.655   2.453   2.494
  104   1HG   GLU  13          1HG       GLU  13  15.946   1.057   4.399
  105   2HG   GLU  13          2HG       GLU  13  17.582   0.412   4.537
  106    H    ALA  14           H        ALA  14  14.903   1.596   0.800
  107    HA   ALA  14           HA       ALA  14  12.810   0.194   2.384
  108   1HB   ALA  14          1HB       ALA  14  11.343   1.939   1.728
  109   2HB   ALA  14          2HB       ALA  14  12.361   2.397   0.362
  110   3HB   ALA  14          3HB       ALA  14  12.885   2.749   2.009
  111    H    VAL  15           H        VAL  15  11.172  -1.039   1.363
  112    HA   VAL  15           HA       VAL  15  11.922  -2.495  -0.975
  113    HB   VAL  15           HB       VAL  15   9.225  -2.110   0.358
  114   1HG1  VAL  15          1HG1      VAL  15  10.075  -3.877  -1.943
  115   2HG1  VAL  15          2HG1      VAL  15   8.678  -4.257  -0.936
  116   3HG1  VAL  15          3HG1      VAL  15   8.709  -2.764  -1.873
  117   1HG2  VAL  15          1HG2      VAL  15  11.257  -4.364   0.401
  118   2HG2  VAL  15          2HG2      VAL  15  10.917  -3.250   1.725
  119   3HG2  VAL  15          3HG2      VAL  15   9.686  -4.399   1.202
  120    H    ASP  16           H        ASP  16   9.524   0.121  -0.537
  121    HA   ASP  16           HA       ASP  16  10.013   0.997  -3.329
  122   1HB   ASP  16          1HB       ASP  16   7.324   0.126  -2.246
  123   2HB   ASP  16          2HB       ASP  16   7.503   1.143  -3.675
  124    H    ALA  17           H        ALA  17   9.461   3.214  -3.651
  125    HA   ALA  17           HA       ALA  17   8.877   4.733  -1.126
  126   1HB   ALA  17          1HB       ALA  17  11.111   5.078  -2.333
  127   2HB   ALA  17          2HB       ALA  17  10.176   5.838  -3.622
  128   3HB   ALA  17          3HB       ALA  17  10.167   6.530  -2.000
  129    H    ASN  18           H        ASN  18   7.506   3.784  -4.054
  130    HA   ASN  18           HA       ASN  18   5.496   6.000  -3.873
  131   1HB   ASN  18          1HB       ASN  18   6.820   4.917  -6.373
  132   2HB   ASN  18          2HB       ASN  18   5.357   5.902  -6.394
  133   2HD2  ASN  18          2HD2      ASN  18   5.922   7.784  -4.379
  134   1HD2  ASN  18          1HD2      ASN  18   7.274   8.707  -4.828
  135    H    SER  19           H        SER  19   6.190   2.721  -5.140
  136    HA   SER  19           HA       SER  19   3.495   2.067  -5.774
  137   1HB   SER  19          1HB       SER  19   5.719   0.242  -4.822
  138   2HB   SER  19          2HB       SER  19   4.213  -0.300  -5.549
  139    HG   SER  19           HG       SER  19   6.067  -0.045  -7.000
  140    H    LEU  20           H        LEU  20   5.297   1.748  -2.710
  141    HA   LEU  20           HA       LEU  20   3.280   0.353  -1.274
  142   1HB   LEU  20          1HB       LEU  20   5.571   0.641  -0.414
  143   2HB   LEU  20          2HB       LEU  20   5.299   2.372  -0.248
  144    HG   LEU  20           HG       LEU  20   3.518   1.946   1.408
  145   1HD1  LEU  20          1HD1      LEU  20   4.155  -0.928   0.734
  146   2HD1  LEU  20          2HD1      LEU  20   3.493  -0.505   2.313
  147   3HD1  LEU  20          3HD1      LEU  20   2.578  -0.149   0.852
  148   1HD2  LEU  20          1HD2      LEU  20   6.120   0.490   1.980
  149   2HD2  LEU  20          2HD2      LEU  20   5.842   2.220   2.178
  150   3HD2  LEU  20          3HD2      LEU  20   4.988   1.067   3.204
  151    H    ALA  21           H        ALA  21   3.879   3.875  -1.493
  152    HA   ALA  21           HA       ALA  21   1.514   4.537   0.010
  153   1HB   ALA  21          1HB       ALA  21   3.651   5.974  -0.481
  154   2HB   ALA  21          2HB       ALA  21   2.796   6.427  -1.955
  155   3HB   ALA  21          3HB       ALA  21   2.086   6.778  -0.380
  156    H    GLU  22           H        GLU  22   2.275   4.361  -3.454
  157    HA   GLU  22           HA       GLU  22  -0.189   5.381  -4.424
  158   1HB   GLU  22          1HB       GLU  22   1.884   4.913  -5.799
  159   2HB   GLU  22          2HB       GLU  22   1.449   3.204  -5.740
  160   1HG   GLU  22          1HG       GLU  22   0.580   4.133  -7.803
  161   2HG   GLU  22          2HG       GLU  22  -0.779   3.797  -6.731
  162    H    ALA  23           H        ALA  23   0.734   2.070  -3.503
  163    HA   ALA  23           HA       ALA  23  -1.622   0.780  -4.432
  164   1HB   ALA  23          1HB       ALA  23  -1.076  -0.996  -2.831
  165   2HB   ALA  23          2HB       ALA  23   0.397  -0.426  -3.615
  166   3HB   ALA  23          3HB       ALA  23   0.017   0.090  -1.972
  167    H    LYS  24           H        LYS  24  -0.914   2.287  -1.267
  168    HA   LYS  24           HA       LYS  24  -3.538   1.713  -0.200
  169   1HB   LYS  24          1HB       LYS  24  -1.402   3.707   0.595
  170   2HB   LYS  24          2HB       LYS  24  -2.901   3.490   1.499
  171   1HG   LYS  24          1HG       LYS  24  -2.345   1.042   1.693
  172   2HG   LYS  24          2HG       LYS  24  -0.780   1.388   0.968
  173   1HD   LYS  24          1HD       LYS  24  -1.828   2.686   3.502
  174   2HD   LYS  24          2HD       LYS  24  -0.711   1.330   3.466
  175   1HE   LYS  24          1HE       LYS  24  -0.234   4.162   2.564
  176   2HE   LYS  24          2HE       LYS  24   0.686   3.203   3.721
  177   1HZ   LYS  24          1HZ       LYS  24   1.196   1.693   1.782
  178   2HZ   LYS  24          2HZ       LYS  24   0.604   2.929   0.777
  179   3HZ   LYS  24          3HZ       LYS  24   1.952   3.211   1.772
  180    H    VAL  25           H        VAL  25  -2.114   4.517  -1.868
  181    HA   VAL  25           HA       VAL  25  -4.357   6.253  -1.558
  182    HB   VAL  25           HB       VAL  25  -2.252   6.092  -3.721
  183   1HG1  VAL  25          1HG1      VAL  25  -4.470   8.091  -3.266
  184   2HG1  VAL  25          2HG1      VAL  25  -3.014   8.491  -4.176
  185   3HG1  VAL  25          3HG1      VAL  25  -4.086   7.212  -4.744
  186   1HG2  VAL  25          1HG2      VAL  25  -1.645   6.679  -1.301
  187   2HG2  VAL  25          2HG2      VAL  25  -1.179   7.861  -2.526
  188   3HG2  VAL  25          3HG2      VAL  25  -2.604   8.141  -1.526
  189    H    LEU  26           H        LEU  26  -3.510   4.008  -4.216
  190    HA   LEU  26           HA       LEU  26  -5.825   4.500  -5.800
  191   1HB   LEU  26          1HB       LEU  26  -4.096   2.030  -5.495
  192   2HB   LEU  26          2HB       LEU  26  -5.379   2.160  -6.697
  193    HG   LEU  26           HG       LEU  26  -3.084   4.130  -6.455
  194   1HD1  LEU  26          1HD1      LEU  26  -3.419   1.733  -8.285
  195   2HD1  LEU  26          2HD1      LEU  26  -2.159   2.956  -8.450
  196   3HD1  LEU  26          3HD1      LEU  26  -2.203   1.922  -7.022
  197   1HD2  LEU  26          1HD2      LEU  26  -5.395   3.757  -8.359
  198   2HD2  LEU  26          2HD2      LEU  26  -4.738   5.243  -7.681
  199   3HD2  LEU  26          3HD2      LEU  26  -3.881   4.417  -8.975
  200    H    ALA  27           H        ALA  27  -5.249   2.084  -3.248
  201    HA   ALA  27           HA       ALA  27  -7.893   0.943  -3.429
  202   1HB   ALA  27          1HB       ALA  27  -5.775  -0.078  -2.366
  203   2HB   ALA  27          2HB       ALA  27  -6.158   0.909  -0.956
  204   3HB   ALA  27          3HB       ALA  27  -7.299  -0.316  -1.511
  205    H    ASN  28           H        ASN  28  -6.504   3.631  -1.637
  206    HA   ASN  28           HA       ASN  28  -8.526   3.972   0.322
  207   1HB   ASN  28          1HB       ASN  28  -6.386   5.185   0.359
  208   2HB   ASN  28          2HB       ASN  28  -6.870   6.090  -1.076
  209   2HD2  ASN  28          2HD2      ASN  28  -7.499   5.670   2.384
  210   1HD2  ASN  28          1HD2      ASN  28  -8.426   7.078   2.566
  211    H    ARG  29           H        ARG  29  -8.322   5.471  -2.951
  212    HA   ARG  29           HA       ARG  29 -10.849   6.824  -2.627
  213   1HB   ARG  29          1HB       ARG  29 -10.736   7.069  -5.147
  214   2HB   ARG  29          2HB       ARG  29  -9.382   7.742  -4.245
  215   1HG   ARG  29          1HG       ARG  29  -7.941   5.957  -4.849
  216   2HG   ARG  29          2HG       ARG  29  -9.280   4.924  -5.324
  217   1HD   ARG  29          1HD       ARG  29  -9.172   5.690  -7.461
  218   2HD   ARG  29          2HD       ARG  29  -9.336   7.358  -6.936
  219    HE   ARG  29           HE       ARG  29  -6.965   6.139  -7.933
  220   1HH1  ARG  29          1HH1      ARG  29  -4.928   7.020  -7.588
  221   2HH1  ARG  29          2HH1      ARG  29  -4.682   8.109  -6.264
  222   1HH2  ARG  29          1HH2      ARG  29  -7.971   7.993  -5.206
  223   2HH2  ARG  29          2HH2      ARG  29  -6.402   8.659  -4.918
  224    H    GLU  30           H        GLU  30 -10.015   3.589  -3.733
  225    HA   GLU  30           HA       GLU  30 -12.423   3.021  -5.151
  226   1HB   GLU  30          1HB       GLU  30 -10.621   1.221  -3.510
  227   2HB   GLU  30          2HB       GLU  30 -11.967   0.620  -4.477
  228   1HG   GLU  30          1HG       GLU  30  -9.743   2.327  -5.614
  229   2HG   GLU  30          2HG       GLU  30  -9.724   0.564  -5.646
  230    H    LEU  31           H        LEU  31 -11.681   2.732  -1.666
  231    HA   LEU  31           HA       LEU  31 -14.197   1.612  -0.906
  232   1HB   LEU  31          1HB       LEU  31 -12.664   3.587   0.800
  233   2HB   LEU  31          2HB       LEU  31 -13.632   2.208   1.325
  234    HG   LEU  31           HG       LEU  31 -10.960   2.166  -0.076
  235   1HD1  LEU  31          1HD1      LEU  31 -11.012   2.472   2.404
  236   2HD1  LEU  31          2HD1      LEU  31 -11.888   0.948   2.541
  237   3HD1  LEU  31          3HD1      LEU  31 -10.238   0.964   1.919
  238   1HD2  LEU  31          1HD2      LEU  31 -12.987  -0.038   0.362
  239   2HD2  LEU  31          2HD2      LEU  31 -12.160   0.400  -1.133
  240   3HD2  LEU  31          3HD2      LEU  31 -11.269  -0.390   0.167
  241    H    ASP  32           H        ASP  32 -13.077   4.972  -1.040
  242    HA   ASP  32           HA       ASP  32 -15.528   6.213  -0.300
  243   1HB   ASP  32          1HB       ASP  32 -13.353   7.388  -0.410
  244   2HB   ASP  32          2HB       ASP  32 -13.344   7.202  -2.162
  245    H    LYS  33           H        LYS  33 -14.239   5.155  -3.424
  246    HA   LYS  33           HA       LYS  33 -16.283   6.205  -5.106
  247   1HB   LYS  33          1HB       LYS  33 -14.158   5.228  -5.936
  248   2HB   LYS  33          2HB       LYS  33 -14.691   3.636  -5.404
  249   1HG   LYS  33          1HG       LYS  33 -16.617   3.761  -6.943
  250   2HG   LYS  33          2HG       LYS  33 -16.078   5.356  -7.479
  251   1HD   LYS  33          1HD       LYS  33 -13.947   4.381  -8.248
  252   2HD   LYS  33          2HD       LYS  33 -14.484   2.789  -7.715
  253   1HE   LYS  33          1HE       LYS  33 -15.866   4.489  -9.807
  254   2HE   LYS  33          2HE       LYS  33 -14.841   3.094 -10.138
  255   1HZ   LYS  33          1HZ       LYS  33 -16.605   2.147  -8.318
  256   2HZ   LYS  33          2HZ       LYS  33 -17.569   3.188  -9.248
  257   3HZ   LYS  33          3HZ       LYS  33 -16.715   1.925  -9.999
  258    H    TYR  34           H        TYR  34 -15.988   2.992  -3.555
  259    HA   TYR  34           HA       TYR  34 -18.595   2.122  -4.436
  260   1HB   TYR  34          1HB       TYR  34 -16.742   1.110  -2.265
  261   2HB   TYR  34          2HB       TYR  34 -18.268   0.326  -2.671
  262    HD1  TYR  34           HD1      TYR  34 -18.613  -0.015  -5.333
  263    HD2  TYR  34           HD2      TYR  34 -14.817   0.288  -3.332
  264    HE1  TYR  34           HE1      TYR  34 -17.518  -1.178  -7.226
  265    HE2  TYR  34           HE2      TYR  34 -13.729  -0.876  -5.230
  266    HH   TYR  34           HH       TYR  34 -15.257  -1.349  -8.219
  267    H    GLY  35           H        GLY  35 -17.412   3.891  -1.647
  268   1HA   GLY  35          1HA       GLY  35 -20.239   4.381  -0.840
  269   2HA   GLY  35          2HA       GLY  35 -18.853   5.368  -0.384
  270    H    VAL  36           H        VAL  36 -17.303   2.854   0.299
  271    HA   VAL  36           HA       VAL  36 -18.735   1.542   2.443
  272    HB   VAL  36           HB       VAL  36 -15.722   1.735   2.303
  273   1HG1  VAL  36          1HG1      VAL  36 -16.799   0.511   4.177
  274   2HG1  VAL  36          2HG1      VAL  36 -17.628  -0.517   3.008
  275   3HG1  VAL  36          3HG1      VAL  36 -15.869  -0.567   3.135
  276   1HG2  VAL  36          1HG2      VAL  36 -17.594   0.177   0.504
  277   2HG2  VAL  36          2HG2      VAL  36 -16.321   1.299   0.024
  278   3HG2  VAL  36          3HG2      VAL  36 -15.899  -0.261   0.728
  279    H    SER  37           H        SER  37 -18.036   1.745   4.780
  280    HA   SER  37           HA       SER  37 -18.294   4.427   5.689
  281   1HB   SER  37          1HB       SER  37 -17.873   3.554   7.897
  282   2HB   SER  37          2HB       SER  37 -18.786   2.331   7.017
  283    HG   SER  37           HG       SER  37 -16.026   2.221   6.782
  284    H    ASP  38           H        ASP  38 -16.674   5.706   6.888
  285    HA   ASP  38           HA       ASP  38 -14.145   5.815   5.449
  286   1HB   ASP  38          1HB       ASP  38 -13.659   7.731   6.943
  287   2HB   ASP  38          2HB       ASP  38 -15.257   7.876   6.208
  288    H    TYR  39           H        TYR  39 -15.204   3.930   7.993
  289    HA   TYR  39           HA       TYR  39 -12.926   3.972   9.738
  290   1HB   TYR  39          1HB       TYR  39 -14.973   2.969  10.509
  291   2HB   TYR  39          2HB       TYR  39 -15.007   1.851   9.145
  292    HD1  TYR  39           HD1      TYR  39 -13.476  -0.042   9.025
  293    HD2  TYR  39           HD2      TYR  39 -13.463   2.612  12.399
  294    HE1  TYR  39           HE1      TYR  39 -12.144  -1.684  10.305
  295    HE2  TYR  39           HE2      TYR  39 -12.128   0.967  13.688
  296    HH   TYR  39           HH       TYR  39 -11.798  -1.608  13.591
  297    H    TYR  40           H        TYR  40 -13.693   2.013   6.868
  298    HA   TYR  40           HA       TYR  40 -11.417   0.283   7.041
  299   1HB   TYR  40          1HB       TYR  40 -13.065   1.140   4.647
  300   2HB   TYR  40          2HB       TYR  40 -11.874  -0.159   4.622
  301    HD1  TYR  40           HD1      TYR  40 -15.164   0.909   5.851
  302    HD2  TYR  40           HD2      TYR  40 -12.270  -2.266   5.819
  303    HE1  TYR  40           HE1      TYR  40 -16.873  -0.655   6.725
  304    HE2  TYR  40           HE2      TYR  40 -13.982  -3.833   6.697
  305    HH   TYR  40           HH       TYR  40 -16.754  -2.911   8.128
  306    H    LYS  41           H        LYS  41 -11.831   3.438   5.398
  307    HA   LYS  41           HA       LYS  41  -9.413   3.314   3.922
  308   1HB   LYS  41          1HB       LYS  41  -9.689   5.604   3.472
  309   2HB   LYS  41          2HB       LYS  41 -11.332   5.047   3.757
  310   1HG   LYS  41          1HG       LYS  41 -11.421   6.856   5.173
  311   2HG   LYS  41          2HG       LYS  41 -10.649   5.757   6.298
  312   1HD   LYS  41          1HD       LYS  41  -9.205   7.583   6.425
  313   2HD   LYS  41          2HD       LYS  41  -8.415   6.626   5.173
  314   1HE   LYS  41          1HE       LYS  41  -9.695   7.954   3.454
  315   2HE   LYS  41          2HE       LYS  41 -10.276   8.984   4.761
  316   1HZ   LYS  41          1HZ       LYS  41  -7.436   8.590   4.820
  317   2HZ   LYS  41          2HZ       LYS  41  -7.964   9.331   3.384
  318   3HZ   LYS  41          3HZ       LYS  41  -8.332  10.032   4.884
  319    H    ASN  42           H        ASN  42 -10.044   4.127   7.282
  320    HA   ASN  42           HA       ASN  42  -7.419   5.186   7.796
  321   1HB   ASN  42          1HB       ASN  42  -9.522   3.994   9.621
  322   2HB   ASN  42          2HB       ASN  42  -8.011   4.685  10.213
  323   2HD2  ASN  42          2HD2      ASN  42  -7.783   6.909   8.431
  324   1HD2  ASN  42          1HD2      ASN  42  -9.057   7.985   8.748
  325    H    LEU  43           H        LEU  43  -8.897   1.991   8.033
  326    HA   LEU  43           HA       LEU  43  -6.725   0.635   9.255
  327   1HB   LEU  43          1HB       LEU  43  -8.975  -0.343   9.015
  328   2HB   LEU  43          2HB       LEU  43  -8.768  -0.404   7.267
  329    HG   LEU  43           HG       LEU  43  -6.892  -1.966   7.523
  330   1HD1  LEU  43          1HD1      LEU  43  -7.372  -1.430  10.454
  331   2HD1  LEU  43          2HD1      LEU  43  -6.686  -2.973   9.943
  332   3HD1  LEU  43          3HD1      LEU  43  -5.846  -1.471   9.571
  333   1HD2  LEU  43          1HD2      LEU  43  -9.308  -2.739   7.448
  334   2HD2  LEU  43          2HD2      LEU  43  -8.193  -3.884   8.193
  335   3HD2  LEU  43          3HD2      LEU  43  -9.239  -2.887   9.203
  336    H    ILE  44           H        ILE  44  -7.400   1.350   5.833
  337    HA   ILE  44           HA       ILE  44  -5.241  -0.156   4.708
  338    HB   ILE  44           HB       ILE  44  -6.398   2.486   3.751
  339   1HG1  ILE  44          1HG1      ILE  44  -8.180   0.844   3.940
  340   2HG1  ILE  44          2HG1      ILE  44  -7.776   1.036   2.238
  341   1HG2  ILE  44          1HG2      ILE  44  -4.769   0.342   2.367
  342   2HG2  ILE  44          2HG2      ILE  44  -5.604   1.641   1.516
  343   3HG2  ILE  44          3HG2      ILE  44  -4.305   2.020   2.646
  344   1HD1  ILE  44          1HD1      ILE  44  -6.176  -0.988   2.634
  345   2HD1  ILE  44          2HD1      ILE  44  -7.147  -1.255   4.080
  346   3HD1  ILE  44          3HD1      ILE  44  -7.905  -1.292   2.492
  347    H    ASN  45           H        ASN  45  -5.430   3.125   6.008
  348    HA   ASN  45           HA       ASN  45  -2.735   3.861   5.337
  349   1HB   ASN  45          1HB       ASN  45  -4.670   4.889   7.432
  350   2HB   ASN  45          2HB       ASN  45  -3.092   5.619   7.132
  351   2HD2  ASN  45          2HD2      ASN  45  -5.582   7.026   6.660
  352   1HD2  ASN  45          1HD2      ASN  45  -5.704   7.311   4.991
  353    H    ASN  46           H        ASN  46  -4.082   1.826   7.769
  354    HA   ASN  46           HA       ASN  46  -1.736   2.049   9.550
  355   1HB   ASN  46          1HB       ASN  46  -3.957   1.686  10.540
  356   2HB   ASN  46          2HB       ASN  46  -4.131   0.188   9.624
  357   2HD2  ASN  46          2HD2      ASN  46  -1.509   1.626  11.664
  358   1HD2  ASN  46          1HD2      ASN  46  -1.250   0.217  12.573
  359    H    ALA  47           H        ALA  47  -2.511   0.387   6.708
  360    HA   ALA  47           HA       ALA  47  -1.378  -2.182   7.156
  361   1HB   ALA  47          1HB       ALA  47  -2.658  -1.351   5.098
  362   2HB   ALA  47          2HB       ALA  47  -1.268  -2.389   4.784
  363   3HB   ALA  47          3HB       ALA  47  -1.133  -0.646   4.566
  364    H    LYS  48           H        LYS  48   0.685  -2.787   7.538
  365    HA   LYS  48           HA       LYS  48   2.836  -0.769   7.400
  366   1HB   LYS  48          1HB       LYS  48   2.449  -2.446   9.333
  367   2HB   LYS  48          2HB       LYS  48   3.128  -3.655   8.249
  368   1HG   LYS  48          1HG       LYS  48   5.033  -2.939   9.403
  369   2HG   LYS  48          2HG       LYS  48   5.088  -1.923   7.963
  370   1HD   LYS  48          1HD       LYS  48   4.103  -0.057   9.181
  371   2HD   LYS  48          2HD       LYS  48   3.839  -1.073  10.598
  372   1HE   LYS  48          1HE       LYS  48   6.216  -1.332  10.937
  373   2HE   LYS  48          2HE       LYS  48   6.571  -0.528   9.409
  374   1HZ   LYS  48          1HZ       LYS  48   4.993   0.867  11.465
  375   2HZ   LYS  48          2HZ       LYS  48   6.686   0.801  11.604
  376   3HZ   LYS  48          3HZ       LYS  48   5.969   1.515  10.239
  377    H    THR  49           H        THR  49   1.629  -3.422   5.543
  378    HA   THR  49           HA       THR  49   3.931  -3.124   3.662
  379    HB   THR  49           HB       THR  49   4.373  -5.136   5.019
  380    HG1  THR  49           HG1      THR  49   3.887  -6.624   3.012
  381   1HG2  THR  49          1HG2      THR  49   1.991  -5.575   5.614
  382   2HG2  THR  49          2HG2      THR  49   1.713  -6.130   3.964
  383   3HG2  THR  49          3HG2      THR  49   2.822  -7.010   5.015
  384    H    VAL  50           H        VAL  50   3.377  -3.510   1.481
  385    HA   VAL  50           HA       VAL  50   0.606  -2.976   0.821
  386    HB   VAL  50           HB       VAL  50   2.430  -2.074  -0.526
  387   1HG1  VAL  50          1HG1      VAL  50   3.977  -4.010  -0.256
  388   2HG1  VAL  50          2HG1      VAL  50   2.943  -4.955  -1.326
  389   3HG1  VAL  50          3HG1      VAL  50   3.788  -3.537  -1.944
  390   1HG2  VAL  50          1HG2      VAL  50   0.171  -2.589  -1.524
  391   2HG2  VAL  50          2HG2      VAL  50   1.487  -2.554  -2.697
  392   3HG2  VAL  50          3HG2      VAL  50   0.851  -4.099  -2.133
  393    H    GLU  51           H        GLU  51   2.522  -5.867   1.093
  394    HA   GLU  51           HA       GLU  51   1.056  -7.580  -0.634
  395   1HB   GLU  51          1HB       GLU  51   2.449  -8.129   2.005
  396   2HB   GLU  51          2HB       GLU  51   1.804  -9.398   0.963
  397   1HG   GLU  51          1HG       GLU  51   3.238  -8.637  -0.882
  398   2HG   GLU  51          2HG       GLU  51   3.873  -7.342   0.133
  399    H    GLY  52           H        GLY  52   0.481  -6.557   2.703
  400   1HA   GLY  52          1HA       GLY  52  -1.383  -6.908   4.101
  401   2HA   GLY  52          2HA       GLY  52  -1.911  -8.184   3.004
  402    H    VAL  53           H        VAL  53  -1.190  -4.935   1.831
  403    HA   VAL  53           HA       VAL  53  -3.796  -3.818   2.086
  404    HB   VAL  53           HB       VAL  53  -1.596  -3.304   0.071
  405   1HG1  VAL  53          1HG1      VAL  53  -4.242  -1.900   0.511
  406   2HG1  VAL  53          2HG1      VAL  53  -2.872  -1.118  -0.276
  407   3HG1  VAL  53          3HG1      VAL  53  -3.604  -2.550  -0.999
  408   1HG2  VAL  53          1HG2      VAL  53  -2.560  -1.816   2.535
  409   2HG2  VAL  53          2HG2      VAL  53  -1.078  -2.764   2.419
  410   3HG2  VAL  53          3HG2      VAL  53  -1.256  -1.287   1.471
  411    H    LYS  54           H        LYS  54  -2.367  -5.550  -0.735
  412    HA   LYS  54           HA       LYS  54  -4.815  -5.419  -2.249
  413   1HB   LYS  54          1HB       LYS  54  -3.776  -6.963  -3.780
  414   2HB   LYS  54          2HB       LYS  54  -2.527  -5.853  -3.220
  415   1HG   LYS  54          1HG       LYS  54  -1.925  -7.574  -1.464
  416   2HG   LYS  54          2HG       LYS  54  -3.011  -8.692  -2.287
  417   1HD   LYS  54          1HD       LYS  54  -1.699  -8.255  -4.407
  418   2HD   LYS  54          2HD       LYS  54  -0.527  -7.382  -3.418
  419   1HE   LYS  54          1HE       LYS  54   0.160  -9.735  -3.750
  420   2HE   LYS  54          2HE       LYS  54  -0.164  -9.396  -2.050
  421   1HZ   LYS  54          1HZ       LYS  54  -2.257 -10.473  -3.835
  422   2HZ   LYS  54          2HZ       LYS  54  -1.159 -11.498  -3.039
  423   3HZ   LYS  54          3HZ       LYS  54  -2.197 -10.496  -2.140
  424    H    ALA  55           H        ALA  55  -3.504  -7.803   0.011
  425    HA   ALA  55           HA       ALA  55  -5.512  -9.810  -0.502
  426   1HB   ALA  55          1HB       ALA  55  -3.897  -9.341   2.023
  427   2HB   ALA  55          2HB       ALA  55  -4.726 -10.832   1.577
  428   3HB   ALA  55          3HB       ALA  55  -3.344 -10.276   0.634
  429    H    LEU  56           H        LEU  56  -5.276  -7.131   1.809
  430    HA   LEU  56           HA       LEU  56  -7.577  -7.757   3.361
  431   1HB   LEU  56          1HB       LEU  56  -5.780  -5.967   3.812
  432   2HB   LEU  56          2HB       LEU  56  -6.658  -4.954   2.669
  433    HG   LEU  56           HG       LEU  56  -8.743  -5.551   4.168
  434   1HD1  LEU  56          1HD1      LEU  56  -7.219  -7.185   5.523
  435   2HD1  LEU  56          2HD1      LEU  56  -6.633  -5.725   6.315
  436   3HD1  LEU  56          3HD1      LEU  56  -8.341  -6.152   6.403
  437   1HD2  LEU  56          1HD2      LEU  56  -6.550  -3.559   4.716
  438   2HD2  LEU  56          2HD2      LEU  56  -8.174  -3.297   4.077
  439   3HD2  LEU  56          3HD2      LEU  56  -7.947  -3.638   5.789
  440    H    ILE  57           H        ILE  57  -7.213  -5.609   0.538
  441    HA   ILE  57           HA       ILE  57  -9.990  -4.962   0.286
  442    HB   ILE  57           HB       ILE  57  -7.872  -5.141  -1.874
  443   1HG1  ILE  57          1HG1      ILE  57  -7.165  -3.595  -0.123
  444   2HG1  ILE  57          2HG1      ILE  57  -7.681  -2.667  -1.524
  445   1HG2  ILE  57          1HG2      ILE  57 -10.563  -3.767  -1.796
  446   2HG2  ILE  57          2HG2      ILE  57  -9.341  -3.476  -3.034
  447   3HG2  ILE  57          3HG2      ILE  57 -10.058  -5.074  -2.863
  448   1HD1  ILE  57          1HD1      ILE  57 -10.019  -2.657  -0.290
  449   2HD1  ILE  57          2HD1      ILE  57  -9.039  -3.002   1.134
  450   3HD1  ILE  57          3HD1      ILE  57  -8.757  -1.532   0.206
  451    H    ASP  58           H        ASP  58  -8.013  -7.617  -0.978
  452    HA   ASP  58           HA       ASP  58  -9.949  -8.682  -2.782
  453   1HB   ASP  58          1HB       ASP  58  -7.785 -10.035  -1.147
  454   2HB   ASP  58          2HB       ASP  58  -8.740 -10.874  -2.370
  455    H    GLU  59           H        GLU  59  -9.482  -9.187   0.700
  456    HA   GLU  59           HA       GLU  59 -11.587 -11.156   0.924
  457   1HB   GLU  59          1HB       GLU  59 -10.218  -9.380   2.963
  458   2HB   GLU  59          2HB       GLU  59 -11.435 -10.585   3.389
  459   1HG   GLU  59          1HG       GLU  59 -10.059 -12.350   2.352
  460   2HG   GLU  59          2HG       GLU  59  -8.838 -11.152   1.925
  461    H    ILE  60           H        ILE  60 -11.384  -7.642   1.319
  462    HA   ILE  60           HA       ILE  60 -14.085  -7.321   2.235
  463    HB   ILE  60           HB       ILE  60 -12.228  -5.352   0.873
  464   1HG1  ILE  60          1HG1      ILE  60 -12.918  -5.646   3.809
  465   2HG1  ILE  60          2HG1      ILE  60 -11.508  -6.411   3.079
  466   1HG2  ILE  60          1HG2      ILE  60 -14.884  -5.035   2.286
  467   2HG2  ILE  60          2HG2      ILE  60 -13.755  -3.695   2.099
  468   3HG2  ILE  60          3HG2      ILE  60 -14.438  -4.477   0.674
  469   1HD1  ILE  60          1HD1      ILE  60 -12.042  -3.446   2.828
  470   2HD1  ILE  60          2HD1      ILE  60 -11.112  -4.127   4.163
  471   3HD1  ILE  60          3HD1      ILE  60 -10.537  -4.310   2.506
  472    H    LEU  61           H        LEU  61 -12.602  -7.041  -1.012
  473    HA   LEU  61           HA       LEU  61 -15.103  -6.349  -2.290
  474   1HB   LEU  61          1HB       LEU  61 -12.502  -7.447  -3.395
  475   2HB   LEU  61          2HB       LEU  61 -13.878  -7.037  -4.415
  476    HG   LEU  61           HG       LEU  61 -12.423  -5.117  -2.563
  477   1HD1  LEU  61          1HD1      LEU  61 -11.224  -5.949  -4.676
  478   2HD1  LEU  61          2HD1      LEU  61 -12.486  -5.126  -5.590
  479   3HD1  LEU  61          3HD1      LEU  61 -11.423  -4.201  -4.533
  480   1HD2  LEU  61          1HD2      LEU  61 -14.887  -4.889  -4.281
  481   2HD2  LEU  61          2HD2      LEU  61 -14.544  -4.157  -2.714
  482   3HD2  LEU  61          3HD2      LEU  61 -13.818  -3.492  -4.173
  483    H    ALA  62           H        ALA  62 -13.530  -9.386  -1.488
  484    HA   ALA  62           HA       ALA  62 -15.380 -10.967  -3.120
  485   1HB   ALA  62          1HB       ALA  62 -13.551 -11.894  -0.887
  486   2HB   ALA  62          2HB       ALA  62 -13.044 -11.714  -2.566
  487   3HB   ALA  62          3HB       ALA  62 -14.282 -12.896  -2.139
  488    H    ALA  63           H        ALA  63 -16.319  -9.098  -0.843
  489    HA   ALA  63           HA       ALA  63 -18.232 -11.060   0.306
  490   1HB   ALA  63          1HB       ALA  63 -16.718  -9.124   2.076
  491   2HB   ALA  63          2HB       ALA  63 -17.830 -10.396   2.581
  492   3HB   ALA  63          3HB       ALA  63 -16.265 -10.819   1.888
  493    H    LEU  64           H        LEU  64 -17.333  -7.759  -0.461
  494    HA   LEU  64           HA       LEU  64 -19.422  -6.312   0.684
  495   1HB   LEU  64          1HB       LEU  64 -17.609  -5.987  -1.589
  496   2HB   LEU  64          2HB       LEU  64 -19.155  -5.206  -1.901
  497    HG   LEU  64           HG       LEU  64 -17.675  -4.768   0.704
  498   1HD1  LEU  64          1HD1      LEU  64 -17.330  -3.349  -1.947
  499   2HD1  LEU  64          2HD1      LEU  64 -16.882  -2.616  -0.408
  500   3HD1  LEU  64          3HD1      LEU  64 -16.081  -4.090  -0.949
  501   1HD2  LEU  64          1HD2      LEU  64 -19.705  -3.139  -0.867
  502   2HD2  LEU  64          2HD2      LEU  64 -20.051  -4.085   0.580
  503   3HD2  LEU  64          3HD2      LEU  64 -19.000  -2.673   0.681
  504    HA   PRO  65           HA       PRO  65 -22.834  -8.673  -1.297
  505   1HB   PRO  65          1HB       PRO  65 -24.555  -6.470  -0.324
  506   2HB   PRO  65          2HB       PRO  65 -24.638  -8.199   0.038
  507   1HG   PRO  65          1HG       PRO  65 -23.760  -6.252   1.817
  508   2HG   PRO  65          2HG       PRO  65 -23.385  -7.976   1.941
  509   1HD   PRO  65          1HD       PRO  65 -21.597  -5.747   1.208
  510   2HD   PRO  65          2HD       PRO  65 -21.178  -7.413   1.685

  No H/Q in entry =         510
  Start of MODEL   25
    1    H1   MET   1           H1       MET   1  21.143 -11.864 -12.239
    2    H2   MET   1           H2       MET   1  20.848 -10.809 -13.539
    3    H3   MET   1           H3       MET   1  19.828 -12.138 -13.279
    4    HA   MET   1           HA       MET   1  21.455 -13.682 -13.937
    5   1HB   MET   1          1HB       MET   1  21.492 -11.208 -15.687
    6   2HB   MET   1          2HB       MET   1  22.156 -12.762 -16.187
    7   1HG   MET   1          1HG       MET   1  19.915 -12.663 -17.044
    8   2HG   MET   1          2HG       MET   1  19.889 -13.778 -15.679
    9   1HE   MET   1          1HE       MET   1  19.692 -10.253 -16.822
   10   2HE   MET   1          2HE       MET   1  18.017 -10.666 -17.176
   11   3HE   MET   1          3HE       MET   1  18.392  -9.479 -15.920
   12    H    LYS   2           H        LYS   2  22.696 -10.620 -12.938
   13    HA   LYS   2           HA       LYS   2  25.366 -11.799 -12.555
   14   1HB   LYS   2          1HB       LYS   2  26.520  -9.960 -13.739
   15   2HB   LYS   2          2HB       LYS   2  25.511 -10.896 -14.838
   16   1HG   LYS   2          1HG       LYS   2  23.727  -9.202 -14.667
   17   2HG   LYS   2          2HG       LYS   2  24.709  -8.270 -13.541
   18   1HD   LYS   2          1HD       LYS   2  25.125  -7.207 -15.593
   19   2HD   LYS   2          2HD       LYS   2  26.508  -8.284 -15.419
   20   1HE   LYS   2          1HE       LYS   2  25.515  -9.905 -16.922
   21   2HE   LYS   2          2HE       LYS   2  24.000  -9.005 -16.967
   22   1HZ   LYS   2          1HZ       LYS   2  25.663  -7.111 -17.725
   23   2HZ   LYS   2          2HZ       LYS   2  26.535  -8.455 -18.291
   24   3HZ   LYS   2          3HZ       LYS   2  24.945  -8.182 -18.826
   25    H    ALA   3           H        ALA   3  26.798 -10.066 -11.407
   26    HA   ALA   3           HA       ALA   3  25.593  -9.275  -9.010
   27   1HB   ALA   3          1HB       ALA   3  27.511  -7.758  -8.701
   28   2HB   ALA   3          2HB       ALA   3  27.901  -7.895 -10.416
   29   3HB   ALA   3          3HB       ALA   3  28.039  -9.305  -9.365
   30    H    ILE   4           H        ILE   4  24.647  -7.349  -8.275
   31    HA   ILE   4           HA       ILE   4  23.429  -5.673 -10.398
   32    HB   ILE   4           HB       ILE   4  22.008  -4.843  -8.511
   33   1HG1  ILE   4          1HG1      ILE   4  23.476  -6.964  -6.912
   34   2HG1  ILE   4          2HG1      ILE   4  23.755  -5.232  -6.738
   35   1HG2  ILE   4          1HG2      ILE   4  21.413  -6.839  -9.911
   36   2HG2  ILE   4          2HG2      ILE   4  22.172  -7.867  -8.694
   37   3HG2  ILE   4          3HG2      ILE   4  20.747  -6.913  -8.280
   38   1HD1  ILE   4          1HD1      ILE   4  21.055  -6.565  -6.365
   39   2HD1  ILE   4          2HD1      ILE   4  22.149  -6.152  -5.045
   40   3HD1  ILE   4          3HD1      ILE   4  21.454  -4.877  -6.045
   41    H    PHE   5           H        PHE   5  23.001  -3.305  -9.031
   42    HA   PHE   5           HA       PHE   5  25.436  -1.905  -9.464
   43   1HB   PHE   5          1HB       PHE   5  23.227  -0.803  -9.486
   44   2HB   PHE   5          2HB       PHE   5  23.066  -1.090  -7.752
   45    HD1  PHE   5           HD1      PHE   5  24.421   0.142  -6.134
   46    HD2  PHE   5           HD2      PHE   5  24.819   0.838 -10.354
   47    HE1  PHE   5           HE1      PHE   5  25.695   2.218  -5.672
   48    HE2  PHE   5           HE2      PHE   5  26.092   2.916  -9.892
   49    HZ   PHE   5           HZ       PHE   5  26.530   3.606  -7.550
   50    H    VAL   6           H        VAL   6  23.931  -3.001  -6.406
   51    HA   VAL   6           HA       VAL   6  26.414  -2.236  -4.950
   52    HB   VAL   6           HB       VAL   6  24.092  -1.666  -4.078
   53   1HG1  VAL   6          1HG1      VAL   6  23.202  -3.976  -4.764
   54   2HG1  VAL   6          2HG1      VAL   6  23.938  -4.574  -3.278
   55   3HG1  VAL   6          3HG1      VAL   6  22.679  -3.347  -3.203
   56   1HG2  VAL   6          1HG2      VAL   6  26.415  -2.462  -2.661
   57   2HG2  VAL   6          2HG2      VAL   6  25.057  -1.549  -2.011
   58   3HG2  VAL   6          3HG2      VAL   6  25.098  -3.301  -1.850
   59    H    LEU   7           H        LEU   7  26.050  -4.358  -2.928
   60    HA   LEU   7           HA       LEU   7  27.740  -6.340  -4.002
   61   1HB   LEU   7          1HB       LEU   7  27.336  -5.975  -1.560
   62   2HB   LEU   7          2HB       LEU   7  25.744  -6.705  -1.747
   63    HG   LEU   7           HG       LEU   7  26.834  -8.793  -2.580
   64   1HD1  LEU   7          1HD1      LEU   7  29.298  -7.120  -2.141
   65   2HD1  LEU   7          2HD1      LEU   7  29.392  -8.862  -1.885
   66   3HD1  LEU   7          3HD1      LEU   7  28.922  -8.231  -3.459
   67   1HD2  LEU   7          1HD2      LEU   7  27.528  -7.689   0.148
   68   2HD2  LEU   7          2HD2      LEU   7  26.259  -8.837  -0.280
   69   3HD2  LEU   7          3HD2      LEU   7  27.948  -9.341  -0.307
   70    H    ASN   8           H        ASN   8  27.324  -8.442  -4.815
   71    HA   ASN   8           HA       ASN   8  24.971  -8.688  -6.460
   72   1HB   ASN   8          1HB       ASN   8  25.870 -10.970  -6.945
   73   2HB   ASN   8          2HB       ASN   8  27.066  -9.692  -7.164
   74   2HD2  ASN   8          2HD2      ASN   8  26.409 -10.157  -3.851
   75   1HD2  ASN   8          1HD2      ASN   8  27.737 -11.148  -3.483
   76    H    ALA   9           H        ALA   9  24.692  -8.636  -3.381
   77    HA   ALA   9           HA       ALA   9  23.809 -11.147  -2.435
   78   1HB   ALA   9          1HB       ALA   9  22.532  -8.479  -1.775
   79   2HB   ALA   9          2HB       ALA   9  24.049  -9.037  -1.069
   80   3HB   ALA   9          3HB       ALA   9  22.555  -9.926  -0.768
   81    H    GLN  10           H        GLN  10  21.862 -12.263  -2.629
   82    HA   GLN  10           HA       GLN  10  20.290 -11.793  -4.988
   83   1HB   GLN  10          1HB       GLN  10  18.821 -13.603  -4.062
   84   2HB   GLN  10          2HB       GLN  10  20.525 -14.047  -4.126
   85   1HG   GLN  10          1HG       GLN  10  19.791 -14.744  -1.974
   86   2HG   GLN  10          2HG       GLN  10  20.662 -13.241  -1.687
   87   2HE2  GLN  10          2HE2      GLN  10  19.460 -12.508   0.146
   88   1HE2  GLN  10          1HE2      GLN  10  17.807 -12.131   0.077
   89    H    HIS  11           H        HIS  11  19.969 -10.752  -1.665
   90    HA   HIS  11           HA       HIS  11  17.187 -10.169  -1.616
   91   1HB   HIS  11          1HB       HIS  11  18.627 -10.065   0.391
   92   2HB   HIS  11          2HB       HIS  11  19.452  -8.656  -0.277
   93    HD1  HIS  11           HD1      HIS  11  15.848  -9.682   0.478
   94    HD2  HIS  11           HD2      HIS  11  18.284  -6.300   0.559
   95    HE1  HIS  11           HE1      HIS  11  14.421  -7.793   1.379
   96    H    ASP  12           H        ASP  12  15.992  -8.504  -2.475
   97    HA   ASP  12           HA       ASP  12  17.374  -6.135  -3.615
   98   1HB   ASP  12          1HB       ASP  12  17.232  -7.830  -5.449
   99   2HB   ASP  12          2HB       ASP  12  15.480  -7.862  -5.242
  100    H    GLU  13           H        GLU  13  16.098  -4.304  -3.451
  101    HA   GLU  13           HA       GLU  13  13.192  -4.639  -2.842
  102   1HB   GLU  13          1HB       GLU  13  14.397  -4.481  -0.680
  103   2HB   GLU  13          2HB       GLU  13  15.118  -2.959  -1.202
  104   1HG   GLU  13          1HG       GLU  13  12.887  -1.944  -1.392
  105   2HG   GLU  13          2HG       GLU  13  12.140  -3.471  -0.918
  106    H    ALA  14           H        ALA  14  11.989  -3.172  -3.929
  107    HA   ALA  14           HA       ALA  14  13.316  -1.220  -5.651
  108   1HB   ALA  14          1HB       ALA  14  10.397  -1.847  -5.120
  109   2HB   ALA  14          2HB       ALA  14  10.940  -0.644  -6.290
  110   3HB   ALA  14          3HB       ALA  14  11.353  -2.345  -6.515
  111    H    VAL  15           H        VAL  15  11.400   0.904  -5.493
  112    HA   VAL  15           HA       VAL  15  12.386   2.225  -3.037
  113    HB   VAL  15           HB       VAL  15  10.639   3.354  -5.240
  114   1HG1  VAL  15          1HG1      VAL  15  12.344   4.568  -3.049
  115   2HG1  VAL  15          2HG1      VAL  15  11.719   5.498  -4.411
  116   3HG1  VAL  15          3HG1      VAL  15  10.604   4.740  -3.275
  117   1HG2  VAL  15          1HG2      VAL  15  13.659   3.251  -4.961
  118   2HG2  VAL  15          2HG2      VAL  15  12.691   2.532  -6.248
  119   3HG2  VAL  15          3HG2      VAL  15  12.811   4.285  -6.111
  120    H    ASP  16           H        ASP  16  11.187   1.872  -1.232
  121    HA   ASP  16           HA       ASP  16   8.269   1.377  -1.457
  122   1HB   ASP  16          1HB       ASP  16   9.740  -0.060  -0.011
  123   2HB   ASP  16          2HB       ASP  16  10.038   1.351   1.004
  124    H    ALA  17           H        ALA  17  10.293   4.014  -1.094
  125    HA   ALA  17           HA       ALA  17   9.005   5.527   0.947
  126   1HB   ALA  17          1HB       ALA  17  11.174   6.164  -0.027
  127   2HB   ALA  17          2HB       ALA  17  10.387   6.502  -1.569
  128   3HB   ALA  17          3HB       ALA  17  10.019   7.490  -0.155
  129    H    ASN  18           H        ASN  18   8.507   5.687  -2.609
  130    HA   ASN  18           HA       ASN  18   5.932   7.117  -2.115
  131   1HB   ASN  18          1HB       ASN  18   7.650   8.044  -3.718
  132   2HB   ASN  18          2HB       ASN  18   7.340   6.648  -4.751
  133   2HD2  ASN  18          2HD2      ASN  18   5.848   7.126  -6.359
  134   1HD2  ASN  18          1HD2      ASN  18   4.541   8.196  -6.197
  135    H    SER  19           H        SER  19   7.169   4.042  -3.223
  136    HA   SER  19           HA       SER  19   4.861   3.265  -4.749
  137   1HB   SER  19          1HB       SER  19   7.078   2.114  -4.854
  138   2HB   SER  19          2HB       SER  19   6.776   1.466  -3.245
  139    HG   SER  19           HG       SER  19   4.631   0.887  -4.488
  140    H    LEU  20           H        LEU  20   5.727   2.761  -1.318
  141    HA   LEU  20           HA       LEU  20   3.491   1.135  -0.661
  142   1HB   LEU  20          1HB       LEU  20   5.413   1.461   0.858
  143   2HB   LEU  20          2HB       LEU  20   4.947   3.144   1.089
  144    HG   LEU  20           HG       LEU  20   2.785   2.407   2.059
  145   1HD1  LEU  20          1HD1      LEU  20   3.901  -0.300   1.345
  146   2HD1  LEU  20          2HD1      LEU  20   2.818  -0.144   2.728
  147   3HD1  LEU  20          3HD1      LEU  20   2.267   0.322   1.123
  148   1HD2  LEU  20          1HD2      LEU  20   5.327   1.276   3.258
  149   2HD2  LEU  20          2HD2      LEU  20   4.560   2.822   3.625
  150   3HD2  LEU  20          3HD2      LEU  20   3.793   1.315   4.128
  151    H    ALA  21           H        ALA  21   3.869   4.684  -0.509
  152    HA   ALA  21           HA       ALA  21   1.271   5.257   0.471
  153   1HB   ALA  21          1HB       ALA  21   3.014   6.931  -1.358
  154   2HB   ALA  21          2HB       ALA  21   3.088   6.924   0.403
  155   3HB   ALA  21          3HB       ALA  21   1.647   7.528  -0.416
  156    H    GLU  22           H        GLU  22   2.456   4.935  -2.877
  157    HA   GLU  22           HA       GLU  22   0.009   5.687  -4.144
  158   1HB   GLU  22          1HB       GLU  22   2.244   5.412  -5.290
  159   2HB   GLU  22          2HB       GLU  22   2.016   3.667  -5.176
  160   1HG   GLU  22          1HG       GLU  22   1.258   4.366  -7.362
  161   2HG   GLU  22          2HG       GLU  22  -0.161   3.943  -6.407
  162    H    ALA  23           H        ALA  23   1.197   2.547  -2.981
  163    HA   ALA  23           HA       ALA  23  -0.901   0.954  -4.048
  164   1HB   ALA  23          1HB       ALA  23   0.446   0.494  -1.375
  165   2HB   ALA  23          2HB       ALA  23   1.232   0.144  -2.913
  166   3HB   ALA  23          3HB       ALA  23  -0.238  -0.718  -2.457
  167    H    LYS  24           H        LYS  24  -0.654   2.657  -0.911
  168    HA   LYS  24           HA       LYS  24  -3.275   1.825  -0.029
  169   1HB   LYS  24          1HB       LYS  24  -1.477   4.114   0.804
  170   2HB   LYS  24          2HB       LYS  24  -3.008   3.749   1.600
  171   1HG   LYS  24          1HG       LYS  24  -2.193   1.448   2.065
  172   2HG   LYS  24          2HG       LYS  24  -0.641   1.869   1.341
  173   1HD   LYS  24          1HD       LYS  24  -1.875   3.322   3.696
  174   2HD   LYS  24          2HD       LYS  24  -0.657   2.059   3.847
  175   1HE   LYS  24          1HE       LYS  24   0.684   3.965   3.873
  176   2HE   LYS  24          2HE       LYS  24   0.688   3.601   2.148
  177   1HZ   LYS  24          1HZ       LYS  24  -1.583   5.130   2.713
  178   2HZ   LYS  24          2HZ       LYS  24  -0.256   5.899   3.444
  179   3HZ   LYS  24          3HZ       LYS  24  -0.235   5.563   1.778
  180    H    VAL  25           H        VAL  25  -2.054   4.712  -1.742
  181    HA   VAL  25           HA       VAL  25  -4.509   6.170  -1.717
  182    HB   VAL  25           HB       VAL  25  -2.215   6.172  -3.691
  183   1HG1  VAL  25          1HG1      VAL  25  -4.681   7.921  -3.550
  184   2HG1  VAL  25          2HG1      VAL  25  -3.214   8.399  -4.404
  185   3HG1  VAL  25          3HG1      VAL  25  -4.114   6.975  -4.926
  186   1HG2  VAL  25          1HG2      VAL  25  -1.894   6.975  -1.291
  187   2HG2  VAL  25          2HG2      VAL  25  -1.514   8.155  -2.546
  188   3HG2  VAL  25          3HG2      VAL  25  -3.038   8.262  -1.665
  189    H    LEU  26           H        LEU  26  -3.166   3.901  -4.110
  190    HA   LEU  26           HA       LEU  26  -5.357   4.011  -5.928
  191   1HB   LEU  26          1HB       LEU  26  -3.343   1.830  -5.325
  192   2HB   LEU  26          2HB       LEU  26  -4.507   1.724  -6.647
  193    HG   LEU  26           HG       LEU  26  -2.530   3.996  -6.286
  194   1HD1  LEU  26          1HD1      LEU  26  -2.416   1.566  -8.098
  195   2HD1  LEU  26          2HD1      LEU  26  -1.302   2.930  -8.166
  196   3HD1  LEU  26          3HD1      LEU  26  -1.349   1.900  -6.735
  197   1HD2  LEU  26          1HD2      LEU  26  -4.677   3.359  -8.289
  198   2HD2  LEU  26          2HD2      LEU  26  -4.144   4.920  -7.671
  199   3HD2  LEU  26          3HD2      LEU  26  -3.192   4.088  -8.895
  200    H    ALA  27           H        ALA  27  -4.781   1.982  -3.078
  201    HA   ALA  27           HA       ALA  27  -7.238   0.468  -3.459
  202   1HB   ALA  27          1HB       ALA  27  -5.248   0.743  -1.205
  203   2HB   ALA  27          2HB       ALA  27  -5.570  -0.664  -2.218
  204   3HB   ALA  27          3HB       ALA  27  -6.743  -0.171  -0.998
  205    H    ASN  28           H        ASN  28  -6.241   3.304  -1.614
  206    HA   ASN  28           HA       ASN  28  -8.526   3.594   0.042
  207   1HB   ASN  28          1HB       ASN  28  -6.458   4.885   0.349
  208   2HB   ASN  28          2HB       ASN  28  -6.763   5.744  -1.160
  209   2HD2  ASN  28          2HD2      ASN  28  -7.891   5.344   2.179
  210   1HD2  ASN  28          1HD2      ASN  28  -8.866   6.732   2.199
  211    H    ARG  29           H        ARG  29  -7.932   4.942  -3.234
  212    HA   ARG  29           HA       ARG  29 -10.397   6.385  -3.350
  213   1HB   ARG  29          1HB       ARG  29 -10.048   6.403  -5.812
  214   2HB   ARG  29          2HB       ARG  29  -8.597   6.862  -4.923
  215   1HG   ARG  29          1HG       ARG  29  -7.729   4.579  -5.143
  216   2HG   ARG  29          2HG       ARG  29  -9.176   4.101  -6.032
  217   1HD   ARG  29          1HD       ARG  29  -8.615   5.929  -7.701
  218   2HD   ARG  29          2HD       ARG  29  -7.068   6.108  -6.875
  219    HE   ARG  29           HE       ARG  29  -7.221   3.394  -7.446
  220   1HH1  ARG  29          1HH1      ARG  29  -6.434   2.509  -9.375
  221   2HH1  ARG  29          2HH1      ARG  29  -6.285   3.518 -10.775
  222   1HH2  ARG  29          1HH2      ARG  29  -7.482   6.358  -9.185
  223   2HH2  ARG  29          2HH2      ARG  29  -6.879   5.696 -10.668
  224    H    GLU  30           H        GLU  30  -9.638   3.005  -4.088
  225    HA   GLU  30           HA       GLU  30 -12.046   2.376  -5.478
  226   1HB   GLU  30          1HB       GLU  30 -10.223   0.726  -3.722
  227   2HB   GLU  30          2HB       GLU  30 -11.641   0.029  -4.502
  228   1HG   GLU  30          1HG       GLU  30 -10.797   0.755  -6.699
  229   2HG   GLU  30          2HG       GLU  30  -9.371   1.448  -5.924
  230    H    LEU  31           H        LEU  31 -11.329   2.482  -2.008
  231    HA   LEU  31           HA       LEU  31 -13.902   1.483  -1.154
  232   1HB   LEU  31          1HB       LEU  31 -12.114   3.394   0.378
  233   2HB   LEU  31          2HB       LEU  31 -13.242   2.211   1.040
  234    HG   LEU  31           HG       LEU  31 -10.745   1.588  -0.542
  235   1HD1  LEU  31          1HD1      LEU  31 -11.432   1.468   2.397
  236   2HD1  LEU  31          2HD1      LEU  31 -10.126   0.500   1.712
  237   3HD1  LEU  31          3HD1      LEU  31 -10.059   2.260   1.621
  238   1HD2  LEU  31          1HD2      LEU  31 -12.964  -0.124   0.596
  239   2HD2  LEU  31          2HD2      LEU  31 -12.262  -0.168  -1.022
  240   3HD2  LEU  31          3HD2      LEU  31 -11.348  -0.786   0.352
  241    H    ASP  32           H        ASP  32 -12.534   4.663  -1.744
  242    HA   ASP  32           HA       ASP  32 -14.691   6.261  -0.836
  243   1HB   ASP  32          1HB       ASP  32 -12.453   7.121  -1.406
  244   2HB   ASP  32          2HB       ASP  32 -12.740   6.745  -3.103
  245    H    LYS  33           H        LYS  33 -14.023   4.919  -4.088
  246    HA   LYS  33           HA       LYS  33 -16.390   6.023  -5.295
  247   1HB   LYS  33          1HB       LYS  33 -14.641   3.668  -6.041
  248   2HB   LYS  33          2HB       LYS  33 -15.973   4.237  -7.047
  249   1HG   LYS  33          1HG       LYS  33 -14.908   6.513  -7.057
  250   2HG   LYS  33          2HG       LYS  33 -13.523   5.819  -6.218
  251   1HD   LYS  33          1HD       LYS  33 -14.555   4.749  -8.858
  252   2HD   LYS  33          2HD       LYS  33 -13.299   5.980  -8.752
  253   1HE   LYS  33          1HE       LYS  33 -12.040   4.343  -7.221
  254   2HE   LYS  33          2HE       LYS  33 -13.191   3.123  -7.768
  255   1HZ   LYS  33          1HZ       LYS  33 -12.077   4.669  -9.910
  256   2HZ   LYS  33          2HZ       LYS  33 -10.900   3.808  -9.039
  257   3HZ   LYS  33          3HZ       LYS  33 -12.210   2.987  -9.743
  258    H    TYR  34           H        TYR  34 -15.692   2.912  -3.734
  259    HA   TYR  34           HA       TYR  34 -18.248   1.710  -4.310
  260   1HB   TYR  34          1HB       TYR  34 -16.452   1.162  -1.934
  261   2HB   TYR  34          2HB       TYR  34 -17.660   0.082  -2.613
  262    HD1  TYR  34           HD1      TYR  34 -16.451   1.297  -5.587
  263    HD2  TYR  34           HD2      TYR  34 -15.024  -0.948  -2.194
  264    HE1  TYR  34           HE1      TYR  34 -14.718   0.265  -6.991
  265    HE2  TYR  34           HE2      TYR  34 -13.286  -1.973  -3.625
  266    HH   TYR  34           HH       TYR  34 -13.289  -2.291  -6.582
  267    H    GLY  35           H        GLY  35 -17.039   3.667  -1.599
  268   1HA   GLY  35          1HA       GLY  35 -19.831   4.365  -0.926
  269   2HA   GLY  35          2HA       GLY  35 -18.384   5.121  -0.263
  270    H    VAL  36           H        VAL  36 -17.179   2.465   0.398
  271    HA   VAL  36           HA       VAL  36 -18.963   1.094   2.206
  272    HB   VAL  36           HB       VAL  36 -16.896   0.006   3.034
  273   1HG1  VAL  36          1HG1      VAL  36 -17.314   0.297   0.059
  274   2HG1  VAL  36          2HG1      VAL  36 -16.105  -0.807   0.716
  275   3HG1  VAL  36          3HG1      VAL  36 -17.810  -1.029   1.109
  276   1HG2  VAL  36          1HG2      VAL  36 -15.561   2.031   1.218
  277   2HG2  VAL  36          2HG2      VAL  36 -15.384   1.911   2.968
  278   3HG2  VAL  36          3HG2      VAL  36 -14.740   0.642   1.927
  279    H    SER  37           H        SER  37 -17.717   0.885   4.619
  280    HA   SER  37           HA       SER  37 -18.406   3.384   5.894
  281   1HB   SER  37          1HB       SER  37 -17.914   2.292   7.939
  282   2HB   SER  37          2HB       SER  37 -18.506   1.007   6.890
  283    HG   SER  37           HG       SER  37 -16.273   0.998   8.154
  284    H    ASP  38           H        ASP  38 -16.964   4.810   7.037
  285    HA   ASP  38           HA       ASP  38 -14.506   5.366   5.626
  286   1HB   ASP  38          1HB       ASP  38 -15.967   7.074   6.793
  287   2HB   ASP  38          2HB       ASP  38 -15.343   6.453   8.323
  288    H    TYR  39           H        TYR  39 -15.306   3.388   8.345
  289    HA   TYR  39           HA       TYR  39 -12.840   3.418   9.757
  290   1HB   TYR  39          1HB       TYR  39 -14.793   2.333  10.699
  291   2HB   TYR  39          2HB       TYR  39 -14.856   1.189   9.357
  292    HD1  TYR  39           HD1      TYR  39 -13.251  -0.613   9.153
  293    HD2  TYR  39           HD2      TYR  39 -13.061   2.148  12.435
  294    HE1  TYR  39           HE1      TYR  39 -11.684  -2.122  10.324
  295    HE2  TYR  39           HE2      TYR  39 -11.490   0.633  13.615
  296    HH   TYR  39           HH       TYR  39 -10.949  -2.580  12.635
  297    H    TYR  40           H        TYR  40 -13.883   1.390   7.021
  298    HA   TYR  40           HA       TYR  40 -11.586  -0.260   6.886
  299   1HB   TYR  40          1HB       TYR  40 -13.537   0.660   4.768
  300   2HB   TYR  40          2HB       TYR  40 -12.238  -0.482   4.423
  301    HD1  TYR  40           HD1      TYR  40 -12.024  -2.468   6.205
  302    HD2  TYR  40           HD2      TYR  40 -15.603  -0.222   5.430
  303    HE1  TYR  40           HE1      TYR  40 -13.388  -4.320   7.132
  304    HE2  TYR  40           HE2      TYR  40 -16.967  -2.073   6.358
  305    HH   TYR  40           HH       TYR  40 -16.856  -4.370   6.841
  306    H    LYS  41           H        LYS  41 -12.132   2.964   5.385
  307    HA   LYS  41           HA       LYS  41  -9.728   2.880   3.839
  308   1HB   LYS  41          1HB       LYS  41 -10.209   5.062   3.238
  309   2HB   LYS  41          2HB       LYS  41 -11.788   4.602   3.861
  310   1HG   LYS  41          1HG       LYS  41 -10.980   5.525   6.121
  311   2HG   LYS  41          2HG       LYS  41  -9.647   6.242   5.227
  312   1HD   LYS  41          1HD       LYS  41 -12.606   6.736   4.793
  313   2HD   LYS  41          2HD       LYS  41 -11.420   7.888   5.406
  314   1HE   LYS  41          1HE       LYS  41 -11.617   8.476   3.135
  315   2HE   LYS  41          2HE       LYS  41 -10.174   7.465   3.163
  316   1HZ   LYS  41          1HZ       LYS  41 -12.593   5.961   2.847
  317   2HZ   LYS  41          2HZ       LYS  41 -12.354   7.076   1.592
  318   3HZ   LYS  41          3HZ       LYS  41 -11.162   5.916   1.934
  319    H    ASN  42           H        ASN  42 -10.414   3.932   7.138
  320    HA   ASN  42           HA       ASN  42  -7.822   4.955   7.713
  321   1HB   ASN  42          1HB       ASN  42  -9.923   3.705   9.502
  322   2HB   ASN  42          2HB       ASN  42  -8.438   4.431  10.119
  323   2HD2  ASN  42          2HD2      ASN  42 -11.061   5.495  10.729
  324   1HD2  ASN  42          1HD2      ASN  42 -11.174   7.031  10.018
  325    H    LEU  43           H        LEU  43  -9.191   1.706   7.832
  326    HA   LEU  43           HA       LEU  43  -7.018   0.400   9.112
  327   1HB   LEU  43          1HB       LEU  43  -9.202  -0.690   8.713
  328   2HB   LEU  43          2HB       LEU  43  -8.893  -0.677   6.978
  329    HG   LEU  43           HG       LEU  43  -6.912  -2.115   7.315
  330   1HD1  LEU  43          1HD1      LEU  43  -7.652  -1.729  10.210
  331   2HD1  LEU  43          2HD1      LEU  43  -6.857  -3.221   9.709
  332   3HD1  LEU  43          3HD1      LEU  43  -6.062  -1.671   9.450
  333   1HD2  LEU  43          1HD2      LEU  43  -9.255  -3.042   6.997
  334   2HD2  LEU  43          2HD2      LEU  43  -8.114  -4.146   7.765
  335   3HD2  LEU  43          3HD2      LEU  43  -9.309  -3.293   8.741
  336    H    ILE  44           H        ILE  44  -7.575   1.209   5.692
  337    HA   ILE  44           HA       ILE  44  -5.333  -0.186   4.610
  338    HB   ILE  44           HB       ILE  44  -6.472   2.487   3.713
  339   1HG1  ILE  44          1HG1      ILE  44  -8.293   0.909   3.758
  340   2HG1  ILE  44          2HG1      ILE  44  -7.775   1.055   2.082
  341   1HG2  ILE  44          1HG2      ILE  44  -4.751   0.399   2.371
  342   2HG2  ILE  44          2HG2      ILE  44  -5.637   1.624   1.462
  343   3HG2  ILE  44          3HG2      ILE  44  -4.394   2.107   2.616
  344   1HD1  ILE  44          1HD1      ILE  44  -6.253  -0.995   2.626
  345   2HD1  ILE  44          2HD1      ILE  44  -7.337  -1.214   4.002
  346   3HD1  ILE  44          3HD1      ILE  44  -7.975  -1.262   2.359
  347    H    ASN  45           H        ASN  45  -5.652   3.030   6.045
  348    HA   ASN  45           HA       ASN  45  -3.091   4.066   5.530
  349   1HB   ASN  45          1HB       ASN  45  -5.024   5.248   6.661
  350   2HB   ASN  45          2HB       ASN  45  -4.595   4.380   8.137
  351   2HD2  ASN  45          2HD2      ASN  45  -4.195   6.715   8.927
  352   1HD2  ASN  45          1HD2      ASN  45  -2.661   7.382   8.638
  353    H    ASN  46           H        ASN  46  -4.090   1.608   7.844
  354    HA   ASN  46           HA       ASN  46  -1.444   1.623   9.167
  355   1HB   ASN  46          1HB       ASN  46  -3.573   1.275  10.451
  356   2HB   ASN  46          2HB       ASN  46  -3.775  -0.259   9.604
  357   2HD2  ASN  46          2HD2      ASN  46  -1.769   1.449  11.985
  358   1HD2  ASN  46          1HD2      ASN  46  -0.964   0.068  12.553
  359    H    ALA  47           H        ALA  47  -2.249   0.545   6.253
  360    HA   ALA  47           HA       ALA  47  -1.689  -2.237   6.212
  361   1HB   ALA  47          1HB       ALA  47  -2.464  -0.786   4.266
  362   2HB   ALA  47          2HB       ALA  47  -1.215  -1.968   3.877
  363   3HB   ALA  47          3HB       ALA  47  -0.786  -0.271   4.095
  364    H    LYS  48           H        LYS  48   0.169  -3.359   6.620
  365    HA   LYS  48           HA       LYS  48   2.658  -1.815   7.135
  366   1HB   LYS  48          1HB       LYS  48   3.450  -3.924   8.168
  367   2HB   LYS  48          2HB       LYS  48   1.928  -3.378   8.872
  368   1HG   LYS  48          1HG       LYS  48   0.694  -4.939   7.405
  369   2HG   LYS  48          2HG       LYS  48   2.219  -5.496   6.717
  370   1HD   LYS  48          1HD       LYS  48   2.952  -6.171   9.014
  371   2HD   LYS  48          2HD       LYS  48   1.349  -5.741   9.609
  372   1HE   LYS  48          1HE       LYS  48   1.343  -8.115   9.184
  373   2HE   LYS  48          2HE       LYS  48   0.385  -7.351   7.917
  374   1HZ   LYS  48          1HZ       LYS  48   3.269  -7.922   7.589
  375   2HZ   LYS  48          2HZ       LYS  48   2.074  -9.055   7.183
  376   3HZ   LYS  48          3HZ       LYS  48   2.127  -7.555   6.386
  377    H    THR  49           H        THR  49   1.334  -4.123   4.854
  378    HA   THR  49           HA       THR  49   3.908  -4.005   3.328
  379    HB   THR  49           HB       THR  49   3.460  -6.431   2.689
  380    HG1  THR  49           HG1      THR  49   2.142  -6.856   5.041
  381   1HG2  THR  49          1HG2      THR  49   4.222  -5.577   5.481
  382   2HG2  THR  49          2HG2      THR  49   4.303  -7.266   4.980
  383   3HG2  THR  49          3HG2      THR  49   5.278  -6.052   4.151
  384    H    VAL  50           H        VAL  50   3.640  -4.124   1.050
  385    HA   VAL  50           HA       VAL  50   1.179  -2.990   0.069
  386    HB   VAL  50           HB       VAL  50   2.209  -3.202  -2.153
  387   1HG1  VAL  50          1HG1      VAL  50   4.086  -2.341   0.066
  388   2HG1  VAL  50          2HG1      VAL  50   4.338  -1.970  -1.641
  389   3HG1  VAL  50          3HG1      VAL  50   2.929  -1.328  -0.796
  390   1HG2  VAL  50          1HG2      VAL  50   4.201  -4.913  -0.644
  391   2HG2  VAL  50          2HG2      VAL  50   3.209  -5.383  -2.024
  392   3HG2  VAL  50          3HG2      VAL  50   4.530  -4.234  -2.238
  393    H    GLU  51           H        GLU  51   2.488  -6.274   0.111
  394    HA   GLU  51           HA       GLU  51   0.671  -7.430  -1.743
  395   1HB   GLU  51          1HB       GLU  51   2.048  -8.602   0.685
  396   2HB   GLU  51          2HB       GLU  51   1.104  -9.568  -0.453
  397   1HG   GLU  51          1HG       GLU  51   2.554  -8.817  -2.301
  398   2HG   GLU  51          2HG       GLU  51   3.504  -7.854  -1.169
  399    H    GLY  52           H        GLY  52   0.378  -6.807   1.725
  400   1HA   GLY  52          1HA       GLY  52  -1.492  -6.945   3.138
  401   2HA   GLY  52          2HA       GLY  52  -2.189  -8.093   1.997
  402    H    VAL  53           H        VAL  53  -1.198  -4.898   0.897
  403    HA   VAL  53           HA       VAL  53  -3.634  -3.504   1.369
  404    HB   VAL  53           HB       VAL  53  -1.597  -3.179  -0.854
  405   1HG1  VAL  53          1HG1      VAL  53  -4.012  -1.520  -0.093
  406   2HG1  VAL  53          2HG1      VAL  53  -2.643  -0.836  -0.972
  407   3HG1  VAL  53          3HG1      VAL  53  -3.582  -2.146  -1.685
  408   1HG2  VAL  53          1HG2      VAL  53  -0.854  -2.810   1.517
  409   2HG2  VAL  53          2HG2      VAL  53  -0.769  -1.354   0.526
  410   3HG2  VAL  53          3HG2      VAL  53  -2.097  -1.569   1.666
  411    H    LYS  54           H        LYS  54  -2.614  -5.290  -1.582
  412    HA   LYS  54           HA       LYS  54  -5.204  -4.902  -2.819
  413   1HB   LYS  54          1HB       LYS  54  -4.405  -6.405  -4.560
  414   2HB   LYS  54          2HB       LYS  54  -3.146  -5.246  -4.146
  415   1HG   LYS  54          1HG       LYS  54  -2.070  -6.948  -2.693
  416   2HG   LYS  54          2HG       LYS  54  -3.318  -8.109  -3.151
  417   1HD   LYS  54          1HD       LYS  54  -2.678  -7.853  -5.529
  418   2HD   LYS  54          2HD       LYS  54  -1.396  -6.741  -5.055
  419   1HE   LYS  54          1HE       LYS  54  -1.495  -9.477  -3.804
  420   2HE   LYS  54          2HE       LYS  54  -0.845  -9.293  -5.431
  421   1HZ   LYS  54          1HZ       LYS  54   0.097  -7.374  -3.469
  422   2HZ   LYS  54          2HZ       LYS  54   0.606  -8.975  -3.232
  423   3HZ   LYS  54          3HZ       LYS  54   0.946  -8.186  -4.698
  424    H    ALA  55           H        ALA  55  -3.747  -7.575  -0.981
  425    HA   ALA  55           HA       ALA  55  -5.906  -9.415  -1.509
  426   1HB   ALA  55          1HB       ALA  55  -4.981 -10.680   0.434
  427   2HB   ALA  55          2HB       ALA  55  -3.894  -9.329   0.757
  428   3HB   ALA  55          3HB       ALA  55  -3.744 -10.242  -0.745
  429    H    LEU  56           H        LEU  56  -5.455  -6.848   0.795
  430    HA   LEU  56           HA       LEU  56  -7.452  -7.670   2.684
  431   1HB   LEU  56          1HB       LEU  56  -5.729  -6.001   3.220
  432   2HB   LEU  56          2HB       LEU  56  -6.399  -4.908   2.012
  433    HG   LEU  56           HG       LEU  56  -8.519  -4.801   3.274
  434   1HD1  LEU  56          1HD1      LEU  56  -7.103  -6.831   4.994
  435   2HD1  LEU  56          2HD1      LEU  56  -8.301  -5.759   5.716
  436   3HD1  LEU  56          3HD1      LEU  56  -8.765  -6.839   4.404
  437   1HD2  LEU  56          1HD2      LEU  56  -6.434  -3.334   3.760
  438   2HD2  LEU  56          2HD2      LEU  56  -7.722  -3.348   4.965
  439   3HD2  LEU  56          3HD2      LEU  56  -6.263  -4.305   5.221
  440    H    ILE  57           H        ILE  57  -7.552  -5.594  -0.201
  441    HA   ILE  57           HA       ILE  57 -10.291  -4.792   0.078
  442    HB   ILE  57           HB       ILE  57  -8.806  -5.274  -2.522
  443   1HG1  ILE  57          1HG1      ILE  57  -7.392  -3.854  -1.170
  444   2HG1  ILE  57          2HG1      ILE  57  -8.216  -2.818  -2.329
  445   1HG2  ILE  57          1HG2      ILE  57 -11.283  -4.822  -2.583
  446   2HG2  ILE  57          2HG2      ILE  57 -10.956  -3.254  -1.850
  447   3HG2  ILE  57          3HG2      ILE  57 -10.307  -3.638  -3.444
  448   1HD1  ILE  57          1HD1      ILE  57  -9.991  -2.508  -0.451
  449   2HD1  ILE  57          2HD1      ILE  57  -8.740  -3.129   0.623
  450   3HD1  ILE  57          3HD1      ILE  57  -8.458  -1.652  -0.298
  451    H    ASP  58           H        ASP  58  -8.708  -7.611  -1.348
  452    HA   ASP  58           HA       ASP  58 -10.993  -8.736  -2.628
  453   1HB   ASP  58          1HB       ASP  58  -8.689  -9.577  -2.963
  454   2HB   ASP  58          2HB       ASP  58  -8.676 -10.183  -1.307
  455    H    GLU  59           H        GLU  59  -9.835  -8.998   0.720
  456    HA   GLU  59           HA       GLU  59 -11.861 -10.891   1.527
  457   1HB   GLU  59          1HB       GLU  59 -10.121  -8.966   3.096
  458   2HB   GLU  59          2HB       GLU  59 -11.225 -10.113   3.855
  459   1HG   GLU  59          1HG       GLU  59  -9.061 -10.929   1.899
  460   2HG   GLU  59          2HG       GLU  59  -8.844 -10.938   3.649
  461    H    ILE  60           H        ILE  60 -11.559  -7.366   1.580
  462    HA   ILE  60           HA       ILE  60 -13.997  -6.880   2.996
  463    HB   ILE  60           HB       ILE  60 -12.460  -5.126   1.064
  464   1HG1  ILE  60          1HG1      ILE  60 -12.538  -5.097   4.096
  465   2HG1  ILE  60          2HG1      ILE  60 -11.298  -5.940   3.172
  466   1HG2  ILE  60          1HG2      ILE  60 -14.749  -4.553   2.963
  467   2HG2  ILE  60          2HG2      ILE  60 -13.692  -3.289   2.333
  468   3HG2  ILE  60          3HG2      ILE  60 -14.683  -4.241   1.228
  469   1HD1  ILE  60          1HD1      ILE  60 -11.891  -3.017   2.694
  470   2HD1  ILE  60          2HD1      ILE  60 -10.763  -3.536   3.945
  471   3HD1  ILE  60          3HD1      ILE  60 -10.447  -3.929   2.256
  472    H    LEU  61           H        LEU  61 -13.267  -6.943  -0.507
  473    HA   LEU  61           HA       LEU  61 -15.982  -6.324  -1.278
  474   1HB   LEU  61          1HB       LEU  61 -13.671  -7.568  -2.789
  475   2HB   LEU  61          2HB       LEU  61 -15.229  -7.219  -3.539
  476    HG   LEU  61           HG       LEU  61 -13.533  -5.150  -2.109
  477   1HD1  LEU  61          1HD1      LEU  61 -12.433  -6.124  -4.152
  478   2HD1  LEU  61          2HD1      LEU  61 -13.831  -5.605  -5.093
  479   3HD1  LEU  61          3HD1      LEU  61 -12.806  -4.407  -4.305
  480   1HD2  LEU  61          1HD2      LEU  61 -16.128  -5.087  -3.640
  481   2HD2  LEU  61          2HD2      LEU  61 -15.678  -4.228  -2.168
  482   3HD2  LEU  61          3HD2      LEU  61 -15.062  -3.686  -3.724
  483    H    ALA  62           H        ALA  62 -14.239  -9.348  -0.714
  484    HA   ALA  62           HA       ALA  62 -16.385 -11.021  -1.730
  485   1HB   ALA  62          1HB       ALA  62 -14.055 -11.834  -1.583
  486   2HB   ALA  62          2HB       ALA  62 -14.118 -11.688   0.173
  487   3HB   ALA  62          3HB       ALA  62 -15.143 -12.862  -0.651
  488    H    ALA  63           H        ALA  63 -15.962  -9.203   1.115
  489    HA   ALA  63           HA       ALA  63 -17.607 -10.954   2.819
  490   1HB   ALA  63          1HB       ALA  63 -17.294  -9.203   4.514
  491   2HB   ALA  63          2HB       ALA  63 -15.748  -9.643   3.788
  492   3HB   ALA  63          3HB       ALA  63 -16.556  -8.152   3.304
  493    H    LEU  64           H        LEU  64 -18.418  -9.029   0.296
  494    HA   LEU  64           HA       LEU  64 -21.105  -8.510   1.453
  495   1HB   LEU  64          1HB       LEU  64 -21.112  -6.202   0.472
  496   2HB   LEU  64          2HB       LEU  64 -19.949  -6.402   1.774
  497    HG   LEU  64           HG       LEU  64 -18.365  -7.060  -0.362
  498   1HD1  LEU  64          1HD1      LEU  64 -20.354  -5.005  -1.377
  499   2HD1  LEU  64          2HD1      LEU  64 -18.811  -5.370  -2.147
  500   3HD1  LEU  64          3HD1      LEU  64 -20.062  -6.605  -2.056
  501   1HD2  LEU  64          1HD2      LEU  64 -18.964  -4.299   0.737
  502   2HD2  LEU  64          2HD2      LEU  64 -17.727  -5.423   1.302
  503   3HD2  LEU  64          3HD2      LEU  64 -17.575  -4.668  -0.286
  504    HA   PRO  65           HA       PRO  65 -22.323 -10.124  -2.520
  505   1HB   PRO  65          1HB       PRO  65 -24.664  -8.576  -2.906
  506   2HB   PRO  65          2HB       PRO  65 -24.562 -10.127  -2.065
  507   1HG   PRO  65          1HG       PRO  65 -24.820  -7.399  -0.936
  508   2HG   PRO  65          2HG       PRO  65 -25.269  -8.955  -0.224
  509   1HD   PRO  65          1HD       PRO  65 -23.045  -7.441   0.533
  510   2HD   PRO  65          2HD       PRO  65 -23.232  -9.185   0.834

  No H/Q in entry =         510
  Start of MODEL   26
    1    H1   MET   1           H1       MET   1  32.302  -0.562 -18.409
    2    H2   MET   1           H2       MET   1  32.929  -0.565 -19.989
    3    H3   MET   1           H3       MET   1  33.878  -0.003 -18.697
    4    HA   MET   1           HA       MET   1  33.091   2.034 -18.887
    5   1HB   MET   1          1HB       MET   1  33.080   1.191 -21.327
    6   2HB   MET   1          2HB       MET   1  31.331   1.064 -21.148
    7   1HG   MET   1          1HG       MET   1  32.803   3.626 -20.496
    8   2HG   MET   1          2HG       MET   1  32.251   3.262 -22.127
    9   1HE   MET   1          1HE       MET   1  29.740   2.214 -22.457
   10   2HE   MET   1          2HE       MET   1  28.577   3.518 -22.181
   11   3HE   MET   1          3HE       MET   1  30.100   3.849 -23.003
   12    H    LYS   2           H        LYS   2  30.242  -0.029 -19.613
   13    HA   LYS   2           HA       LYS   2  28.399   1.794 -18.353
   14   1HB   LYS   2          1HB       LYS   2  27.793   0.067 -20.079
   15   2HB   LYS   2          2HB       LYS   2  28.013  -1.172 -18.845
   16   1HG   LYS   2          1HG       LYS   2  26.320   0.050 -17.428
   17   2HG   LYS   2          2HG       LYS   2  26.014   1.107 -18.805
   18   1HD   LYS   2          1HD       LYS   2  25.738  -1.914 -18.870
   19   2HD   LYS   2          2HD       LYS   2  24.392  -0.798 -18.651
   20   1HE   LYS   2          1HE       LYS   2  25.227   0.303 -20.856
   21   2HE   LYS   2          2HE       LYS   2  26.125  -1.197 -21.088
   22   1HZ   LYS   2          1HZ       LYS   2  23.989  -2.388 -20.739
   23   2HZ   LYS   2          2HZ       LYS   2  23.194  -0.890 -20.771
   24   3HZ   LYS   2          3HZ       LYS   2  24.033  -1.435 -22.145
   25    H    ALA   3           H        ALA   3  27.753   1.914 -16.237
   26    HA   ALA   3           HA       ALA   3  28.256  -0.306 -14.379
   27   1HB   ALA   3          1HB       ALA   3  29.519   2.383 -13.793
   28   2HB   ALA   3          2HB       ALA   3  29.737   0.869 -12.912
   29   3HB   ALA   3          3HB       ALA   3  30.416   1.053 -14.527
   30    H    ILE   4           H        ILE   4  27.224   0.104 -12.283
   31    HA   ILE   4           HA       ILE   4  25.665   2.483 -11.805
   32    HB   ILE   4           HB       ILE   4  24.380   1.374 -13.690
   33   1HG1  ILE   4          1HG1      ILE   4  22.154   1.378 -12.420
   34   2HG1  ILE   4          2HG1      ILE   4  23.091   1.677 -10.961
   35   1HG2  ILE   4          1HG2      ILE   4  24.952  -0.959 -12.788
   36   2HG2  ILE   4          2HG2      ILE   4  23.660  -0.704 -11.617
   37   3HG2  ILE   4          3HG2      ILE   4  23.296  -0.711 -13.343
   38   1HD1  ILE   4          1HD1      ILE   4  23.410   3.446 -13.388
   39   2HD1  ILE   4          2HD1      ILE   4  22.114   3.721 -12.228
   40   3HD1  ILE   4          3HD1      ILE   4  23.793   3.808 -11.707
   41    H    PHE   5           H        PHE   5  26.518  -0.810 -11.135
   42    HA   PHE   5           HA       PHE   5  25.111  -1.010  -8.602
   43   1HB   PHE   5          1HB       PHE   5  26.506  -3.038  -8.279
   44   2HB   PHE   5          2HB       PHE   5  25.718  -3.024  -9.856
   45    HD1  PHE   5           HD1      PHE   5  26.992  -2.673 -11.909
   46    HD2  PHE   5           HD2      PHE   5  28.923  -2.638  -8.070
   47    HE1  PHE   5           HE1      PHE   5  29.204  -2.840 -13.019
   48    HE2  PHE   5           HE2      PHE   5  31.134  -2.805  -9.182
   49    HZ   PHE   5           HZ       PHE   5  31.274  -2.907 -11.655
   50    H    VAL   6           H        VAL   6  27.937   0.600  -9.597
   51    HA   VAL   6           HA       VAL   6  29.583   0.335  -7.281
   52    HB   VAL   6           HB       VAL   6  29.236   2.606  -9.261
   53   1HG1  VAL   6          1HG1      VAL   6  31.302   2.223  -7.070
   54   2HG1  VAL   6          2HG1      VAL   6  31.476   3.364  -8.403
   55   3HG1  VAL   6          3HG1      VAL   6  30.171   3.567  -7.238
   56   1HG2  VAL   6          1HG2      VAL   6  30.100   0.341 -10.023
   57   2HG2  VAL   6          2HG2      VAL   6  31.201   1.692 -10.304
   58   3HG2  VAL   6          3HG2      VAL   6  31.477   0.593  -8.952
   59    H    LEU   7           H        LEU   7  26.899   2.510  -8.052
   60    HA   LEU   7           HA       LEU   7  26.884   3.465  -5.201
   61   1HB   LEU   7          1HB       LEU   7  25.745   4.806  -7.674
   62   2HB   LEU   7          2HB       LEU   7  25.761   5.470  -6.041
   63    HG   LEU   7           HG       LEU   7  28.215   4.784  -7.686
   64   1HD1  LEU   7          1HD1      LEU   7  26.924   7.425  -6.941
   65   2HD1  LEU   7          2HD1      LEU   7  28.525   7.277  -7.664
   66   3HD1  LEU   7          3HD1      LEU   7  27.100   6.755  -8.563
   67   1HD2  LEU   7          1HD2      LEU   7  27.805   5.768  -4.861
   68   2HD2  LEU   7          2HD2      LEU   7  28.912   4.529  -5.454
   69   3HD2  LEU   7          3HD2      LEU   7  29.257   6.230  -5.749
   70    H    ASN   8           H        ASN   8  24.885   3.438  -4.119
   71    HA   ASN   8           HA       ASN   8  22.592   2.120  -5.533
   72   1HB   ASN   8          1HB       ASN   8  22.133   0.836  -3.482
   73   2HB   ASN   8          2HB       ASN   8  23.734   0.455  -4.114
   74   2HD2  ASN   8          2HD2      ASN   8  24.666  -0.100  -2.052
   75   1HD2  ASN   8          1HD2      ASN   8  24.917   1.053  -0.832
   76    H    ALA   9           H        ALA   9  20.519   2.437  -4.195
   77    HA   ALA   9           HA       ALA   9  20.065   5.223  -3.831
   78   1HB   ALA   9          1HB       ALA   9  18.410   3.054  -2.527
   79   2HB   ALA   9          2HB       ALA   9  17.874   4.626  -3.122
   80   3HB   ALA   9          3HB       ALA   9  18.342   3.365  -4.261
   81    H    GLN  10           H        GLN  10  21.422   6.201  -2.331
   82    HA   GLN  10           HA       GLN  10  21.871   5.016   0.304
   83   1HB   GLN  10          1HB       GLN  10  23.605   6.390  -0.825
   84   2HB   GLN  10          2HB       GLN  10  22.538   7.791  -0.728
   85   1HG   GLN  10          1HG       GLN  10  22.548   7.681   1.711
   86   2HG   GLN  10          2HG       GLN  10  23.516   6.207   1.666
   87   2HE2  GLN  10          2HE2      GLN  10  24.805   8.042   3.080
   88   1HE2  GLN  10          1HE2      GLN  10  26.000   8.858   2.192
   89    H    HIS  11           H        HIS  11  21.139   5.992   2.312
   90    HA   HIS  11           HA       HIS  11  18.390   6.841   2.217
   91   1HB   HIS  11          1HB       HIS  11  19.342   5.618   4.146
   92   2HB   HIS  11          2HB       HIS  11  20.375   7.002   4.506
   93    HD1  HIS  11           HD1      HIS  11  19.101   7.193   6.836
   94    HD2  HIS  11           HD2      HIS  11  16.737   7.906   3.476
   95    HE1  HIS  11           HE1      HIS  11  16.988   8.314   7.669
   96    H    ASP  12           H        ASP  12  17.664   8.849   1.764
   97    HA   ASP  12           HA       ASP  12  19.494  11.191   2.216
   98   1HB   ASP  12          1HB       ASP  12  17.345  10.709   0.136
   99   2HB   ASP  12          2HB       ASP  12  18.102  12.278   0.406
  100    H    GLU  13           H        GLU  13  16.543  12.320   1.306
  101    HA   GLU  13           HA       GLU  13  15.951  13.506   3.819
  102   1HB   GLU  13          1HB       GLU  13  15.118  14.386   1.660
  103   2HB   GLU  13          2HB       GLU  13  14.081  12.971   1.488
  104   1HG   GLU  13          1HG       GLU  13  12.886  13.588   3.560
  105   2HG   GLU  13          2HG       GLU  13  13.927  15.001   3.739
  106    H    ALA  14           H        ALA  14  14.628  10.596   2.256
  107    HA   ALA  14           HA       ALA  14  14.083   9.329   4.781
  108   1HB   ALA  14          1HB       ALA  14  11.589   9.320   4.598
  109   2HB   ALA  14          2HB       ALA  14  11.715  10.486   3.280
  110   3HB   ALA  14          3HB       ALA  14  12.242  10.930   4.902
  111    H    VAL  15           H        VAL  15  12.696   7.272   4.355
  112    HA   VAL  15           HA       VAL  15  13.807   5.919   2.055
  113    HB   VAL  15           HB       VAL  15  13.265   4.731   4.158
  114   1HG1  VAL  15          1HG1      VAL  15  11.109   6.148   4.465
  115   2HG1  VAL  15          2HG1      VAL  15  10.348   4.954   3.414
  116   3HG1  VAL  15          3HG1      VAL  15  11.059   4.454   4.948
  117   1HG2  VAL  15          1HG2      VAL  15  13.263   3.599   1.871
  118   2HG2  VAL  15          2HG2      VAL  15  12.363   2.760   3.136
  119   3HG2  VAL  15          3HG2      VAL  15  11.505   3.707   1.921
  120    H    ASP  16           H        ASP  16  12.606   5.118   0.205
  121    HA   ASP  16           HA       ASP  16  10.611   7.009  -0.742
  122   1HB   ASP  16          1HB       ASP  16  11.709   4.433  -1.898
  123   2HB   ASP  16          2HB       ASP  16  10.526   5.441  -2.732
  124    H    ALA  17           H        ALA  17   8.607   6.902   0.119
  125    HA   ALA  17           HA       ALA  17   7.342   4.210   0.534
  126   1HB   ALA  17          1HB       ALA  17   7.526   5.559   2.584
  127   2HB   ALA  17          2HB       ALA  17   6.694   6.897   1.791
  128   3HB   ALA  17          3HB       ALA  17   5.836   5.388   2.108
  129    H    ASN  18           H        ASN  18   7.524   6.420  -1.791
  130    HA   ASN  18           HA       ASN  18   4.859   7.263  -2.319
  131   1HB   ASN  18          1HB       ASN  18   7.160   6.629  -4.189
  132   2HB   ASN  18          2HB       ASN  18   5.640   7.344  -4.730
  133   2HD2  ASN  18          2HD2      ASN  18   5.089   9.143  -2.643
  134   1HD2  ASN  18          1HD2      ASN  18   6.315  10.315  -2.563
  135    H    SER  19           H        SER  19   6.574   4.265  -3.174
  136    HA   SER  19           HA       SER  19   4.536   3.144  -4.816
  137   1HB   SER  19          1HB       SER  19   6.570   1.811  -3.010
  138   2HB   SER  19          2HB       SER  19   5.551   0.939  -4.151
  139    HG   SER  19           HG       SER  19   6.872   3.140  -5.170
  140    H    LEU  20           H        LEU  20   5.015   3.066  -1.285
  141    HA   LEU  20           HA       LEU  20   2.749   1.331  -0.792
  142   1HB   LEU  20          1HB       LEU  20   4.224   3.300   0.986
  143   2HB   LEU  20          2HB       LEU  20   2.933   2.254   1.567
  144    HG   LEU  20           HG       LEU  20   5.436   1.236   0.201
  145   1HD1  LEU  20          1HD1      LEU  20   5.933   2.400   2.349
  146   2HD1  LEU  20          2HD1      LEU  20   4.801   1.321   3.164
  147   3HD1  LEU  20          3HD1      LEU  20   6.266   0.669   2.425
  148   1HD2  LEU  20          1HD2      LEU  20   3.046  -0.055   1.504
  149   2HD2  LEU  20          2HD2      LEU  20   3.890  -0.506   0.024
  150   3HD2  LEU  20          3HD2      LEU  20   4.606  -0.869   1.591
  151    H    ALA  21           H        ALA  21   3.229   4.845  -0.877
  152    HA   ALA  21           HA       ALA  21   0.648   5.595   0.016
  153   1HB   ALA  21          1HB       ALA  21   2.538   6.962  -1.916
  154   2HB   ALA  21          2HB       ALA  21   2.403   7.255  -0.182
  155   3HB   ALA  21          3HB       ALA  21   1.086   7.719  -1.261
  156    H    GLU  22           H        GLU  22   1.856   5.126  -3.325
  157    HA   GLU  22           HA       GLU  22  -0.650   5.600  -4.596
  158   1HB   GLU  22          1HB       GLU  22   1.495   5.481  -5.831
  159   2HB   GLU  22          2HB       GLU  22   1.587   3.755  -5.486
  160   1HG   GLU  22          1HG       GLU  22  -0.519   3.389  -6.712
  161   2HG   GLU  22          2HG       GLU  22  -0.622   5.115  -7.057
  162    H    ALA  23           H        ALA  23   0.812   2.574  -3.396
  163    HA   ALA  23           HA       ALA  23  -1.284   0.842  -4.244
  164   1HB   ALA  23          1HB       ALA  23   0.389   0.571  -1.726
  165   2HB   ALA  23          2HB       ALA  23   0.935   0.091  -3.332
  166   3HB   ALA  23          3HB       ALA  23  -0.440  -0.726  -2.587
  167    H    LYS  24           H        LYS  24  -0.842   2.690  -1.235
  168    HA   LYS  24           HA       LYS  24  -3.303   1.773  -0.030
  169   1HB   LYS  24          1HB       LYS  24  -1.536   4.182   0.482
  170   2HB   LYS  24          2HB       LYS  24  -2.945   3.786   1.469
  171   1HG   LYS  24          1HG       LYS  24  -1.977   1.579   1.984
  172   2HG   LYS  24          2HG       LYS  24  -0.567   1.960   0.998
  173   1HD   LYS  24          1HD       LYS  24  -0.092   3.907   2.472
  174   2HD   LYS  24          2HD       LYS  24  -1.460   3.446   3.486
  175   1HE   LYS  24          1HE       LYS  24  -0.403   1.279   3.958
  176   2HE   LYS  24          2HE       LYS  24   0.953   1.698   2.908
  177   1HZ   LYS  24          1HZ       LYS  24   0.432   3.723   4.850
  178   2HZ   LYS  24          2HZ       LYS  24   0.747   2.226   5.584
  179   3HZ   LYS  24          3HZ       LYS  24   1.878   2.899   4.510
  180    H    VAL  25           H        VAL  25  -2.413   4.613  -1.993
  181    HA   VAL  25           HA       VAL  25  -4.987   5.906  -1.806
  182    HB   VAL  25           HB       VAL  25  -2.797   6.075  -3.885
  183   1HG1  VAL  25          1HG1      VAL  25  -5.391   7.597  -3.589
  184   2HG1  VAL  25          2HG1      VAL  25  -4.014   8.254  -4.472
  185   3HG1  VAL  25          3HG1      VAL  25  -4.777   6.761  -5.016
  186   1HG2  VAL  25          1HG2      VAL  25  -2.481   6.891  -1.427
  187   2HG2  VAL  25          2HG2      VAL  25  -2.065   7.999  -2.733
  188   3HG2  VAL  25          3HG2      VAL  25  -3.595   8.183  -1.877
  189    H    LEU  26           H        LEU  26  -3.570   3.863  -4.403
  190    HA   LEU  26           HA       LEU  26  -5.954   3.797  -5.952
  191   1HB   LEU  26          1HB       LEU  26  -3.738   1.743  -5.628
  192   2HB   LEU  26          2HB       LEU  26  -5.030   1.587  -6.816
  193    HG   LEU  26           HG       LEU  26  -3.136   3.950  -6.639
  194   1HD1  LEU  26          1HD1      LEU  26  -2.077   1.738  -7.280
  195   2HD1  LEU  26          2HD1      LEU  26  -3.152   1.709  -8.677
  196   3HD1  LEU  26          3HD1      LEU  26  -1.959   2.996  -8.512
  197   1HD2  LEU  26          1HD2      LEU  26  -5.453   3.226  -8.421
  198   2HD2  LEU  26          2HD2      LEU  26  -4.983   4.800  -7.783
  199   3HD2  LEU  26          3HD2      LEU  26  -4.095   4.097  -9.129
  200    H    ALA  27           H        ALA  27  -4.865   1.792  -3.234
  201    HA   ALA  27           HA       ALA  27  -7.173   0.040  -3.317
  202   1HB   ALA  27          1HB       ALA  27  -4.907  -0.407  -2.188
  203   2HB   ALA  27          2HB       ALA  27  -5.478   0.631  -0.882
  204   3HB   ALA  27          3HB       ALA  27  -6.342  -0.855  -1.271
  205    H    ASN  28           H        ASN  28  -6.248   2.597  -0.976
  206    HA   ASN  28           HA       ASN  28  -8.770   2.738   0.331
  207   1HB   ASN  28          1HB       ASN  28  -6.712   3.723   1.259
  208   2HB   ASN  28          2HB       ASN  28  -6.698   4.921  -0.036
  209   2HD2  ASN  28          2HD2      ASN  28  -6.813   5.993   2.481
  210   1HD2  ASN  28          1HD2      ASN  28  -8.375   6.553   2.840
  211    H    ARG  29           H        ARG  29  -7.525   4.582  -2.450
  212    HA   ARG  29           HA       ARG  29  -9.701   6.394  -2.677
  213   1HB   ARG  29          1HB       ARG  29  -7.514   6.542  -3.919
  214   2HB   ARG  29          2HB       ARG  29  -8.078   5.237  -4.965
  215   1HG   ARG  29          1HG       ARG  29  -8.690   7.097  -6.199
  216   2HG   ARG  29          2HG       ARG  29 -10.169   6.826  -5.288
  217   1HD   ARG  29          1HD       ARG  29  -8.984   8.430  -3.530
  218   2HD   ARG  29          2HD       ARG  29  -8.086   8.963  -4.946
  219    HE   ARG  29           HE       ARG  29 -10.745   9.734  -4.275
  220   1HH1  ARG  29          1HH1      ARG  29 -12.277  10.402  -5.771
  221   2HH1  ARG  29          2HH1      ARG  29 -12.005  10.118  -7.459
  222   1HH2  ARG  29          1HH2      ARG  29  -8.939   8.589  -6.985
  223   2HH2  ARG  29          2HH2      ARG  29 -10.123   9.087  -8.140
  224    H    GLU  30           H        GLU  30  -9.292   3.102  -3.954
  225    HA   GLU  30           HA       GLU  30 -11.615   3.053  -5.595
  226   1HB   GLU  30          1HB       GLU  30  -9.849   1.287  -5.571
  227   2HB   GLU  30          2HB       GLU  30 -10.431   0.766  -3.991
  228   1HG   GLU  30          1HG       GLU  30 -11.405  -0.663  -5.707
  229   2HG   GLU  30          2HG       GLU  30 -12.677   0.336  -5.010
  230    H    LEU  31           H        LEU  31 -11.210   2.384  -2.126
  231    HA   LEU  31           HA       LEU  31 -13.907   1.521  -1.634
  232   1HB   LEU  31          1HB       LEU  31 -12.178   3.045   0.331
  233   2HB   LEU  31          2HB       LEU  31 -13.407   1.830   0.683
  234    HG   LEU  31           HG       LEU  31 -10.748   1.395  -0.674
  235   1HD1  LEU  31          1HD1      LEU  31 -11.933   0.498   1.966
  236   2HD1  LEU  31          2HD1      LEU  31 -10.442  -0.164   1.295
  237   3HD1  LEU  31          3HD1      LEU  31 -10.534   1.544   1.726
  238   1HD2  LEU  31          1HD2      LEU  31 -13.179  -0.378  -0.386
  239   2HD2  LEU  31          2HD2      LEU  31 -12.174  -0.106  -1.809
  240   3HD2  LEU  31          3HD2      LEU  31 -11.568  -1.087  -0.477
  241    H    ASP  32           H        ASP  32 -12.314   4.654  -1.620
  242    HA   ASP  32           HA       ASP  32 -14.437   6.237  -0.613
  243   1HB   ASP  32          1HB       ASP  32 -12.122   7.037  -0.879
  244   2HB   ASP  32          2HB       ASP  32 -12.290   6.950  -2.629
  245    H    LYS  33           H        LYS  33 -13.698   5.160  -3.929
  246    HA   LYS  33           HA       LYS  33 -15.680   6.711  -5.261
  247   1HB   LYS  33          1HB       LYS  33 -13.864   5.303  -6.344
  248   2HB   LYS  33          2HB       LYS  33 -14.854   3.886  -5.996
  249   1HG   LYS  33          1HG       LYS  33 -16.741   5.001  -7.246
  250   2HG   LYS  33          2HG       LYS  33 -15.601   6.252  -7.736
  251   1HD   LYS  33          1HD       LYS  33 -15.337   3.285  -8.319
  252   2HD   LYS  33          2HD       LYS  33 -15.794   4.527  -9.483
  253   1HE   LYS  33          1HE       LYS  33 -13.121   4.061  -8.176
  254   2HE   LYS  33          2HE       LYS  33 -13.496   4.257  -9.886
  255   1HZ   LYS  33          1HZ       LYS  33 -14.090   6.575  -9.425
  256   2HZ   LYS  33          2HZ       LYS  33 -13.620   6.371  -7.805
  257   3HZ   LYS  33          3HZ       LYS  33 -12.468   6.242  -9.043
  258    H    TYR  34           H        TYR  34 -15.881   3.420  -3.855
  259    HA   TYR  34           HA       TYR  34 -18.701   3.140  -4.434
  260   1HB   TYR  34          1HB       TYR  34 -16.868   1.694  -2.504
  261   2HB   TYR  34          2HB       TYR  34 -18.564   1.266  -2.731
  262    HD1  TYR  34           HD1      TYR  34 -15.224   0.852  -3.986
  263    HD2  TYR  34           HD2      TYR  34 -19.363   0.777  -5.132
  264    HE1  TYR  34           HE1      TYR  34 -14.643  -0.468  -6.004
  265    HE2  TYR  34           HE2      TYR  34 -18.782  -0.542  -7.150
  266    HH   TYR  34           HH       TYR  34 -15.739  -2.016  -7.566
  267    H    GLY  35           H        GLY  35 -16.852   4.483  -1.764
  268   1HA   GLY  35          1HA       GLY  35 -19.361   5.602  -0.644
  269   2HA   GLY  35          2HA       GLY  35 -17.725   6.112  -0.229
  270    H    VAL  36           H        VAL  36 -17.065   3.100   0.003
  271    HA   VAL  36           HA       VAL  36 -18.586   1.913   2.063
  272    HB   VAL  36           HB       VAL  36 -15.583   1.618   2.048
  273   1HG1  VAL  36          1HG1      VAL  36 -17.909  -0.323   2.272
  274   2HG1  VAL  36          2HG1      VAL  36 -16.206  -0.772   2.345
  275   3HG1  VAL  36          3HG1      VAL  36 -16.903   0.250   3.601
  276   1HG2  VAL  36          1HG2      VAL  36 -17.510   0.779  -0.128
  277   2HG2  VAL  36          2HG2      VAL  36 -15.998   1.670  -0.300
  278   3HG2  VAL  36          3HG2      VAL  36 -15.969  -0.039   0.127
  279    H    SER  37           H        SER  37 -17.722   1.618   4.395
  280    HA   SER  37           HA       SER  37 -17.761   4.123   5.736
  281   1HB   SER  37          1HB       SER  37 -18.391   2.007   6.832
  282   2HB   SER  37          2HB       SER  37 -16.722   1.453   6.732
  283    HG   SER  37           HG       SER  37 -17.863   2.982   8.587
  284    H    ASP  38           H        ASP  38 -16.135   5.448   6.503
  285    HA   ASP  38           HA       ASP  38 -13.590   5.416   5.198
  286   1HB   ASP  38          1HB       ASP  38 -14.584   6.890   7.650
  287   2HB   ASP  38          2HB       ASP  38 -13.000   7.173   6.926
  288    H    TYR  39           H        TYR  39 -14.741   3.657   7.885
  289    HA   TYR  39           HA       TYR  39 -12.399   3.439   9.482
  290   1HB   TYR  39          1HB       TYR  39 -14.525   2.587  10.281
  291   2HB   TYR  39          2HB       TYR  39 -14.610   1.436   8.948
  292    HD1  TYR  39           HD1      TYR  39 -12.971   2.245  12.147
  293    HD2  TYR  39           HD2      TYR  39 -13.195  -0.544   8.890
  294    HE1  TYR  39           HE1      TYR  39 -11.691   0.588  13.476
  295    HE2  TYR  39           HE2      TYR  39 -11.916  -2.199  10.216
  296    HH   TYR  39           HH       TYR  39 -11.603  -2.552  12.905
  297    H    TYR  40           H        TYR  40 -13.492   1.368   6.768
  298    HA   TYR  40           HA       TYR  40 -11.252  -0.386   6.792
  299   1HB   TYR  40          1HB       TYR  40 -12.899   0.531   4.412
  300   2HB   TYR  40          2HB       TYR  40 -11.856  -0.890   4.454
  301    HD1  TYR  40           HD1      TYR  40 -12.373  -2.754   6.094
  302    HD2  TYR  40           HD2      TYR  40 -15.099   0.470   5.304
  303    HE1  TYR  40           HE1      TYR  40 -14.230  -4.084   7.064
  304    HE2  TYR  40           HE2      TYR  40 -16.954  -0.857   6.273
  305    HH   TYR  40           HH       TYR  40 -16.905  -2.974   8.161
  306    H    LYS  41           H        LYS  41 -11.737   2.746   5.181
  307    HA   LYS  41           HA       LYS  41  -9.349   2.768   3.629
  308   1HB   LYS  41          1HB       LYS  41 -10.769   5.080   4.998
  309   2HB   LYS  41          2HB       LYS  41  -9.625   5.220   3.660
  310   1HG   LYS  41          1HG       LYS  41 -11.110   3.866   2.241
  311   2HG   LYS  41          2HG       LYS  41 -12.253   3.723   3.577
  312   1HD   LYS  41          1HD       LYS  41 -12.184   6.353   3.572
  313   2HD   LYS  41          2HD       LYS  41 -11.549   6.152   1.936
  314   1HE   LYS  41          1HE       LYS  41 -13.505   4.786   1.340
  315   2HE   LYS  41          2HE       LYS  41 -14.132   4.971   2.977
  316   1HZ   LYS  41          1HZ       LYS  41 -13.541   7.263   1.189
  317   2HZ   LYS  41          2HZ       LYS  41 -15.077   6.543   1.304
  318   3HZ   LYS  41          3HZ       LYS  41 -14.382   7.292   2.661
  319    H    ASN  42           H        ASN  42 -10.102   3.817   6.903
  320    HA   ASN  42           HA       ASN  42  -7.521   4.807   7.573
  321   1HB   ASN  42          1HB       ASN  42  -9.689   3.590   9.301
  322   2HB   ASN  42          2HB       ASN  42  -8.225   4.320   9.960
  323   2HD2  ASN  42          2HD2      ASN  42  -7.937   6.524   8.165
  324   1HD2  ASN  42          1HD2      ASN  42  -9.249   7.579   8.389
  325    H    LEU  43           H        LEU  43  -8.906   1.554   7.761
  326    HA   LEU  43           HA       LEU  43  -6.744   0.281   9.099
  327   1HB   LEU  43          1HB       LEU  43  -8.930  -0.808   8.733
  328   2HB   LEU  43          2HB       LEU  43  -8.622  -0.853   7.000
  329    HG   LEU  43           HG       LEU  43  -6.652  -2.301   7.393
  330   1HD1  LEU  43          1HD1      LEU  43  -7.444  -1.874  10.272
  331   2HD1  LEU  43          2HD1      LEU  43  -6.604  -3.350   9.792
  332   3HD1  LEU  43          3HD1      LEU  43  -5.841  -1.785   9.540
  333   1HD2  LEU  43          1HD2      LEU  43  -9.069  -3.160   7.127
  334   2HD2  LEU  43          2HD2      LEU  43  -7.887  -4.291   7.787
  335   3HD2  LEU  43          3HD2      LEU  43  -9.019  -3.473   8.862
  336    H    ILE  44           H        ILE  44  -7.287   0.982   5.659
  337    HA   ILE  44           HA       ILE  44  -5.045  -0.436   4.611
  338    HB   ILE  44           HB       ILE  44  -6.361   2.141   3.694
  339   1HG1  ILE  44          1HG1      ILE  44  -7.626  -0.177   3.786
  340   2HG1  ILE  44          2HG1      ILE  44  -7.773   0.842   2.359
  341   1HG2  ILE  44          1HG2      ILE  44  -4.254   0.410   2.400
  342   2HG2  ILE  44          2HG2      ILE  44  -5.294   1.476   1.457
  343   3HG2  ILE  44          3HG2      ILE  44  -4.220   2.150   2.682
  344   1HD1  ILE  44          1HD1      ILE  44  -5.599  -1.240   2.501
  345   2HD1  ILE  44          2HD1      ILE  44  -7.241  -1.696   2.044
  346   3HD1  ILE  44          3HD1      ILE  44  -6.355  -0.516   1.083
  347    H    ASN  45           H        ASN  45  -5.376   2.820   5.961
  348    HA   ASN  45           HA       ASN  45  -2.779   3.800   5.402
  349   1HB   ASN  45          1HB       ASN  45  -4.733   5.104   6.361
  350   2HB   ASN  45          2HB       ASN  45  -4.371   4.359   7.918
  351   2HD2  ASN  45          2HD2      ASN  45  -3.311   5.932   9.146
  352   1HD2  ASN  45          1HD2      ASN  45  -2.026   6.891   8.588
  353    H    ASN  46           H        ASN  46  -3.919   1.623   7.935
  354    HA   ASN  46           HA       ASN  46  -1.309   1.677   9.314
  355   1HB   ASN  46          1HB       ASN  46  -3.875   0.143   9.801
  356   2HB   ASN  46          2HB       ASN  46  -2.425  -0.044  10.788
  357   2HD2  ASN  46          2HD2      ASN  46  -1.532   2.631  10.946
  358   1HD2  ASN  46          1HD2      ASN  46  -2.691   3.561  11.765
  359    H    ALA  47           H        ALA  47  -2.341   0.236   6.546
  360    HA   ALA  47           HA       ALA  47  -1.631  -2.501   6.850
  361   1HB   ALA  47          1HB       ALA  47  -2.735  -1.316   4.839
  362   2HB   ALA  47          2HB       ALA  47  -1.591  -2.611   4.487
  363   3HB   ALA  47          3HB       ALA  47  -1.094  -0.925   4.332
  364    H    LYS  48           H        LYS  48   0.333  -3.562   6.785
  365    HA   LYS  48           HA       LYS  48   2.735  -1.905   7.193
  366   1HB   LYS  48          1HB       LYS  48   3.805  -4.033   7.795
  367   2HB   LYS  48          2HB       LYS  48   2.281  -3.839   8.661
  368   1HG   LYS  48          1HG       LYS  48   1.163  -5.212   6.881
  369   2HG   LYS  48          2HG       LYS  48   2.754  -5.514   6.179
  370   1HD   LYS  48          1HD       LYS  48   3.494  -6.479   8.355
  371   2HD   LYS  48          2HD       LYS  48   1.856  -6.263   8.975
  372   1HE   LYS  48          1HE       LYS  48   2.538  -7.884   6.507
  373   2HE   LYS  48          2HE       LYS  48   2.290  -8.578   8.111
  374   1HZ   LYS  48          1HZ       LYS  48   0.092  -7.218   7.984
  375   2HZ   LYS  48          2HZ       LYS  48   0.346  -7.319   6.308
  376   3HZ   LYS  48          3HZ       LYS  48   0.201  -8.736   7.229
  377    H    THR  49           H        THR  49   1.361  -3.902   4.639
  378    HA   THR  49           HA       THR  49   3.624  -3.107   2.897
  379    HB   THR  49           HB       THR  49   4.247  -5.294   3.971
  380    HG1  THR  49           HG1      THR  49   4.288  -6.312   1.661
  381   1HG2  THR  49          1HG2      THR  49   1.832  -6.109   3.999
  382   2HG2  THR  49          2HG2      THR  49   2.024  -6.441   2.277
  383   3HG2  THR  49          3HG2      THR  49   3.031  -7.282   3.453
  384    H    VAL  50           H        VAL  50   3.198  -3.944   0.583
  385    HA   VAL  50           HA       VAL  50   0.607  -3.022  -0.250
  386    HB   VAL  50           HB       VAL  50   1.304  -3.635  -2.494
  387   1HG1  VAL  50          1HG1      VAL  50   2.367  -1.651  -1.458
  388   2HG1  VAL  50          2HG1      VAL  50   3.681  -2.671  -0.874
  389   3HG1  VAL  50          3HG1      VAL  50   3.446  -2.441  -2.608
  390   1HG2  VAL  50          1HG2      VAL  50   3.368  -5.287  -1.023
  391   2HG2  VAL  50          2HG2      VAL  50   2.185  -5.833  -2.211
  392   3HG2  VAL  50          3HG2      VAL  50   3.556  -4.847  -2.721
  393    H    GLU  51           H        GLU  51   1.978  -6.286   0.158
  394    HA   GLU  51           HA       GLU  51  -0.139  -7.707  -1.103
  395   1HB   GLU  51          1HB       GLU  51   1.983  -8.780  -0.416
  396   2HB   GLU  51          2HB       GLU  51   1.540  -8.563   1.277
  397   1HG   GLU  51          1HG       GLU  51  -0.458  -9.977   0.941
  398   2HG   GLU  51          2HG       GLU  51  -0.018 -10.193  -0.753
  399    H    GLY  52           H        GLY  52   0.217  -6.504   2.214
  400   1HA   GLY  52          1HA       GLY  52  -1.380  -6.292   3.924
  401   2HA   GLY  52          2HA       GLY  52  -2.229  -7.660   3.197
  402    H    VAL  53           H        VAL  53  -1.402  -4.560   1.674
  403    HA   VAL  53           HA       VAL  53  -3.992  -3.358   1.949
  404    HB   VAL  53           HB       VAL  53  -1.743  -2.919  -0.034
  405   1HG1  VAL  53          1HG1      VAL  53  -4.397  -1.515   0.289
  406   2HG1  VAL  53          2HG1      VAL  53  -2.998  -0.692  -0.402
  407   3HG1  VAL  53          3HG1      VAL  53  -3.657  -2.126  -1.189
  408   1HG2  VAL  53          1HG2      VAL  53  -2.700  -1.476   2.454
  409   2HG2  VAL  53          2HG2      VAL  53  -1.149  -2.278   2.215
  410   3HG2  VAL  53          3HG2      VAL  53  -1.519  -0.799   1.333
  411    H    LYS  54           H        LYS  54  -2.490  -5.123  -0.780
  412    HA   LYS  54           HA       LYS  54  -4.773  -5.018  -2.484
  413   1HB   LYS  54          1HB       LYS  54  -2.530  -5.599  -3.302
  414   2HB   LYS  54          2HB       LYS  54  -2.572  -7.099  -2.373
  415   1HG   LYS  54          1HG       LYS  54  -4.400  -7.952  -3.674
  416   2HG   LYS  54          2HG       LYS  54  -4.650  -6.393  -4.454
  417   1HD   LYS  54          1HD       LYS  54  -3.469  -7.780  -6.025
  418   2HD   LYS  54          2HD       LYS  54  -2.315  -6.599  -5.410
  419   1HE   LYS  54          1HE       LYS  54  -1.273  -8.196  -3.991
  420   2HE   LYS  54          2HE       LYS  54  -2.602  -9.341  -4.170
  421   1HZ   LYS  54          1HZ       LYS  54  -0.905  -8.453  -6.432
  422   2HZ   LYS  54          2HZ       LYS  54  -0.580  -9.846  -5.515
  423   3HZ   LYS  54          3HZ       LYS  54  -2.018  -9.732  -6.413
  424    H    ALA  55           H        ALA  55  -3.743  -7.552  -0.178
  425    HA   ALA  55           HA       ALA  55  -5.965  -9.298  -0.774
  426   1HB   ALA  55          1HB       ALA  55  -4.304  -9.161   1.758
  427   2HB   ALA  55          2HB       ALA  55  -5.277 -10.528   1.214
  428   3HB   ALA  55          3HB       ALA  55  -3.843 -10.051   0.306
  429    H    LEU  56           H        LEU  56  -5.607  -6.514   1.253
  430    HA   LEU  56           HA       LEU  56  -7.801  -7.091   3.014
  431   1HB   LEU  56          1HB       LEU  56  -6.135  -5.491   3.679
  432   2HB   LEU  56          2HB       LEU  56  -6.468  -4.485   2.274
  433    HG   LEU  56           HG       LEU  56  -8.702  -3.978   3.105
  434   1HD1  LEU  56          1HD1      LEU  56  -7.997  -6.069   5.170
  435   2HD1  LEU  56          2HD1      LEU  56  -9.205  -4.834   5.519
  436   3HD1  LEU  56          3HD1      LEU  56  -9.449  -5.946   4.177
  437   1HD2  LEU  56          1HD2      LEU  56  -6.609  -2.775   4.012
  438   2HD2  LEU  56          2HD2      LEU  56  -8.088  -2.608   4.956
  439   3HD2  LEU  56          3HD2      LEU  56  -6.834  -3.735   5.473
  440    H    ILE  57           H        ILE  57  -7.546  -5.597  -0.162
  441    HA   ILE  57           HA       ILE  57 -10.339  -4.685  -0.114
  442    HB   ILE  57           HB       ILE  57  -8.610  -5.078  -2.566
  443   1HG1  ILE  57          1HG1      ILE  57  -7.475  -3.665  -0.721
  444   2HG1  ILE  57          2HG1      ILE  57  -7.650  -2.912  -2.299
  445   1HG2  ILE  57          1HG2      ILE  57 -10.986  -3.326  -1.900
  446   2HG2  ILE  57          2HG2      ILE  57 -10.013  -3.124  -3.357
  447   3HG2  ILE  57          3HG2      ILE  57 -10.899  -4.622  -3.087
  448   1HD1  ILE  57          1HD1      ILE  57  -9.744  -2.512  -0.163
  449   2HD1  ILE  57          2HD1      ILE  57  -8.300  -1.517  -0.212
  450   3HD1  ILE  57          3HD1      ILE  57  -9.412  -1.520  -1.578
  451    H    ASP  58           H        ASP  58  -8.469  -7.440  -1.272
  452    HA   ASP  58           HA       ASP  58 -10.599  -8.649  -2.792
  453   1HB   ASP  58          1HB       ASP  58  -8.140  -9.828  -1.475
  454   2HB   ASP  58          2HB       ASP  58  -9.244 -10.766  -2.482
  455    H    GLU  59           H        GLU  59  -9.596  -8.955   0.609
  456    HA   GLU  59           HA       GLU  59 -11.542 -11.019   1.180
  457   1HB   GLU  59          1HB       GLU  59 -10.930 -10.736   3.492
  458   2HB   GLU  59          2HB       GLU  59  -9.450 -10.541   2.553
  459   1HG   GLU  59          1HG       GLU  59  -9.824  -8.086   2.603
  460   2HG   GLU  59          2HG       GLU  59 -11.157  -8.341   3.723
  461    H    ILE  60           H        ILE  60 -11.500  -7.494   1.349
  462    HA   ILE  60           HA       ILE  60 -14.054  -7.262   2.663
  463    HB   ILE  60           HB       ILE  60 -12.436  -5.330   0.984
  464   1HG1  ILE  60          1HG1      ILE  60 -13.060  -5.296   3.945
  465   2HG1  ILE  60          2HG1      ILE  60 -11.643  -6.108   3.284
  466   1HG2  ILE  60          1HG2      ILE  60 -15.066  -4.937   2.433
  467   2HG2  ILE  60          2HG2      ILE  60 -13.998  -3.596   2.016
  468   3HG2  ILE  60          3HG2      ILE  60 -14.704  -4.591   0.742
  469   1HD1  ILE  60          1HD1      ILE  60 -10.983  -3.944   2.196
  470   2HD1  ILE  60          2HD1      ILE  60 -12.327  -3.166   3.031
  471   3HD1  ILE  60          3HD1      ILE  60 -10.997  -3.864   3.957
  472    H    LEU  61           H        LEU  61 -13.031  -7.275  -0.740
  473    HA   LEU  61           HA       LEU  61 -15.652  -6.741  -1.801
  474   1HB   LEU  61          1HB       LEU  61 -13.172  -8.003  -2.991
  475   2HB   LEU  61          2HB       LEU  61 -14.652  -7.776  -3.923
  476    HG   LEU  61           HG       LEU  61 -13.174  -5.547  -2.489
  477   1HD1  LEU  61          1HD1      LEU  61 -13.130  -6.415  -5.393
  478   2HD1  LEU  61          2HD1      LEU  61 -12.455  -4.897  -4.800
  479   3HD1  LEU  61          3HD1      LEU  61 -11.773  -6.435  -4.269
  480   1HD2  LEU  61          1HD2      LEU  61 -15.642  -5.694  -4.209
  481   2HD2  LEU  61          2HD2      LEU  61 -15.325  -4.696  -2.791
  482   3HD2  LEU  61          3HD2      LEU  61 -14.614  -4.267  -4.341
  483    H    ALA  62           H        ALA  62 -13.907  -9.739  -1.042
  484    HA   ALA  62           HA       ALA  62 -16.102 -11.410  -2.029
  485   1HB   ALA  62          1HB       ALA  62 -13.703 -12.143  -2.041
  486   2HB   ALA  62          2HB       ALA  62 -13.753 -12.192  -0.279
  487   3HB   ALA  62          3HB       ALA  62 -14.776 -13.276  -1.221
  488    H    ALA  63           H        ALA  63 -16.470  -9.380   0.260
  489    HA   ALA  63           HA       ALA  63 -17.894 -11.277   2.081
  490   1HB   ALA  63          1HB       ALA  63 -16.083  -9.009   2.965
  491   2HB   ALA  63          2HB       ALA  63 -17.138  -9.931   4.034
  492   3HB   ALA  63          3HB       ALA  63 -15.797 -10.731   3.215
  493    H    LEU  64           H        LEU  64 -18.489  -9.113  -0.089
  494    HA   LEU  64           HA       LEU  64 -19.864  -7.004   1.306
  495   1HB   LEU  64          1HB       LEU  64 -20.082  -8.085  -1.514
  496   2HB   LEU  64          2HB       LEU  64 -20.999  -6.687  -0.966
  497    HG   LEU  64           HG       LEU  64 -18.000  -6.787  -0.604
  498   1HD1  LEU  64          1HD1      LEU  64 -19.512  -5.911  -3.080
  499   2HD1  LEU  64          2HD1      LEU  64 -17.814  -5.552  -2.770
  500   3HD1  LEU  64          3HD1      LEU  64 -18.339  -7.223  -2.972
  501   1HD2  LEU  64          1HD2      LEU  64 -20.077  -4.584  -0.840
  502   2HD2  LEU  64          2HD2      LEU  64 -19.073  -4.969   0.557
  503   3HD2  LEU  64          3HD2      LEU  64 -18.344  -4.279  -0.889
  504    HA   PRO  65           HA       PRO  65 -23.542  -9.181   2.568
  505   1HB   PRO  65          1HB       PRO  65 -25.443  -7.165   1.880
  506   2HB   PRO  65          2HB       PRO  65 -24.649  -7.388   3.443
  507   1HG   PRO  65          1HG       PRO  65 -24.108  -5.377   1.353
  508   2HG   PRO  65          2HG       PRO  65 -23.680  -5.350   3.069
  509   1HD   PRO  65          1HD       PRO  65 -21.872  -5.774   0.967
  510   2HD   PRO  65          2HD       PRO  65 -21.579  -6.210   2.668

  No H/Q in entry =         510
  Start of MODEL   27
    1    H1   MET   1           H1       MET   1  22.848  -4.428 -16.647
    2    H2   MET   1           H2       MET   1  24.480  -4.616 -16.213
    3    H3   MET   1           H3       MET   1  24.069  -3.711 -17.588
    4    HA   MET   1           HA       MET   1  23.475  -5.577 -18.819
    5   1HB   MET   1          1HB       MET   1  25.826  -6.230 -17.022
    6   2HB   MET   1          2HB       MET   1  25.411  -7.159 -18.465
    7   1HG   MET   1          1HG       MET   1  25.626  -5.133 -19.846
    8   2HG   MET   1          2HG       MET   1  26.033  -4.191 -18.411
    9   1HE   MET   1          1HE       MET   1  28.007  -3.343 -19.651
   10   2HE   MET   1          2HE       MET   1  29.422  -4.269 -20.173
   11   3HE   MET   1          3HE       MET   1  27.912  -4.379 -21.073
   12    H    LYS   2           H        LYS   2  23.865  -8.259 -18.415
   13    HA   LYS   2           HA       LYS   2  21.485  -9.065 -17.063
   14   1HB   LYS   2          1HB       LYS   2  22.623 -10.401 -18.842
   15   2HB   LYS   2          2HB       LYS   2  23.911 -10.779 -17.698
   16   1HG   LYS   2          1HG       LYS   2  22.255 -11.829 -16.188
   17   2HG   LYS   2          2HG       LYS   2  20.975 -11.456 -17.341
   18   1HD   LYS   2          1HD       LYS   2  22.096 -12.851 -19.043
   19   2HD   LYS   2          2HD       LYS   2  23.377 -13.226 -17.889
   20   1HE   LYS   2          1HE       LYS   2  20.440 -13.860 -17.477
   21   2HE   LYS   2          2HE       LYS   2  21.658 -15.024 -17.998
   22   1HZ   LYS   2          1HZ       LYS   2  22.897 -14.334 -15.907
   23   2HZ   LYS   2          2HZ       LYS   2  21.436 -13.630 -15.402
   24   3HZ   LYS   2          3HZ       LYS   2  21.518 -15.299 -15.703
   25    H    ALA   3           H        ALA   3  24.881  -9.020 -16.028
   26    HA   ALA   3           HA       ALA   3  24.351 -10.268 -13.465
   27   1HB   ALA   3          1HB       ALA   3  26.710  -8.474 -14.048
   28   2HB   ALA   3          2HB       ALA   3  26.636  -9.890 -12.998
   29   3HB   ALA   3          3HB       ALA   3  26.599 -10.084 -14.752
   30    H    ILE   4           H        ILE   4  24.277  -9.203 -11.398
   31    HA   ILE   4           HA       ILE   4  23.871  -6.237 -11.442
   32    HB   ILE   4           HB       ILE   4  21.991  -6.697  -9.722
   33   1HG1  ILE   4          1HG1      ILE   4  22.735  -9.267  -9.800
   34   2HG1  ILE   4          2HG1      ILE   4  21.056  -8.816  -9.537
   35   1HG2  ILE   4          1HG2      ILE   4  21.697  -7.284 -12.676
   36   2HG2  ILE   4          2HG2      ILE   4  20.322  -7.077 -11.591
   37   3HG2  ILE   4          3HG2      ILE   4  21.451  -5.747 -11.847
   38   1HD1  ILE   4          1HD1      ILE   4  22.047  -9.268 -12.347
   39   2HD1  ILE   4          2HD1      ILE   4  21.622 -10.641 -11.328
   40   3HD1  ILE   4          3HD1      ILE   4  20.415  -9.415 -11.708
   41    H    PHE   5           H        PHE   5  26.137  -6.492 -10.562
   42    HA   PHE   5           HA       PHE   5  26.677  -7.800  -8.089
   43   1HB   PHE   5          1HB       PHE   5  27.945  -5.370  -9.382
   44   2HB   PHE   5          2HB       PHE   5  28.586  -6.141  -7.930
   45    HD1  PHE   5           HD1      PHE   5  29.552  -8.393  -8.013
   46    HD2  PHE   5           HD2      PHE   5  28.037  -6.482 -11.550
   47    HE1  PHE   5           HE1      PHE   5  30.707 -10.079  -9.420
   48    HE2  PHE   5           HE2      PHE   5  29.191  -8.169 -12.955
   49    HZ   PHE   5           HZ       PHE   5  30.526  -9.966 -11.891
   50    H    VAL   6           H        VAL   6  25.764  -4.424  -8.778
   51    HA   VAL   6           HA       VAL   6  24.495  -4.254  -6.109
   52    HB   VAL   6           HB       VAL   6  25.680  -2.067  -5.679
   53   1HG1  VAL   6          1HG1      VAL   6  26.345  -4.295  -4.667
   54   2HG1  VAL   6          2HG1      VAL   6  27.569  -4.423  -5.930
   55   3HG1  VAL   6          3HG1      VAL   6  27.646  -3.109  -4.757
   56   1HG2  VAL   6          1HG2      VAL   6  26.397  -1.677  -8.021
   57   2HG2  VAL   6          2HG2      VAL   6  27.771  -1.651  -6.916
   58   3HG2  VAL   6          3HG2      VAL   6  27.470  -3.073  -7.916
   59    H    LEU   7           H        LEU   7  22.922  -2.555  -6.014
   60    HA   LEU   7           HA       LEU   7  22.555  -0.850  -8.388
   61   1HB   LEU   7          1HB       LEU   7  20.305  -1.621  -8.882
   62   2HB   LEU   7          2HB       LEU   7  21.407  -2.990  -8.969
   63    HG   LEU   7           HG       LEU   7  19.668  -2.310  -6.572
   64   1HD1  LEU   7          1HD1      LEU   7  18.481  -3.101  -8.669
   65   2HD1  LEU   7          2HD1      LEU   7  19.385  -4.610  -8.513
   66   3HD1  LEU   7          3HD1      LEU   7  18.259  -4.120  -7.246
   67   1HD2  LEU   7          1HD2      LEU   7  21.753  -4.410  -7.133
   68   2HD2  LEU   7          2HD2      LEU   7  21.433  -3.523  -5.642
   69   3HD2  LEU   7          3HD2      LEU   7  20.370  -4.839  -6.126
   70    H    ASN   8           H        ASN   8  21.554  -1.822  -5.149
   71    HA   ASN   8           HA       ASN   8  20.846   1.018  -4.603
   72   1HB   ASN   8          1HB       ASN   8  19.078  -1.375  -4.040
   73   2HB   ASN   8          2HB       ASN   8  18.856   0.195  -3.265
   74   2HD2  ASN   8          2HD2      ASN   8  19.240   2.014  -5.287
   75   1HD2  ASN   8          1HD2      ASN   8  18.150   1.749  -6.561
   76    H    ALA   9           H        ALA   9  22.064   1.616  -2.914
   77    HA   ALA   9           HA       ALA   9  23.491  -0.269  -1.271
   78   1HB   ALA   9          1HB       ALA   9  24.441   1.920  -1.644
   79   2HB   ALA   9          2HB       ALA   9  23.010   2.708  -0.981
   80   3HB   ALA   9          3HB       ALA   9  24.076   1.784   0.075
   81    H    GLN  10           H        GLN  10  20.529   1.627  -0.780
   82    HA   GLN  10           HA       GLN  10  20.213   1.107   1.996
   83   1HB   GLN  10          1HB       GLN  10  17.798   1.562   1.598
   84   2HB   GLN  10          2HB       GLN  10  18.840   2.762   0.837
   85   1HG   GLN  10          1HG       GLN  10  18.663   1.484  -1.308
   86   2HG   GLN  10          2HG       GLN  10  17.505   0.407  -0.527
   87   2HE2  GLN  10          2HE2      GLN  10  16.082   1.367  -2.376
   88   1HE2  GLN  10          1HE2      GLN  10  15.240   2.797  -2.019
   89    H    HIS  11           H        HIS  11  19.220  -0.818  -0.831
   90    HA   HIS  11           HA       HIS  11  19.154  -3.215   0.869
   91   1HB   HIS  11          1HB       HIS  11  16.661  -2.285  -0.584
   92   2HB   HIS  11          2HB       HIS  11  16.845  -3.823   0.257
   93    HD1  HIS  11           HD1      HIS  11  17.386  -3.608   2.911
   94    HD2  HIS  11           HD2      HIS  11  15.869  -0.193   1.064
   95    HE1  HIS  11           HE1      HIS  11  16.555  -2.099   4.767
   96    H    ASP  12           H        ASP  12  18.512  -5.161  -0.610
   97    HA   ASP  12           HA       ASP  12  19.952  -4.786  -3.196
   98   1HB   ASP  12          1HB       ASP  12  20.219  -7.212  -3.165
   99   2HB   ASP  12          2HB       ASP  12  20.743  -6.540  -1.619
  100    H    GLU  13           H        GLU  13  16.801  -4.651  -2.217
  101    HA   GLU  13           HA       GLU  13  15.864  -5.537  -4.898
  102   1HB   GLU  13          1HB       GLU  13  13.997  -6.823  -3.901
  103   2HB   GLU  13          2HB       GLU  13  15.565  -7.513  -3.483
  104   1HG   GLU  13          1HG       GLU  13  15.494  -6.355  -1.302
  105   2HG   GLU  13          2HG       GLU  13  13.923  -5.670  -1.718
  106    H    ALA  14           H        ALA  14  15.987  -3.055  -2.847
  107    HA   ALA  14           HA       ALA  14  13.128  -2.270  -2.988
  108   1HB   ALA  14          1HB       ALA  14  14.424  -1.747  -0.947
  109   2HB   ALA  14          2HB       ALA  14  15.521  -0.752  -1.907
  110   3HB   ALA  14          3HB       ALA  14  13.831  -0.284  -1.730
  111    H    VAL  15           H        VAL  15  12.923  -2.070  -5.303
  112    HA   VAL  15           HA       VAL  15  14.670  -0.380  -6.863
  113    HB   VAL  15           HB       VAL  15  11.848  -1.391  -7.323
  114   1HG1  VAL  15          1HG1      VAL  15  13.669   0.252  -9.098
  115   2HG1  VAL  15          2HG1      VAL  15  12.344  -0.720  -9.737
  116   3HG1  VAL  15          3HG1      VAL  15  12.007   0.609  -8.628
  117   1HG2  VAL  15          1HG2      VAL  15  14.558  -2.162  -8.451
  118   2HG2  VAL  15          2HG2      VAL  15  13.591  -3.112  -7.322
  119   3HG2  VAL  15          3HG2      VAL  15  13.019  -2.849  -8.969
  120    H    ASP  16           H        ASP  16  11.584   0.142  -5.179
  121    HA   ASP  16           HA       ASP  16  12.158   3.013  -5.009
  122   1HB   ASP  16          1HB       ASP  16  10.049   3.708  -6.090
  123   2HB   ASP  16          2HB       ASP  16  11.090   2.854  -7.229
  124    H    ALA  17           H        ALA  17  10.553   4.106  -3.596
  125    HA   ALA  17           HA       ALA  17   9.163   2.179  -1.752
  126   1HB   ALA  17          1HB       ALA  17  10.523   4.820  -1.143
  127   2HB   ALA  17          2HB       ALA  17  11.075   3.220  -0.650
  128   3HB   ALA  17          3HB       ALA  17   9.586   3.883   0.022
  129    H    ASN  18           H        ASN  18   8.775   4.727  -3.943
  130    HA   ASN  18           HA       ASN  18   6.571   6.111  -2.701
  131   1HB   ASN  18          1HB       ASN  18   7.992   6.982  -4.607
  132   2HB   ASN  18          2HB       ASN  18   7.135   5.862  -5.665
  133   2HD2  ASN  18          2HD2      ASN  18   5.533   7.514  -2.948
  134   1HD2  ASN  18          1HD2      ASN  18   4.542   8.494  -3.914
  135    H    SER  19           H        SER  19   6.850   3.102  -4.371
  136    HA   SER  19           HA       SER  19   4.234   2.840  -5.447
  137   1HB   SER  19          1HB       SER  19   6.095   0.742  -4.303
  138   2HB   SER  19          2HB       SER  19   4.632   0.377  -5.215
  139    HG   SER  19           HG       SER  19   5.684   1.934  -6.805
  140    H    LEU  20           H        LEU  20   5.456   2.174  -2.166
  141    HA   LEU  20           HA       LEU  20   3.082   0.972  -1.149
  142   1HB   LEU  20          1HB       LEU  20   5.264   2.603   0.167
  143   2HB   LEU  20          2HB       LEU  20   3.927   1.938   1.094
  144    HG   LEU  20           HG       LEU  20   6.141   0.585   0.952
  145   1HD1  LEU  20          1HD1      LEU  20   3.462  -0.694   0.360
  146   2HD1  LEU  20          2HD1      LEU  20   4.881  -1.559   0.943
  147   3HD1  LEU  20          3HD1      LEU  20   4.128  -0.320   1.945
  148   1HD2  LEU  20          1HD2      LEU  20   6.343   0.762  -1.542
  149   2HD2  LEU  20          2HD2      LEU  20   6.385  -0.896  -0.951
  150   3HD2  LEU  20          3HD2      LEU  20   4.921  -0.271  -1.697
  151    H    ALA  21           H        ALA  21   4.096   4.402  -1.071
  152    HA   ALA  21           HA       ALA  21   1.744   5.360   0.181
  153   1HB   ALA  21          1HB       ALA  21   3.491   6.796  -1.837
  154   2HB   ALA  21          2HB       ALA  21   3.804   6.715  -0.103
  155   3HB   ALA  21          3HB       ALA  21   2.378   7.560  -0.705
  156    H    GLU  22           H        GLU  22   2.541   5.171  -3.300
  157    HA   GLU  22           HA       GLU  22   0.013   6.159  -4.199
  158   1HB   GLU  22          1HB       GLU  22   2.077   5.929  -5.617
  159   2HB   GLU  22          2HB       GLU  22   1.817   4.184  -5.627
  160   1HG   GLU  22          1HG       GLU  22  -0.406   4.519  -6.640
  161   2HG   GLU  22          2HG       GLU  22  -0.144   6.263  -6.638
  162    H    ALA  23           H        ALA  23   1.157   2.867  -3.499
  163    HA   ALA  23           HA       ALA  23  -1.123   1.473  -4.470
  164   1HB   ALA  23          1HB       ALA  23   0.606   0.743  -2.086
  165   2HB   ALA  23          2HB       ALA  23   1.004   0.379  -3.765
  166   3HB   ALA  23          3HB       ALA  23  -0.411  -0.359  -3.015
  167    H    LYS  24           H        LYS  24  -0.459   2.898  -1.265
  168    HA   LYS  24           HA       LYS  24  -2.972   2.029  -0.119
  169   1HB   LYS  24          1HB       LYS  24  -1.056   4.260   0.639
  170   2HB   LYS  24          2HB       LYS  24  -2.453   3.788   1.611
  171   1HG   LYS  24          1HG       LYS  24  -1.560   1.501   1.809
  172   2HG   LYS  24          2HG       LYS  24  -0.162   1.953   0.830
  173   1HD   LYS  24          1HD       LYS  24   0.468   3.645   2.510
  174   2HD   LYS  24          2HD       LYS  24  -0.923   3.193   3.491
  175   1HE   LYS  24          1HE       LYS  24  -0.038   0.921   3.744
  176   2HE   LYS  24          2HE       LYS  24   1.330   1.322   2.704
  177   1HZ   LYS  24          1HZ       LYS  24   1.503   3.271   4.490
  178   2HZ   LYS  24          2HZ       LYS  24   0.819   2.062   5.468
  179   3HZ   LYS  24          3HZ       LYS  24   2.291   1.777   4.675
  180    H    VAL  25           H        VAL  25  -1.873   4.993  -1.757
  181    HA   VAL  25           HA       VAL  25  -4.284   6.491  -1.368
  182    HB   VAL  25           HB       VAL  25  -2.139   6.646  -3.494
  183   1HG1  VAL  25          1HG1      VAL  25  -4.532   8.436  -3.002
  184   2HG1  VAL  25          2HG1      VAL  25  -3.116   8.945  -3.923
  185   3HG1  VAL  25          3HG1      VAL  25  -4.104   7.607  -4.498
  186   1HG2  VAL  25          1HG2      VAL  25  -1.568   7.197  -1.100
  187   2HG2  VAL  25          2HG2      VAL  25  -1.361   8.546  -2.216
  188   3HG2  VAL  25          3HG2      VAL  25  -2.777   8.476  -1.169
  189    H    LEU  26           H        LEU  26  -3.192   4.485  -4.131
  190    HA   LEU  26           HA       LEU  26  -5.541   4.824  -5.706
  191   1HB   LEU  26          1HB       LEU  26  -3.560   2.534  -5.529
  192   2HB   LEU  26          2HB       LEU  26  -4.841   2.608  -6.738
  193    HG   LEU  26           HG       LEU  26  -2.726   4.747  -6.341
  194   1HD1  LEU  26          1HD1      LEU  26  -2.934   2.548  -8.420
  195   2HD1  LEU  26          2HD1      LEU  26  -1.748   3.853  -8.437
  196   3HD1  LEU  26          3HD1      LEU  26  -1.725   2.656  -7.142
  197   1HD2  LEU  26          1HD2      LEU  26  -5.080   4.422  -8.188
  198   2HD2  LEU  26          2HD2      LEU  26  -4.442   5.882  -7.432
  199   3HD2  LEU  26          3HD2      LEU  26  -3.625   5.188  -8.827
  200    H    ALA  27           H        ALA  27  -4.737   2.429  -3.203
  201    HA   ALA  27           HA       ALA  27  -7.170   0.920  -3.464
  202   1HB   ALA  27          1HB       ALA  27  -5.223  -0.004  -2.308
  203   2HB   ALA  27          2HB       ALA  27  -5.313   1.267  -1.089
  204   3HB   ALA  27          3HB       ALA  27  -6.591   0.058  -1.199
  205    H    ASN  28           H        ASN  28  -6.257   3.733  -1.506
  206    HA   ASN  28           HA       ASN  28  -8.571   3.852   0.148
  207   1HB   ASN  28          1HB       ASN  28  -6.468   5.241   0.393
  208   2HB   ASN  28          2HB       ASN  28  -7.039   6.224  -0.956
  209   2HD2  ASN  28          2HD2      ASN  28  -7.558   5.470   2.445
  210   1HD2  ASN  28          1HD2      ASN  28  -8.720   6.676   2.725
  211    H    ARG  29           H        ARG  29  -7.956   5.161  -3.099
  212    HA   ARG  29           HA       ARG  29 -10.425   6.594  -3.331
  213   1HB   ARG  29          1HB       ARG  29  -8.559   5.441  -5.419
  214   2HB   ARG  29          2HB       ARG  29  -9.963   6.432  -5.816
  215   1HG   ARG  29          1HG       ARG  29  -9.070   8.265  -4.425
  216   2HG   ARG  29          2HG       ARG  29  -7.664   7.277  -4.028
  217   1HD   ARG  29          1HD       ARG  29  -7.050   8.773  -5.835
  218   2HD   ARG  29          2HD       ARG  29  -7.149   7.135  -6.483
  219    HE   ARG  29           HE       ARG  29  -9.682   8.160  -6.915
  220   1HH1  ARG  29          1HH1      ARG  29 -10.247   9.254  -8.809
  221   2HH1  ARG  29          2HH1      ARG  29  -9.017  10.047  -9.735
  222   1HH2  ARG  29          1HH2      ARG  29  -6.446   9.146  -7.595
  223   2HH2  ARG  29          2HH2      ARG  29  -6.869   9.986  -9.049
  224    H    GLU  30           H        GLU  30  -9.592   3.204  -3.931
  225    HA   GLU  30           HA       GLU  30 -11.872   2.518  -5.474
  226   1HB   GLU  30          1HB       GLU  30 -10.252   0.884  -3.515
  227   2HB   GLU  30          2HB       GLU  30 -11.519   0.201  -4.536
  228   1HG   GLU  30          1HG       GLU  30 -10.344   0.989  -6.549
  229   2HG   GLU  30          2HG       GLU  30  -9.072   1.685  -5.543
  230    H    LEU  31           H        LEU  31 -11.469   2.636  -1.947
  231    HA   LEU  31           HA       LEU  31 -13.986   1.505  -1.235
  232   1HB   LEU  31          1HB       LEU  31 -12.724   3.793   0.293
  233   2HB   LEU  31          2HB       LEU  31 -13.641   2.423   0.922
  234    HG   LEU  31           HG       LEU  31 -10.874   2.355  -0.298
  235   1HD1  LEU  31          1HD1      LEU  31 -11.991   1.912   2.481
  236   2HD1  LEU  31          2HD1      LEU  31 -10.383   1.375   2.012
  237   3HD1  LEU  31          3HD1      LEU  31 -10.781   3.091   1.977
  238   1HD2  LEU  31          1HD2      LEU  31 -12.762   0.132   0.544
  239   2HD2  LEU  31          2HD2      LEU  31 -11.977   0.341  -1.023
  240   3HD2  LEU  31          3HD2      LEU  31 -11.022  -0.113   0.388
  241    H    ASP  32           H        ASP  32 -13.063   4.758  -2.180
  242    HA   ASP  32           HA       ASP  32 -15.448   6.119  -1.476
  243   1HB   ASP  32          1HB       ASP  32 -13.356   7.230  -2.172
  244   2HB   ASP  32          2HB       ASP  32 -13.569   6.602  -3.803
  245    H    LYS  33           H        LYS  33 -14.590   4.401  -4.512
  246    HA   LYS  33           HA       LYS  33 -17.000   5.028  -5.898
  247   1HB   LYS  33          1HB       LYS  33 -15.168   2.626  -6.087
  248   2HB   LYS  33          2HB       LYS  33 -16.519   2.899  -7.187
  249   1HG   LYS  33          1HG       LYS  33 -15.557   5.099  -7.807
  250   2HG   LYS  33          2HG       LYS  33 -14.186   4.788  -6.744
  251   1HD   LYS  33          1HD       LYS  33 -14.907   2.820  -8.916
  252   2HD   LYS  33          2HD       LYS  33 -13.947   4.249  -9.293
  253   1HE   LYS  33          1HE       LYS  33 -12.336   3.575  -7.497
  254   2HE   LYS  33          2HE       LYS  33 -13.261   2.088  -7.281
  255   1HZ   LYS  33          1HZ       LYS  33 -12.638   2.568 -10.019
  256   2HZ   LYS  33          2HZ       LYS  33 -11.233   2.490  -9.066
  257   3HZ   LYS  33          3HZ       LYS  33 -12.335   1.197  -9.069
  258    H    TYR  34           H        TYR  34 -16.190   2.181  -3.892
  259    HA   TYR  34           HA       TYR  34 -18.839   1.051  -4.085
  260   1HB   TYR  34          1HB       TYR  34 -16.578   0.591  -2.121
  261   2HB   TYR  34          2HB       TYR  34 -18.071  -0.352  -2.137
  262    HD1  TYR  34           HD1      TYR  34 -18.731  -1.552  -4.303
  263    HD2  TYR  34           HD2      TYR  34 -14.822   0.094  -3.634
  264    HE1  TYR  34           HE1      TYR  34 -17.821  -2.951  -6.139
  265    HE2  TYR  34           HE2      TYR  34 -13.915  -1.295  -5.470
  266    HH   TYR  34           HH       TYR  34 -15.214  -2.446  -7.723
  267    H    GLY  35           H        GLY  35 -17.224   3.139  -1.706
  268   1HA   GLY  35          1HA       GLY  35 -19.846   4.085  -0.772
  269   2HA   GLY  35          2HA       GLY  35 -18.275   4.706  -0.263
  270    H    VAL  36           H        VAL  36 -17.260   1.990   0.383
  271    HA   VAL  36           HA       VAL  36 -18.984   0.771   2.340
  272    HB   VAL  36           HB       VAL  36 -16.815  -0.306   3.112
  273   1HG1  VAL  36          1HG1      VAL  36 -18.283  -1.321   1.401
  274   2HG1  VAL  36          2HG1      VAL  36 -17.455  -0.397   0.149
  275   3HG1  VAL  36          3HG1      VAL  36 -16.584  -1.637   1.050
  276   1HG2  VAL  36          1HG2      VAL  36 -15.455   1.724   2.302
  277   2HG2  VAL  36          2HG2      VAL  36 -14.799   0.131   1.925
  278   3HG2  VAL  36          3HG2      VAL  36 -15.642   1.055   0.681
  279    H    SER  37           H        SER  37 -17.537   0.538   4.669
  280    HA   SER  37           HA       SER  37 -18.076   3.067   5.953
  281   1HB   SER  37          1HB       SER  37 -17.305   2.005   7.975
  282   2HB   SER  37          2HB       SER  37 -18.202   0.797   7.060
  283    HG   SER  37           HG       SER  37 -16.336  -0.198   7.581
  284    H    ASP  38           H        ASP  38 -16.570   4.538   6.869
  285    HA   ASP  38           HA       ASP  38 -14.152   4.927   5.317
  286   1HB   ASP  38          1HB       ASP  38 -15.260   6.310   7.772
  287   2HB   ASP  38          2HB       ASP  38 -13.774   6.814   6.966
  288    H    TYR  39           H        TYR  39 -14.892   3.160   8.163
  289    HA   TYR  39           HA       TYR  39 -12.455   3.363   9.605
  290   1HB   TYR  39          1HB       TYR  39 -14.381   2.273  10.589
  291   2HB   TYR  39          2HB       TYR  39 -14.389   1.046   9.321
  292    HD1  TYR  39           HD1      TYR  39 -12.722  -0.714   9.252
  293    HD2  TYR  39           HD2      TYR  39 -12.677   2.248  12.359
  294    HE1  TYR  39           HE1      TYR  39 -11.132  -2.099  10.542
  295    HE2  TYR  39           HE2      TYR  39 -11.084   0.859  13.658
  296    HH   TYR  39           HH       TYR  39  -9.920  -2.270  12.391
  297    H    TYR  40           H        TYR  40 -13.362   1.113   6.988
  298    HA   TYR  40           HA       TYR  40 -11.003  -0.452   7.026
  299   1HB   TYR  40          1HB       TYR  40 -12.757   0.275   4.663
  300   2HB   TYR  40          2HB       TYR  40 -11.584  -1.042   4.693
  301    HD1  TYR  40           HD1      TYR  40 -11.826  -2.634   6.868
  302    HD2  TYR  40           HD2      TYR  40 -14.982  -0.292   5.124
  303    HE1  TYR  40           HE1      TYR  40 -13.511  -4.126   7.906
  304    HE2  TYR  40           HE2      TYR  40 -16.664  -1.788   6.164
  305    HH   TYR  40           HH       TYR  40 -15.727  -4.305   8.442
  306    H    LYS  41           H        LYS  41 -11.499   2.787   5.723
  307    HA   LYS  41           HA       LYS  41  -9.216   2.723   3.966
  308   1HB   LYS  41          1HB       LYS  41  -9.715   4.933   3.495
  309   2HB   LYS  41          2HB       LYS  41 -11.252   4.465   4.211
  310   1HG   LYS  41          1HG       LYS  41 -10.276   5.278   6.449
  311   2HG   LYS  41          2HG       LYS  41  -8.987   6.005   5.500
  312   1HD   LYS  41          1HD       LYS  41 -11.927   6.544   4.997
  313   2HD   LYS  41          2HD       LYS  41 -10.920   7.554   6.032
  314   1HE   LYS  41          1HE       LYS  41  -9.338   7.797   4.048
  315   2HE   LYS  41          2HE       LYS  41 -10.599   7.053   3.065
  316   1HZ   LYS  41          1HZ       LYS  41 -12.044   8.875   4.269
  317   2HZ   LYS  41          2HZ       LYS  41 -10.547   9.674   4.354
  318   3HZ   LYS  41          3HZ       LYS  41 -11.179   9.220   2.847
  319    H    ASN  42           H        ASN  42  -9.686   3.587   7.355
  320    HA   ASN  42           HA       ASN  42  -7.020   4.562   7.782
  321   1HB   ASN  42          1HB       ASN  42  -9.098   3.439   9.677
  322   2HB   ASN  42          2HB       ASN  42  -7.555   4.100  10.218
  323   2HD2  ASN  42          2HD2      ASN  42  -8.155   5.925   7.566
  324   1HD2  ASN  42          1HD2      ASN  42  -9.045   7.192   8.261
  325    H    LEU  43           H        LEU  43  -8.527   1.373   8.096
  326    HA   LEU  43           HA       LEU  43  -6.317   0.050   9.285
  327   1HB   LEU  43          1HB       LEU  43  -8.554  -0.963   9.115
  328   2HB   LEU  43          2HB       LEU  43  -8.392  -1.048   7.363
  329    HG   LEU  43           HG       LEU  43  -6.487  -2.579   7.587
  330   1HD1  LEU  43          1HD1      LEU  43  -6.846  -1.956  10.514
  331   2HD1  LEU  43          2HD1      LEU  43  -6.198  -3.526  10.037
  332   3HD1  LEU  43          3HD1      LEU  43  -5.361  -2.049   9.567
  333   1HD2  LEU  43          1HD2      LEU  43  -8.990  -3.320   7.736
  334   2HD2  LEU  43          2HD2      LEU  43  -7.742  -4.491   8.159
  335   3HD2  LEU  43          3HD2      LEU  43  -8.629  -3.648   9.429
  336    H    ILE  44           H        ILE  44  -7.061   0.703   5.855
  337    HA   ILE  44           HA       ILE  44  -4.908  -0.818   4.752
  338    HB   ILE  44           HB       ILE  44  -6.205   1.736   3.748
  339   1HG1  ILE  44          1HG1      ILE  44  -6.573  -1.144   2.888
  340   2HG1  ILE  44          2HG1      ILE  44  -7.618  -0.337   4.059
  341   1HG2  ILE  44          1HG2      ILE  44  -4.289  -0.206   2.428
  342   2HG2  ILE  44          2HG2      ILE  44  -5.276   0.945   1.528
  343   3HG2  ILE  44          3HG2      ILE  44  -4.059   1.525   2.663
  344   1HD1  ILE  44          1HD1      ILE  44  -8.072   1.431   2.335
  345   2HD1  ILE  44          2HD1      ILE  44  -7.172   0.458   1.173
  346   3HD1  ILE  44          3HD1      ILE  44  -8.657  -0.172   1.881
  347    H    ASN  45           H        ASN  45  -5.071   2.512   5.958
  348    HA   ASN  45           HA       ASN  45  -2.422   3.286   5.268
  349   1HB   ASN  45          1HB       ASN  45  -4.237   4.141   7.543
  350   2HB   ASN  45          2HB       ASN  45  -2.683   4.908   7.203
  351   2HD2  ASN  45          2HD2      ASN  45  -2.578   5.184   4.500
  352   1HD2  ASN  45          1HD2      ASN  45  -3.907   6.056   3.905
  353    H    ASN  46           H        ASN  46  -3.730   1.463   7.992
  354    HA   ASN  46           HA       ASN  46  -1.276   1.421   9.521
  355   1HB   ASN  46          1HB       ASN  46  -3.725  -0.361   9.535
  356   2HB   ASN  46          2HB       ASN  46  -2.390  -0.543  10.672
  357   2HD2  ASN  46          2HD2      ASN  46  -5.073   0.182  11.497
  358   1HD2  ASN  46          1HD2      ASN  46  -5.006   1.756  12.132
  359    H    ALA  47           H        ALA  47  -2.372  -0.311   6.727
  360    HA   ALA  47           HA       ALA  47  -0.938  -2.745   7.009
  361   1HB   ALA  47          1HB       ALA  47  -2.586  -2.140   5.168
  362   2HB   ALA  47          2HB       ALA  47  -1.130  -2.974   4.627
  363   3HB   ALA  47          3HB       ALA  47  -1.280  -1.231   4.408
  364    H    LYS  48           H        LYS  48   1.212  -3.191   6.970
  365    HA   LYS  48           HA       LYS  48   3.104  -0.952   6.415
  366   1HB   LYS  48          1HB       LYS  48   3.518  -3.642   7.759
  367   2HB   LYS  48          2HB       LYS  48   4.745  -2.385   7.593
  368   1HG   LYS  48          1HG       LYS  48   3.329  -0.827   8.880
  369   2HG   LYS  48          2HG       LYS  48   2.103  -2.082   9.051
  370   1HD   LYS  48          1HD       LYS  48   3.720  -3.507  10.252
  371   2HD   LYS  48          2HD       LYS  48   4.949  -2.251  10.086
  372   1HE   LYS  48          1HE       LYS  48   3.623  -0.705  11.414
  373   2HE   LYS  48          2HE       LYS  48   2.284  -1.852  11.477
  374   1HZ   LYS  48          1HZ       LYS  48   4.997  -2.311  12.598
  375   2HZ   LYS  48          2HZ       LYS  48   3.614  -1.905  13.499
  376   3HZ   LYS  48          3HZ       LYS  48   3.691  -3.391  12.679
  377    H    THR  49           H        THR  49   1.745  -3.487   4.744
  378    HA   THR  49           HA       THR  49   4.080  -3.597   2.882
  379    HB   THR  49           HB       THR  49   3.806  -6.027   2.629
  380    HG1  THR  49           HG1      THR  49   1.996  -6.822   3.283
  381   1HG2  THR  49          1HG2      THR  49   5.351  -5.053   4.365
  382   2HG2  THR  49          2HG2      THR  49   4.076  -5.306   5.557
  383   3HG2  THR  49          3HG2      THR  49   4.795  -6.686   4.728
  384    H    VAL  50           H        VAL  50   3.467  -4.257   0.708
  385    HA   VAL  50           HA       VAL  50   0.942  -3.129  -0.129
  386    HB   VAL  50           HB       VAL  50   1.587  -3.909  -2.377
  387   1HG1  VAL  50          1HG1      VAL  50   2.590  -1.839  -1.458
  388   2HG1  VAL  50          2HG1      VAL  50   3.932  -2.786  -0.815
  389   3HG1  VAL  50          3HG1      VAL  50   3.694  -2.663  -2.557
  390   1HG2  VAL  50          1HG2      VAL  50   3.703  -5.396  -0.804
  391   2HG2  VAL  50          2HG2      VAL  50   2.529  -6.062  -1.939
  392   3HG2  VAL  50          3HG2      VAL  50   3.863  -5.073  -2.530
  393    H    GLU  51           H        GLU  51   2.112  -6.425   0.408
  394    HA   GLU  51           HA       GLU  51  -0.034  -7.821  -0.832
  395   1HB   GLU  51          1HB       GLU  51   1.697  -8.529   1.556
  396   2HB   GLU  51          2HB       GLU  51   0.555  -9.654   0.818
  397   1HG   GLU  51          1HG       GLU  51   1.713  -9.424  -1.345
  398   2HG   GLU  51          2HG       GLU  51   2.854  -8.293  -0.619
  399    H    GLY  52           H        GLY  52   0.305  -6.468   2.426
  400   1HA   GLY  52          1HA       GLY  52  -1.305  -6.083   4.089
  401   2HA   GLY  52          2HA       GLY  52  -2.169  -7.486   3.456
  402    H    VAL  53           H        VAL  53  -1.333  -4.491   1.721
  403    HA   VAL  53           HA       VAL  53  -3.857  -3.197   1.973
  404    HB   VAL  53           HB       VAL  53  -1.791  -3.095  -0.246
  405   1HG1  VAL  53          1HG1      VAL  53  -4.322  -1.516   0.208
  406   2HG1  VAL  53          2HG1      VAL  53  -2.965  -0.828  -0.684
  407   3HG1  VAL  53          3HG1      VAL  53  -3.757  -2.289  -1.273
  408   1HG2  VAL  53          1HG2      VAL  53  -2.312  -1.479   2.255
  409   2HG2  VAL  53          2HG2      VAL  53  -0.812  -2.244   1.734
  410   3HG2  VAL  53          3HG2      VAL  53  -1.402  -0.805   0.903
  411    H    LYS  54           H        LYS  54  -2.630  -5.316  -0.632
  412    HA   LYS  54           HA       LYS  54  -5.117  -5.338  -2.090
  413   1HB   LYS  54          1HB       LYS  54  -2.721  -7.190  -2.118
  414   2HB   LYS  54          2HB       LYS  54  -4.087  -7.358  -3.221
  415   1HG   LYS  54          1HG       LYS  54  -3.714  -5.062  -4.039
  416   2HG   LYS  54          2HG       LYS  54  -2.345  -4.892  -2.940
  417   1HD   LYS  54          1HD       LYS  54  -1.207  -6.774  -4.061
  418   2HD   LYS  54          2HD       LYS  54  -2.573  -6.941  -5.165
  419   1HE   LYS  54          1HE       LYS  54  -0.801  -5.637  -6.238
  420   2HE   LYS  54          2HE       LYS  54  -2.203  -4.608  -5.940
  421   1HZ   LYS  54          1HZ       LYS  54  -0.717  -4.436  -3.652
  422   2HZ   LYS  54          2HZ       LYS  54   0.443  -4.410  -4.889
  423   3HZ   LYS  54          3HZ       LYS  54  -0.812  -3.265  -4.880
  424    H    ALA  55           H        ALA  55  -3.690  -7.512   0.325
  425    HA   ALA  55           HA       ALA  55  -5.642  -9.575   0.141
  426   1HB   ALA  55          1HB       ALA  55  -4.219  -8.740   2.677
  427   2HB   ALA  55          2HB       ALA  55  -4.803 -10.348   2.247
  428   3HB   ALA  55          3HB       ALA  55  -3.427  -9.652   1.391
  429    H    LEU  56           H        LEU  56  -5.954  -6.372   1.337
  430    HA   LEU  56           HA       LEU  56  -8.101  -7.026   3.212
  431   1HB   LEU  56          1HB       LEU  56  -6.536  -5.108   3.587
  432   2HB   LEU  56          2HB       LEU  56  -7.230  -4.316   2.177
  433    HG   LEU  56           HG       LEU  56  -9.495  -4.492   3.296
  434   1HD1  LEU  56          1HD1      LEU  56  -7.749  -5.564   5.509
  435   2HD1  LEU  56          2HD1      LEU  56  -9.225  -4.684   5.892
  436   3HD1  LEU  56          3HD1      LEU  56  -9.308  -6.158   4.939
  437   1HD2  LEU  56          1HD2      LEU  56  -7.225  -2.877   4.461
  438   2HD2  LEU  56          2HD2      LEU  56  -8.501  -2.362   3.358
  439   3HD2  LEU  56          3HD2      LEU  56  -8.878  -2.684   5.049
  440    H    ILE  57           H        ILE  57  -8.081  -4.736   0.477
  441    HA   ILE  57           HA       ILE  57 -10.793  -4.475   0.081
  442    HB   ILE  57           HB       ILE  57  -8.568  -4.578  -1.957
  443   1HG1  ILE  57          1HG1      ILE  57  -9.083  -2.110  -2.033
  444   2HG1  ILE  57          2HG1      ILE  57 -10.228  -2.359  -0.719
  445   1HG2  ILE  57          1HG2      ILE  57 -11.509  -4.093  -2.374
  446   2HG2  ILE  57          2HG2      ILE  57 -10.301  -3.413  -3.464
  447   3HG2  ILE  57          3HG2      ILE  57 -10.439  -5.162  -3.277
  448   1HD1  ILE  57          1HD1      ILE  57  -7.356  -3.249  -0.463
  449   2HD1  ILE  57          2HD1      ILE  57  -7.834  -1.590  -0.105
  450   3HD1  ILE  57          3HD1      ILE  57  -8.528  -2.920   0.816
  451    H    ASP  58           H        ASP  58  -8.796  -7.155  -1.225
  452    HA   ASP  58           HA       ASP  58 -10.953  -8.351  -2.671
  453   1HB   ASP  58          1HB       ASP  58  -9.664 -10.451  -2.547
  454   2HB   ASP  58          2HB       ASP  58  -8.608  -9.095  -2.945
  455    H    GLU  59           H        GLU  59  -9.952  -8.592   0.724
  456    HA   GLU  59           HA       GLU  59 -11.912 -10.589   1.418
  457   1HB   GLU  59          1HB       GLU  59 -10.357  -8.607   3.093
  458   2HB   GLU  59          2HB       GLU  59 -11.451  -9.806   3.779
  459   1HG   GLU  59          1HG       GLU  59  -9.162 -10.520   1.933
  460   2HG   GLU  59          2HG       GLU  59  -9.020 -10.520   3.693
  461    H    ILE  60           H        ILE  60 -11.866  -7.039   1.507
  462    HA   ILE  60           HA       ILE  60 -14.432  -6.845   2.794
  463    HB   ILE  60           HB       ILE  60 -13.352  -4.727   0.930
  464   1HG1  ILE  60          1HG1      ILE  60 -11.394  -5.254   2.154
  465   2HG1  ILE  60          2HG1      ILE  60 -12.084  -3.875   2.986
  466   1HG2  ILE  60          1HG2      ILE  60 -15.588  -4.579   2.198
  467   2HG2  ILE  60          2HG2      ILE  60 -14.610  -4.409   3.657
  468   3HG2  ILE  60          3HG2      ILE  60 -14.479  -3.217   2.364
  469   1HD1  ILE  60          1HD1      ILE  60 -13.255  -5.718   4.452
  470   2HD1  ILE  60          2HD1      ILE  60 -11.958  -6.745   3.838
  471   3HD1  ILE  60          3HD1      ILE  60 -11.571  -5.293   4.752
  472    H    LEU  61           H        LEU  61 -13.410  -6.458  -0.592
  473    HA   LEU  61           HA       LEU  61 -16.095  -6.254  -1.604
  474   1HB   LEU  61          1HB       LEU  61 -13.435  -6.824  -2.939
  475   2HB   LEU  61          2HB       LEU  61 -14.946  -6.665  -3.841
  476    HG   LEU  61           HG       LEU  61 -13.767  -4.549  -2.010
  477   1HD1  LEU  61          1HD1      LEU  61 -12.566  -5.068  -4.226
  478   2HD1  LEU  61          2HD1      LEU  61 -14.011  -4.448  -5.023
  479   3HD1  LEU  61          3HD1      LEU  61 -13.064  -3.396  -3.972
  480   1HD2  LEU  61          1HD2      LEU  61 -16.340  -4.772  -3.543
  481   2HD2  LEU  61          2HD2      LEU  61 -16.020  -3.989  -1.996
  482   3HD2  LEU  61          3HD2      LEU  61 -15.555  -3.194  -3.492
  483    H    ALA  62           H        ALA  62 -13.980  -9.007  -0.996
  484    HA   ALA  62           HA       ALA  62 -15.330 -10.908  -2.635
  485   1HB   ALA  62          1HB       ALA  62 -13.806 -11.185  -0.039
  486   2HB   ALA  62          2HB       ALA  62 -14.532 -12.579  -0.838
  487   3HB   ALA  62          3HB       ALA  62 -13.291 -11.640  -1.665
  488    H    ALA  63           H        ALA  63 -16.028  -9.757   0.655
  489    HA   ALA  63           HA       ALA  63 -18.102 -11.606   1.263
  490   1HB   ALA  63          1HB       ALA  63 -17.039  -9.960   2.863
  491   2HB   ALA  63          2HB       ALA  63 -18.011  -8.698   2.107
  492   3HB   ALA  63          3HB       ALA  63 -18.798 -10.030   2.954
  493    H    LEU  64           H        LEU  64 -18.189  -8.500  -0.475
  494    HA   LEU  64           HA       LEU  64 -21.063  -8.522  -0.792
  495   1HB   LEU  64          1HB       LEU  64 -19.022  -7.092  -2.519
  496   2HB   LEU  64          2HB       LEU  64 -20.714  -6.654  -2.303
  497    HG   LEU  64           HG       LEU  64 -18.542  -6.570  -0.191
  498   1HD1  LEU  64          1HD1      LEU  64 -18.627  -4.728  -1.918
  499   2HD1  LEU  64          2HD1      LEU  64 -20.250  -4.348  -1.344
  500   3HD1  LEU  64          3HD1      LEU  64 -18.869  -4.178  -0.261
  501   1HD2  LEU  64          1HD2      LEU  64 -21.545  -6.269  -0.033
  502   2HD2  LEU  64          2HD2      LEU  64 -20.472  -7.194   1.018
  503   3HD2  LEU  64          3HD2      LEU  64 -20.499  -5.434   1.116
  504    HA   PRO  65           HA       PRO  65 -21.574 -11.542  -4.037
  505   1HB   PRO  65          1HB       PRO  65 -22.955  -9.529  -5.719
  506   2HB   PRO  65          2HB       PRO  65 -23.567 -11.053  -5.064
  507   1HG   PRO  65          1HG       PRO  65 -24.193  -8.475  -4.112
  508   2HG   PRO  65          2HG       PRO  65 -24.523  -9.998  -3.279
  509   1HD   PRO  65          1HD       PRO  65 -22.618  -7.940  -2.528
  510   2HD   PRO  65          2HD       PRO  65 -22.985  -9.456  -1.673

  No H/Q in entry =         510
  Start of MODEL   28
    1    H1   MET   1           H1       MET   1  34.194 -18.568  -0.148
    2    H2   MET   1           H2       MET   1  34.154 -20.184  -0.670
    3    H3   MET   1           H3       MET   1  34.596 -18.949  -1.750
    4    HA   MET   1           HA       MET   1  32.382 -19.549  -2.278
    5   1HB   MET   1          1HB       MET   1  30.637 -19.294  -0.415
    6   2HB   MET   1          2HB       MET   1  31.691 -20.704  -0.310
    7   1HG   MET   1          1HG       MET   1  32.406 -18.121   1.083
    8   2HG   MET   1          2HG       MET   1  31.338 -19.301   1.841
    9   1HE   MET   1          1HE       MET   1  33.189 -19.153   3.765
   10   2HE   MET   1          2HE       MET   1  34.880 -19.633   3.556
   11   3HE   MET   1          3HE       MET   1  34.272 -18.175   2.778
   12    H    LYS   2           H        LYS   2  34.117 -17.022  -1.129
   13    HA   LYS   2           HA       LYS   2  32.236 -14.912  -0.801
   14   1HB   LYS   2          1HB       LYS   2  34.641 -14.675  -0.278
   15   2HB   LYS   2          2HB       LYS   2  35.020 -14.795  -1.995
   16   1HG   LYS   2          1HG       LYS   2  33.851 -12.749  -2.480
   17   2HG   LYS   2          2HG       LYS   2  33.180 -12.682  -0.850
   18   1HD   LYS   2          1HD       LYS   2  35.045 -11.131  -0.975
   19   2HD   LYS   2          2HD       LYS   2  35.514 -12.490   0.045
   20   1HE   LYS   2          1HE       LYS   2  36.877 -13.437  -1.646
   21   2HE   LYS   2          2HE       LYS   2  36.133 -12.459  -2.911
   22   1HZ   LYS   2          1HZ       LYS   2  37.488 -11.112  -0.685
   23   2HZ   LYS   2          2HZ       LYS   2  38.433 -11.809  -1.913
   24   3HZ   LYS   2          3HZ       LYS   2  37.298 -10.610  -2.297
   25    H    ALA   3           H        ALA   3  33.904 -16.072  -3.735
   26    HA   ALA   3           HA       ALA   3  31.664 -15.541  -5.446
   27   1HB   ALA   3          1HB       ALA   3  32.176 -13.194  -5.132
   28   2HB   ALA   3          2HB       ALA   3  33.890 -13.481  -5.432
   29   3HB   ALA   3          3HB       ALA   3  32.724 -13.651  -6.744
   30    H    ILE   4           H        ILE   4  32.133 -17.477  -6.494
   31    HA   ILE   4           HA       ILE   4  34.755 -18.396  -7.130
   32    HB   ILE   4           HB       ILE   4  32.112 -19.015  -8.488
   33   1HG1  ILE   4          1HG1      ILE   4  32.748 -21.257  -7.075
   34   2HG1  ILE   4          2HG1      ILE   4  33.528 -20.060  -6.047
   35   1HG2  ILE   4          1HG2      ILE   4  34.868 -20.230  -8.731
   36   2HG2  ILE   4          2HG2      ILE   4  33.410 -21.118  -9.173
   37   3HG2  ILE   4          3HG2      ILE   4  33.824 -19.627 -10.018
   38   1HD1  ILE   4          1HD1      ILE   4  30.632 -19.874  -6.940
   39   2HD1  ILE   4          2HD1      ILE   4  31.145 -20.591  -5.415
   40   3HD1  ILE   4          3HD1      ILE   4  31.438 -18.883  -5.725
   41    H    PHE   5           H        PHE   5  32.348 -16.722  -9.182
   42    HA   PHE   5           HA       PHE   5  34.363 -15.186 -10.547
   43   1HB   PHE   5          1HB       PHE   5  34.810 -17.428 -11.567
   44   2HB   PHE   5          2HB       PHE   5  33.146 -17.456 -12.152
   45    HD1  PHE   5           HD1      PHE   5  32.397 -15.924 -13.912
   46    HD2  PHE   5           HD2      PHE   5  36.460 -15.900 -12.518
   47    HE1  PHE   5           HE1      PHE   5  33.066 -14.581 -15.886
   48    HE2  PHE   5           HE2      PHE   5  37.129 -14.554 -14.492
   49    HZ   PHE   5           HZ       PHE   5  35.431 -13.895 -16.175
   50    H    VAL   6           H        VAL   6  31.155 -16.116  -9.910
   51    HA   VAL   6           HA       VAL   6  30.006 -14.295 -11.967
   52    HB   VAL   6           HB       VAL   6  28.605 -16.025  -9.905
   53   1HG1  VAL   6          1HG1      VAL   6  27.666 -14.477 -12.332
   54   2HG1  VAL   6          2HG1      VAL   6  26.689 -15.714 -11.540
   55   3HG1  VAL   6          3HG1      VAL   6  27.156 -14.261 -10.658
   56   1HG2  VAL   6          1HG2      VAL   6  29.203 -16.531 -12.838
   57   2HG2  VAL   6          2HG2      VAL   6  29.925 -17.388 -11.476
   58   3HG2  VAL   6          3HG2      VAL   6  28.201 -17.559 -11.813
   59    H    LEU   7           H        LEU   7  29.750 -12.196 -11.421
   60    HA   LEU   7           HA       LEU   7  29.212 -11.493  -8.549
   61   1HB   LEU   7          1HB       LEU   7  31.440 -10.727  -9.298
   62   2HB   LEU   7          2HB       LEU   7  30.694  -9.879 -10.650
   63    HG   LEU   7           HG       LEU   7  29.418  -8.471  -9.047
   64   1HD1  LEU   7          1HD1      LEU   7  30.797 -10.269  -7.065
   65   2HD1  LEU   7          2HD1      LEU   7  30.425  -8.607  -6.608
   66   3HD1  LEU   7          3HD1      LEU   7  29.128  -9.700  -7.083
   67   1HD2  LEU   7          1HD2      LEU   7  31.720  -7.860  -9.905
   68   2HD2  LEU   7          2HD2      LEU   7  31.275  -7.095  -8.380
   69   3HD2  LEU   7          3HD2      LEU   7  32.374  -8.475  -8.389
   70    H    ASN   8           H        ASN   8  28.655 -10.542 -11.946
   71    HA   ASN   8           HA       ASN   8  26.532  -8.682 -11.219
   72   1HB   ASN   8          1HB       ASN   8  27.325  -9.888 -13.888
   73   2HB   ASN   8          2HB       ASN   8  26.112  -8.625 -13.686
   74   2HD2  ASN   8          2HD2      ASN   8  27.169  -6.796 -12.004
   75   1HD2  ASN   8          1HD2      ASN   8  28.678  -6.231 -12.540
   76    H    ALA   9           H        ALA   9  24.266  -8.988 -11.766
   77    HA   ALA   9           HA       ALA   9  23.412 -11.865 -11.949
   78   1HB   ALA   9          1HB       ALA   9  22.210  -9.633 -10.284
   79   2HB   ALA   9          2HB       ALA   9  21.477 -11.221 -10.505
   80   3HB   ALA   9          3HB       ALA   9  23.025 -11.073  -9.675
   81    H    GLN  10           H        GLN  10  22.025 -12.248 -13.611
   82    HA   GLN  10           HA       GLN  10  21.070  -9.948 -15.214
   83   1HB   GLN  10          1HB       GLN  10  21.003 -12.947 -15.655
   84   2HB   GLN  10          2HB       GLN  10  20.282 -11.787 -16.770
   85   1HG   GLN  10          1HG       GLN  10  22.468 -12.228 -17.623
   86   2HG   GLN  10          2HG       GLN  10  22.575 -10.649 -16.846
   87   2HE2  GLN  10          2HE2      GLN  10  23.677 -13.971 -16.702
   88   1HE2  GLN  10          1HE2      GLN  10  24.717 -13.773 -15.374
   89    H    HIS  11           H        HIS  11  19.949 -11.570 -12.572
   90    HA   HIS  11           HA       HIS  11  17.244 -12.189 -13.205
   91   1HB   HIS  11          1HB       HIS  11  18.373 -12.814 -11.070
   92   2HB   HIS  11          2HB       HIS  11  18.329 -11.121 -10.581
   93    HD1  HIS  11           HD1      HIS  11  15.831 -13.750 -11.793
   94    HD2  HIS  11           HD2      HIS  11  16.039 -10.514  -9.174
   95    HE1  HIS  11           HE1      HIS  11  13.585 -13.625 -10.628
   96    H    ASP  12           H        ASP  12  15.396 -10.912 -13.316
   97    HA   ASP  12           HA       ASP  12  15.650  -8.169 -14.015
   98   1HB   ASP  12          1HB       ASP  12  13.691  -9.689 -14.541
   99   2HB   ASP  12          2HB       ASP  12  13.165  -9.473 -12.870
  100    H    GLU  13           H        GLU  13  15.567  -6.302 -12.806
  101    HA   GLU  13           HA       GLU  13  15.299  -6.593  -9.825
  102   1HB   GLU  13          1HB       GLU  13  17.064  -4.771 -11.483
  103   2HB   GLU  13          2HB       GLU  13  16.817  -4.574  -9.747
  104   1HG   GLU  13          1HG       GLU  13  17.795  -7.150 -11.002
  105   2HG   GLU  13          2HG       GLU  13  18.877  -5.908 -10.373
  106    H    ALA  14           H        ALA  14  14.027  -5.065  -8.771
  107    HA   ALA  14           HA       ALA  14  12.699  -2.963 -10.445
  108   1HB   ALA  14          1HB       ALA  14  11.260  -5.050 -10.092
  109   2HB   ALA  14          2HB       ALA  14  11.240  -4.626  -8.381
  110   3HB   ALA  14          3HB       ALA  14  10.548  -3.523  -9.571
  111    H    VAL  15           H        VAL  15  11.855  -1.180  -9.161
  112    HA   VAL  15           HA       VAL  15  13.318  -0.827  -6.565
  113    HB   VAL  15           HB       VAL  15  12.260   1.250  -8.510
  114   1HG1  VAL  15          1HG1      VAL  15  13.882   1.485  -5.957
  115   2HG1  VAL  15          2HG1      VAL  15  13.604   2.809  -7.088
  116   3HG1  VAL  15          3HG1      VAL  15  12.246   2.089  -6.221
  117   1HG2  VAL  15          1HG2      VAL  15  15.031   0.167  -7.939
  118   2HG2  VAL  15          2HG2      VAL  15  14.170   0.150  -9.477
  119   3HG2  VAL  15          3HG2      VAL  15  14.749   1.676  -8.807
  120    H    ASP  16           H        ASP  16  12.090  -0.683  -4.761
  121    HA   ASP  16           HA       ASP  16   9.170  -0.017  -5.042
  122   1HB   ASP  16          1HB       ASP  16   9.573  -2.419  -4.499
  123   2HB   ASP  16          2HB       ASP  16  10.442  -1.916  -3.048
  124    H    ALA  17           H        ALA  17   8.505   1.662  -3.796
  125    HA   ALA  17           HA       ALA  17   9.574   2.269  -1.199
  126   1HB   ALA  17          1HB       ALA  17  11.529   3.060  -2.394
  127   2HB   ALA  17          2HB       ALA  17  10.629   4.470  -1.833
  128   3HB   ALA  17          3HB       ALA  17  10.525   3.972  -3.522
  129    H    ASN  18           H        ASN  18   8.643   4.514  -3.805
  130    HA   ASN  18           HA       ASN  18   6.555   5.679  -2.154
  131   1HB   ASN  18          1HB       ASN  18   7.762   7.040  -3.805
  132   2HB   ASN  18          2HB       ASN  18   7.159   6.014  -5.108
  133   2HD2  ASN  18          2HD2      ASN  18   5.765   7.502  -6.170
  134   1HD2  ASN  18          1HD2      ASN  18   4.436   8.241  -5.414
  135    H    SER  19           H        SER  19   6.725   2.911  -4.102
  136    HA   SER  19           HA       SER  19   4.145   2.842  -5.292
  137   1HB   SER  19          1HB       SER  19   4.458   0.456  -5.467
  138   2HB   SER  19          2HB       SER  19   6.029   1.214  -5.712
  139    HG   SER  19           HG       SER  19   5.508  -0.636  -4.013
  140    H    LEU  20           H        LEU  20   5.210   1.996  -2.002
  141    HA   LEU  20           HA       LEU  20   2.776   0.790  -1.141
  142   1HB   LEU  20          1HB       LEU  20   4.881   2.380   0.345
  143   2HB   LEU  20          2HB       LEU  20   3.508   1.646   1.168
  144    HG   LEU  20           HG       LEU  20   5.289  -0.005  -0.632
  145   1HD1  LEU  20          1HD1      LEU  20   5.737   0.787   2.255
  146   2HD1  LEU  20          2HD1      LEU  20   6.450  -0.668   1.557
  147   3HD1  LEU  20          3HD1      LEU  20   6.867   0.917   0.907
  148   1HD2  LEU  20          1HD2      LEU  20   3.462  -0.593   1.725
  149   2HD2  LEU  20          2HD2      LEU  20   3.230  -1.096   0.053
  150   3HD2  LEU  20          3HD2      LEU  20   4.537  -1.789   1.006
  151    H    ALA  21           H        ALA  21   3.845   4.193  -0.907
  152    HA   ALA  21           HA       ALA  21   1.460   5.180   0.251
  153   1HB   ALA  21          1HB       ALA  21   3.270   6.667  -1.668
  154   2HB   ALA  21          2HB       ALA  21   3.625   6.442   0.044
  155   3HB   ALA  21          3HB       ALA  21   2.211   7.375  -0.448
  156    H    GLU  22           H        GLU  22   2.420   5.045  -3.195
  157    HA   GLU  22           HA       GLU  22  -0.018   6.125  -4.207
  158   1HB   GLU  22          1HB       GLU  22   2.040   5.866  -5.571
  159   2HB   GLU  22          2HB       GLU  22   1.845   4.115  -5.513
  160   1HG   GLU  22          1HG       GLU  22  -0.326   4.308  -6.655
  161   2HG   GLU  22          2HG       GLU  22  -0.152   6.062  -6.706
  162    H    ALA  23           H        ALA  23   0.946   2.787  -3.462
  163    HA   ALA  23           HA       ALA  23  -1.371   1.503  -4.506
  164   1HB   ALA  23          1HB       ALA  23  -0.804  -0.252  -2.692
  165   2HB   ALA  23          2HB       ALA  23   0.429   0.086  -3.906
  166   3HB   ALA  23          3HB       ALA  23   0.561   0.794  -2.298
  167    H    LYS  24           H        LYS  24  -0.704   2.766  -1.227
  168    HA   LYS  24           HA       LYS  24  -3.301   2.055  -0.191
  169   1HB   LYS  24          1HB       LYS  24  -1.322   4.170   0.721
  170   2HB   LYS  24          2HB       LYS  24  -2.730   3.641   1.643
  171   1HG   LYS  24          1HG       LYS  24  -1.847   1.336   1.681
  172   2HG   LYS  24          2HG       LYS  24  -0.436   1.859   0.761
  173   1HD   LYS  24          1HD       LYS  24  -0.056   3.568   2.657
  174   2HD   LYS  24          2HD       LYS  24  -1.211   2.610   3.581
  175   1HE   LYS  24          1HE       LYS  24   1.405   1.647   2.393
  176   2HE   LYS  24          2HE       LYS  24   1.020   1.819   4.105
  177   1HZ   LYS  24          1HZ       LYS  24  -0.809   0.171   2.580
  178   2HZ   LYS  24          2HZ       LYS  24   0.759  -0.456   2.738
  179   3HZ   LYS  24          3HZ       LYS  24  -0.147  -0.078   4.125
  180    H    VAL  25           H        VAL  25  -1.965   4.991  -1.686
  181    HA   VAL  25           HA       VAL  25  -4.276   6.628  -1.289
  182    HB   VAL  25           HB       VAL  25  -2.077   6.728  -3.356
  183   1HG1  VAL  25          1HG1      VAL  25  -4.414   8.577  -2.870
  184   2HG1  VAL  25          2HG1      VAL  25  -2.926   9.142  -3.629
  185   3HG1  VAL  25          3HG1      VAL  25  -3.880   7.873  -4.396
  186   1HG2  VAL  25          1HG2      VAL  25  -1.631   7.138  -0.855
  187   2HG2  VAL  25          2HG2      VAL  25  -1.121   8.408  -1.966
  188   3HG2  VAL  25          3HG2      VAL  25  -2.608   8.594  -1.037
  189    H    LEU  26           H        LEU  26  -3.258   4.696  -4.138
  190    HA   LEU  26           HA       LEU  26  -5.629   5.286  -5.658
  191   1HB   LEU  26          1HB       LEU  26  -3.697   2.955  -5.825
  192   2HB   LEU  26          2HB       LEU  26  -4.958   3.281  -7.011
  193    HG   LEU  26           HG       LEU  26  -2.682   5.155  -6.294
  194   1HD1  LEU  26          1HD1      LEU  26  -2.074   3.074  -7.576
  195   2HD1  LEU  26          2HD1      LEU  26  -3.191   3.586  -8.840
  196   3HD1  LEU  26          3HD1      LEU  26  -1.774   4.567  -8.467
  197   1HD2  LEU  26          1HD2      LEU  26  -5.116   5.413  -8.051
  198   2HD2  LEU  26          2HD2      LEU  26  -4.337   6.626  -7.034
  199   3HD2  LEU  26          3HD2      LEU  26  -3.617   6.181  -8.577
  200    H    ALA  27           H        ALA  27  -4.786   2.589  -3.494
  201    HA   ALA  27           HA       ALA  27  -7.140   1.050  -4.004
  202   1HB   ALA  27          1HB       ALA  27  -5.206   0.108  -2.823
  203   2HB   ALA  27          2HB       ALA  27  -5.452   1.237  -1.490
  204   3HB   ALA  27          3HB       ALA  27  -6.649  -0.019  -1.815
  205    H    ASN  28           H        ASN  28  -6.435   3.606  -1.656
  206    HA   ASN  28           HA       ASN  28  -8.867   3.490  -0.198
  207   1HB   ASN  28          1HB       ASN  28  -6.909   4.796   0.526
  208   2HB   ASN  28          2HB       ASN  28  -7.135   5.895  -0.835
  209   2HD2  ASN  28          2HD2      ASN  28  -7.477   6.111   2.301
  210   1HD2  ASN  28          1HD2      ASN  28  -8.967   6.910   2.451
  211    H    ARG  29           H        ARG  29  -8.050   5.230  -3.194
  212    HA   ARG  29           HA       ARG  29 -10.441   6.746  -3.407
  213   1HB   ARG  29          1HB       ARG  29  -8.596   5.635  -5.529
  214   2HB   ARG  29          2HB       ARG  29  -9.934   6.730  -5.888
  215   1HG   ARG  29          1HG       ARG  29  -8.983   8.395  -4.345
  216   2HG   ARG  29          2HG       ARG  29  -7.639   7.314  -3.993
  217   1HD   ARG  29          1HD       ARG  29  -7.173   7.297  -6.500
  218   2HD   ARG  29          2HD       ARG  29  -8.308   8.634  -6.639
  219    HE   ARG  29           HE       ARG  29  -5.569   8.808  -5.816
  220   1HH1  ARG  29          1HH1      ARG  29  -4.747  10.487  -4.584
  221   2HH1  ARG  29          2HH1      ARG  29  -5.832  11.570  -3.778
  222   1HH2  ARG  29          1HH2      ARG  29  -8.690  10.003  -4.935
  223   2HH2  ARG  29          2HH2      ARG  29  -8.055  11.292  -3.971
  224    H    GLU  30           H        GLU  30  -9.755   3.415  -4.509
  225    HA   GLU  30           HA       GLU  30 -12.167   3.038  -5.972
  226   1HB   GLU  30          1HB       GLU  30 -10.479   1.075  -4.400
  227   2HB   GLU  30          2HB       GLU  30 -11.833   0.590  -5.420
  228   1HG   GLU  30          1HG       GLU  30  -9.505   2.240  -6.420
  229   2HG   GLU  30          2HG       GLU  30  -9.581   0.483  -6.548
  230    H    LEU  31           H        LEU  31 -11.459   2.534  -2.539
  231    HA   LEU  31           HA       LEU  31 -13.969   1.422  -1.793
  232   1HB   LEU  31          1HB       LEU  31 -12.341   3.289  -0.056
  233   2HB   LEU  31          2HB       LEU  31 -13.347   1.933   0.449
  234    HG   LEU  31           HG       LEU  31 -10.765   1.803  -1.099
  235   1HD1  LEU  31          1HD1      LEU  31 -11.590   1.077   1.706
  236   2HD1  LEU  31          2HD1      LEU  31 -10.224   0.273   0.935
  237   3HD1  LEU  31          3HD1      LEU  31 -10.199   2.019   1.166
  238   1HD2  LEU  31          1HD2      LEU  31 -12.860  -0.295  -0.514
  239   2HD2  LEU  31          2HD2      LEU  31 -12.073   0.071  -2.051
  240   3HD2  LEU  31          3HD2      LEU  31 -11.175  -0.748  -0.773
  241    H    ASP  32           H        ASP  32 -12.941   4.687  -2.407
  242    HA   ASP  32           HA       ASP  32 -15.056   6.101  -1.166
  243   1HB   ASP  32          1HB       ASP  32 -12.898   6.975  -2.243
  244   2HB   ASP  32          2HB       ASP  32 -13.763   6.883  -3.778
  245    H    LYS  33           H        LYS  33 -14.839   4.699  -4.460
  246    HA   LYS  33           HA       LYS  33 -17.460   5.657  -5.214
  247   1HB   LYS  33          1HB       LYS  33 -17.092   4.626  -7.258
  248   2HB   LYS  33          2HB       LYS  33 -15.431   4.746  -6.692
  249   1HG   LYS  33          1HG       LYS  33 -15.753   2.390  -5.726
  250   2HG   LYS  33          2HG       LYS  33 -17.236   2.317  -6.667
  251   1HD   LYS  33          1HD       LYS  33 -14.519   2.949  -7.861
  252   2HD   LYS  33          2HD       LYS  33 -15.225   1.334  -7.835
  253   1HE   LYS  33          1HE       LYS  33 -17.262   2.364  -9.002
  254   2HE   LYS  33          2HE       LYS  33 -16.256   3.788  -9.269
  255   1HZ   LYS  33          1HZ       LYS  33 -14.695   1.663 -10.015
  256   2HZ   LYS  33          2HZ       LYS  33 -16.235   1.289 -10.628
  257   3HZ   LYS  33          3HZ       LYS  33 -15.486   2.750 -11.052
  258    H    TYR  34           H        TYR  34 -16.259   2.629  -3.815
  259    HA   TYR  34           HA       TYR  34 -18.798   1.265  -3.957
  260   1HB   TYR  34          1HB       TYR  34 -16.319   0.803  -2.274
  261   2HB   TYR  34          2HB       TYR  34 -17.723  -0.268  -2.244
  262    HD1  TYR  34           HD1      TYR  34 -18.634  -0.969  -4.648
  263    HD2  TYR  34           HD2      TYR  34 -14.614   0.320  -3.830
  264    HE1  TYR  34           HE1      TYR  34 -17.855  -2.059  -6.734
  265    HE2  TYR  34           HE2      TYR  34 -13.842  -0.767  -5.914
  266    HH   TYR  34           HH       TYR  34 -16.137  -2.400  -8.100
  267    H    GLY  35           H        GLY  35 -17.224   3.245  -1.452
  268   1HA   GLY  35          1HA       GLY  35 -19.846   3.801  -0.273
  269   2HA   GLY  35          2HA       GLY  35 -18.311   4.490   0.249
  270    H    VAL  36           H        VAL  36 -17.073   1.772   0.527
  271    HA   VAL  36           HA       VAL  36 -18.589   0.176   2.352
  272    HB   VAL  36           HB       VAL  36 -16.408  -0.796   2.984
  273   1HG1  VAL  36          1HG1      VAL  36 -17.566  -1.355   0.787
  274   2HG1  VAL  36          2HG1      VAL  36 -16.441  -0.238   0.014
  275   3HG1  VAL  36          3HG1      VAL  36 -15.835  -1.674   0.834
  276   1HG2  VAL  36          1HG2      VAL  36 -15.388   1.590   1.448
  277   2HG2  VAL  36          2HG2      VAL  36 -15.008   1.130   3.106
  278   3HG2  VAL  36          3HG2      VAL  36 -14.386   0.171   1.761
  279    H    SER  37           H        SER  37 -17.225  -0.142   4.665
  280    HA   SER  37           HA       SER  37 -18.011   2.162   6.218
  281   1HB   SER  37          1HB       SER  37 -17.224   0.921   8.120
  282   2HB   SER  37          2HB       SER  37 -17.960  -0.242   7.021
  283    HG   SER  37           HG       SER  37 -15.809  -0.766   7.902
  284    H    ASP  38           H        ASP  38 -16.620   3.592   7.404
  285    HA   ASP  38           HA       ASP  38 -14.252   4.410   5.957
  286   1HB   ASP  38          1HB       ASP  38 -15.794   5.947   7.251
  287   2HB   ASP  38          2HB       ASP  38 -15.087   5.290   8.728
  288    H    TYR  39           H        TYR  39 -14.830   2.209   8.550
  289    HA   TYR  39           HA       TYR  39 -12.358   2.347   9.944
  290   1HB   TYR  39          1HB       TYR  39 -14.231   1.039  10.794
  291   2HB   TYR  39          2HB       TYR  39 -14.154  -0.035   9.397
  292    HD1  TYR  39           HD1      TYR  39 -12.535   0.936  12.562
  293    HD2  TYR  39           HD2      TYR  39 -12.349  -1.645   9.135
  294    HE1  TYR  39           HE1      TYR  39 -10.835  -0.462  13.706
  295    HE2  TYR  39           HE2      TYR  39 -10.655  -3.041  10.274
  296    HH   TYR  39           HH       TYR  39  -9.636  -3.461  12.238
  297    H    TYR  40           H        TYR  40 -13.255   0.299   7.145
  298    HA   TYR  40           HA       TYR  40 -10.755  -1.020   6.903
  299   1HB   TYR  40          1HB       TYR  40 -12.703  -0.268   4.703
  300   2HB   TYR  40          2HB       TYR  40 -11.422  -1.472   4.569
  301    HD1  TYR  40           HD1      TYR  40 -14.841  -1.088   5.171
  302    HD2  TYR  40           HD2      TYR  40 -11.419  -3.233   6.640
  303    HE1  TYR  40           HE1      TYR  40 -16.336  -2.806   6.149
  304    HE2  TYR  40           HE2      TYR  40 -12.916  -4.948   7.618
  305    HH   TYR  40           HH       TYR  40 -15.770  -4.675   8.387
  306    H    LYS  41           H        LYS  41 -11.832   2.102   5.556
  307    HA   LYS  41           HA       LYS  41  -9.560   2.533   3.885
  308   1HB   LYS  41          1HB       LYS  41 -11.401   4.474   5.315
  309   2HB   LYS  41          2HB       LYS  41 -10.160   4.977   4.167
  310   1HG   LYS  41          1HG       LYS  41 -11.203   3.735   2.383
  311   2HG   LYS  41          2HG       LYS  41 -12.332   2.975   3.502
  312   1HD   LYS  41          1HD       LYS  41 -13.488   4.776   2.352
  313   2HD   LYS  41          2HD       LYS  41 -13.252   5.245   4.033
  314   1HE   LYS  41          1HE       LYS  41 -11.506   6.744   3.497
  315   2HE   LYS  41          2HE       LYS  41 -11.259   6.021   1.907
  316   1HZ   LYS  41          1HZ       LYS  41 -13.928   6.934   2.212
  317   2HZ   LYS  41          2HZ       LYS  41 -12.829   8.194   2.511
  318   3HZ   LYS  41          3HZ       LYS  41 -12.781   7.352   1.036
  319    H    ASN  42           H        ASN  42 -10.197   3.255   7.287
  320    HA   ASN  42           HA       ASN  42  -7.723   4.642   7.712
  321   1HB   ASN  42          1HB       ASN  42  -9.620   3.251   9.618
  322   2HB   ASN  42          2HB       ASN  42  -8.200   4.148  10.156
  323   2HD2  ASN  42          2HD2      ASN  42  -9.079   5.786   7.445
  324   1HD2  ASN  42          1HD2      ASN  42 -10.139   6.928   8.116
  325    H    LEU  43           H        LEU  43  -8.713   1.259   8.070
  326    HA   LEU  43           HA       LEU  43  -6.338   0.306   9.298
  327   1HB   LEU  43          1HB       LEU  43  -8.392  -1.047   9.097
  328   2HB   LEU  43          2HB       LEU  43  -8.177  -1.119   7.350
  329    HG   LEU  43           HG       LEU  43  -6.039  -2.314   7.651
  330   1HD1  LEU  43          1HD1      LEU  43  -6.643  -1.793  10.558
  331   2HD1  LEU  43          2HD1      LEU  43  -5.720  -3.224  10.105
  332   3HD1  LEU  43          3HD1      LEU  43  -5.118  -1.622   9.690
  333   1HD2  LEU  43          1HD2      LEU  43  -8.265  -3.509   7.548
  334   2HD2  LEU  43          2HD2      LEU  43  -6.986  -4.420   8.349
  335   3HD2  LEU  43          3HD2      LEU  43  -8.223  -3.607   9.307
  336    H    ILE  44           H        ILE  44  -7.145   0.761   5.851
  337    HA   ILE  44           HA       ILE  44  -4.760  -0.417   4.810
  338    HB   ILE  44           HB       ILE  44  -6.491   1.819   3.718
  339   1HG1  ILE  44          1HG1      ILE  44  -6.325  -1.114   2.976
  340   2HG1  ILE  44          2HG1      ILE  44  -7.498  -0.462   4.120
  341   1HG2  ILE  44          1HG2      ILE  44  -4.262   0.207   2.442
  342   2HG2  ILE  44          2HG2      ILE  44  -5.431   1.154   1.523
  343   3HG2  ILE  44          3HG2      ILE  44  -4.328   1.959   2.636
  344   1HD1  ILE  44          1HD1      ILE  44  -7.213   0.644   1.327
  345   2HD1  ILE  44          2HD1      ILE  44  -8.278  -0.712   1.696
  346   3HD1  ILE  44          3HD1      ILE  44  -8.552   0.858   2.456
  347    H    ASN  45           H        ASN  45  -5.490   2.865   5.924
  348    HA   ASN  45           HA       ASN  45  -2.992   4.034   5.167
  349   1HB   ASN  45          1HB       ASN  45  -4.956   4.706   7.380
  350   2HB   ASN  45          2HB       ASN  45  -3.544   5.698   7.006
  351   2HD2  ASN  45          2HD2      ASN  45  -3.432   5.936   4.334
  352   1HD2  ASN  45          1HD2      ASN  45  -4.885   6.510   3.672
  353    H    ASN  46           H        ASN  46  -3.861   1.784   7.621
  354    HA   ASN  46           HA       ASN  46  -1.357   2.306   9.166
  355   1HB   ASN  46          1HB       ASN  46  -3.687   0.450   9.743
  356   2HB   ASN  46          2HB       ASN  46  -2.314   0.742  10.813
  357   2HD2  ASN  46          2HD2      ASN  46  -5.440   1.555  10.656
  358   1HD2  ASN  46          1HD2      ASN  46  -5.391   3.159  11.208
  359    H    ALA  47           H        ALA  47  -2.256   0.541   6.510
  360    HA   ALA  47           HA       ALA  47  -1.015  -2.008   7.145
  361   1HB   ALA  47          1HB       ALA  47  -1.800  -0.678   4.544
  362   2HB   ALA  47          2HB       ALA  47  -1.028  -2.262   4.602
  363   3HB   ALA  47          3HB       ALA  47  -2.603  -2.021   5.359
  364    H    LYS  48           H        LYS  48   1.076  -2.728   6.488
  365    HA   LYS  48           HA       LYS  48   2.990  -0.566   5.651
  366   1HB   LYS  48          1HB       LYS  48   4.652  -2.005   7.101
  367   2HB   LYS  48          2HB       LYS  48   3.589  -0.847   7.894
  368   1HG   LYS  48          1HG       LYS  48   2.513  -3.621   7.509
  369   2HG   LYS  48          2HG       LYS  48   3.780  -3.416   8.714
  370   1HD   LYS  48          1HD       LYS  48   2.477  -1.765   9.908
  371   2HD   LYS  48          2HD       LYS  48   1.256  -1.733   8.637
  372   1HE   LYS  48          1HE       LYS  48   0.685  -4.072   9.089
  373   2HE   LYS  48          2HE       LYS  48   1.951  -4.163  10.312
  374   1HZ   LYS  48          1HZ       LYS  48   0.044  -1.997  10.617
  375   2HZ   LYS  48          2HZ       LYS  48  -0.578  -3.560  10.858
  376   3HZ   LYS  48          3HZ       LYS  48   0.733  -3.011  11.790
  377    H    THR  49           H        THR  49   1.546  -3.282   4.578
  378    HA   THR  49           HA       THR  49   3.950  -4.064   2.966
  379    HB   THR  49           HB       THR  49   3.282  -6.441   3.165
  380    HG1  THR  49           HG1      THR  49   1.254  -6.589   3.741
  381   1HG2  THR  49          1HG2      THR  49   3.761  -4.999   5.788
  382   2HG2  THR  49          2HG2      THR  49   3.951  -6.736   5.554
  383   3HG2  THR  49          3HG2      THR  49   4.992  -5.610   4.683
  384    H    VAL  50           H        VAL  50   3.459  -4.741   0.848
  385    HA   VAL  50           HA       VAL  50   1.035  -3.669  -0.296
  386    HB   VAL  50           HB       VAL  50   3.057  -5.595  -1.455
  387   1HG1  VAL  50          1HG1      VAL  50   0.821  -3.978  -2.684
  388   2HG1  VAL  50          2HG1      VAL  50   2.171  -4.596  -3.638
  389   3HG1  VAL  50          3HG1      VAL  50   1.096  -5.715  -2.801
  390   1HG2  VAL  50          1HG2      VAL  50   4.002  -3.407  -0.716
  391   2HG2  VAL  50          2HG2      VAL  50   4.065  -3.606  -2.467
  392   3HG2  VAL  50          3HG2      VAL  50   2.826  -2.582  -1.740
  393    H    GLU  51           H        GLU  51   2.142  -6.971   0.480
  394    HA   GLU  51           HA       GLU  51  -0.069  -8.355  -0.669
  395   1HB   GLU  51          1HB       GLU  51   1.980  -9.497   0.157
  396   2HB   GLU  51          2HB       GLU  51   1.527  -9.087   1.812
  397   1HG   GLU  51          1HG       GLU  51  -0.555 -10.384   1.576
  398   2HG   GLU  51          2HG       GLU  51  -0.123 -10.782  -0.088
  399    H    GLY  52           H        GLY  52   0.422  -6.864   2.494
  400   1HA   GLY  52          1HA       GLY  52  -1.114  -6.313   4.177
  401   2HA   GLY  52          2HA       GLY  52  -2.087  -7.681   3.626
  402    H    VAL  53           H        VAL  53  -1.047  -4.866   1.712
  403    HA   VAL  53           HA       VAL  53  -3.546  -3.448   1.918
  404    HB   VAL  53           HB       VAL  53  -1.323  -3.366  -0.142
  405   1HG1  VAL  53          1HG1      VAL  53  -3.869  -1.754   0.089
  406   2HG1  VAL  53          2HG1      VAL  53  -2.437  -1.113  -0.719
  407   3HG1  VAL  53          3HG1      VAL  53  -3.218  -2.571  -1.331
  408   1HG2  VAL  53          1HG2      VAL  53  -0.979  -2.588   2.288
  409   2HG2  VAL  53          2HG2      VAL  53  -0.590  -1.424   1.022
  410   3HG2  VAL  53          3HG2      VAL  53  -2.108  -1.287   1.911
  411    H    LYS  54           H        LYS  54  -2.243  -5.584  -0.643
  412    HA   LYS  54           HA       LYS  54  -4.671  -5.513  -2.205
  413   1HB   LYS  54          1HB       LYS  54  -2.321  -7.422  -2.175
  414   2HB   LYS  54          2HB       LYS  54  -3.648  -7.543  -3.331
  415   1HG   LYS  54          1HG       LYS  54  -3.192  -5.243  -4.098
  416   2HG   LYS  54          2HG       LYS  54  -1.861  -5.120  -2.945
  417   1HD   LYS  54          1HD       LYS  54  -0.726  -7.014  -4.056
  418   2HD   LYS  54          2HD       LYS  54  -2.055  -7.128  -5.210
  419   1HE   LYS  54          1HE       LYS  54  -1.594  -4.848  -6.001
  420   2HE   LYS  54          2HE       LYS  54  -0.293  -4.693  -4.822
  421   1HZ   LYS  54          1HZ       LYS  54   0.412  -6.947  -6.034
  422   2HZ   LYS  54          2HZ       LYS  54  -0.359  -6.162  -7.325
  423   3HZ   LYS  54          3HZ       LYS  54   0.945  -5.414  -6.534
  424    H    ALA  55           H        ALA  55  -3.392  -7.751   0.230
  425    HA   ALA  55           HA       ALA  55  -5.366  -9.775  -0.038
  426   1HB   ALA  55          1HB       ALA  55  -3.809  -8.874   2.400
  427   2HB   ALA  55          2HB       ALA  55  -3.354 -10.150   1.270
  428   3HB   ALA  55          3HB       ALA  55  -4.758 -10.360   2.318
  429    H    LEU  56           H        LEU  56  -5.473  -6.682   1.662
  430    HA   LEU  56           HA       LEU  56  -7.826  -7.282   3.190
  431   1HB   LEU  56          1HB       LEU  56  -6.225  -5.420   3.718
  432   2HB   LEU  56          2HB       LEU  56  -6.809  -4.569   2.293
  433    HG   LEU  56           HG       LEU  56  -9.142  -4.701   3.277
  434   1HD1  LEU  56          1HD1      LEU  56  -7.549  -5.864   5.562
  435   2HD1  LEU  56          2HD1      LEU  56  -9.024  -4.954   5.880
  436   3HD1  LEU  56          3HD1      LEU  56  -9.088  -6.406   4.894
  437   1HD2  LEU  56          1HD2      LEU  56  -6.891  -3.187   4.609
  438   2HD2  LEU  56          2HD2      LEU  56  -8.074  -2.604   3.438
  439   3HD2  LEU  56          3HD2      LEU  56  -8.569  -2.945   5.095
  440    H    ILE  57           H        ILE  57  -7.421  -5.182   0.295
  441    HA   ILE  57           HA       ILE  57 -10.089  -4.661  -0.289
  442    HB   ILE  57           HB       ILE  57  -8.118  -5.514  -2.422
  443   1HG1  ILE  57          1HG1      ILE  57  -6.929  -3.937  -1.030
  444   2HG1  ILE  57          2HG1      ILE  57  -7.481  -3.061  -2.452
  445   1HG2  ILE  57          1HG2      ILE  57 -10.441  -3.571  -2.364
  446   2HG2  ILE  57          2HG2      ILE  57  -9.342  -3.773  -3.729
  447   3HG2  ILE  57          3HG2      ILE  57 -10.374  -5.110  -3.223
  448   1HD1  ILE  57          1HD1      ILE  57  -9.545  -2.429  -1.045
  449   2HD1  ILE  57          2HD1      ILE  57  -8.614  -2.985   0.346
  450   3HD1  ILE  57          3HD1      ILE  57  -8.021  -1.643  -0.632
  451    H    ASP  58           H        ASP  58  -8.300  -7.655  -0.855
  452    HA   ASP  58           HA       ASP  58 -10.346  -8.979  -2.366
  453   1HB   ASP  58          1HB       ASP  58  -8.196 -10.055  -0.517
  454   2HB   ASP  58          2HB       ASP  58  -9.245 -11.088  -1.489
  455    H    GLU  59           H        GLU  59  -9.740  -8.646   1.107
  456    HA   GLU  59           HA       GLU  59 -11.929 -10.337   1.921
  457   1HB   GLU  59          1HB       GLU  59 -10.340  -8.210   3.371
  458   2HB   GLU  59          2HB       GLU  59 -11.592  -9.180   4.148
  459   1HG   GLU  59          1HG       GLU  59  -9.215 -10.371   2.694
  460   2HG   GLU  59          2HG       GLU  59  -9.252 -10.085   4.434
  461    H    ILE  60           H        ILE  60 -11.532  -6.844   1.432
  462    HA   ILE  60           HA       ILE  60 -14.138  -6.187   2.435
  463    HB   ILE  60           HB       ILE  60 -12.722  -4.531   0.346
  464   1HG1  ILE  60          1HG1      ILE  60 -10.911  -5.069   1.792
  465   2HG1  ILE  60          2HG1      ILE  60 -11.471  -3.495   2.320
  466   1HG2  ILE  60          1HG2      ILE  60 -14.960  -3.878   1.313
  467   2HG2  ILE  60          2HG2      ILE  60 -14.174  -3.745   2.886
  468   3HG2  ILE  60          3HG2      ILE  60 -13.684  -2.686   1.565
  469   1HD1  ILE  60          1HD1      ILE  60 -12.946  -4.924   3.976
  470   2HD1  ILE  60          2HD1      ILE  60 -11.730  -6.162   3.654
  471   3HD1  ILE  60          3HD1      ILE  60 -11.249  -4.613   4.337
  472    H    LEU  61           H        LEU  61 -12.906  -6.509  -0.913
  473    HA   LEU  61           HA       LEU  61 -15.426  -6.130  -2.186
  474   1HB   LEU  61          1HB       LEU  61 -12.977  -7.698  -3.052
  475   2HB   LEU  61          2HB       LEU  61 -14.376  -7.444  -4.094
  476    HG   LEU  61           HG       LEU  61 -12.691  -5.244  -2.852
  477   1HD1  LEU  61          1HD1      LEU  61 -11.564  -6.609  -4.635
  478   2HD1  LEU  61          2HD1      LEU  61 -12.867  -6.164  -5.737
  479   3HD1  LEU  61          3HD1      LEU  61 -11.797  -4.920  -5.088
  480   1HD2  LEU  61          1HD2      LEU  61 -15.208  -5.271  -4.502
  481   2HD2  LEU  61          2HD2      LEU  61 -14.733  -4.178  -3.203
  482   3HD2  LEU  61          3HD2      LEU  61 -14.034  -3.989  -4.805
  483    H    ALA  62           H        ALA  62 -13.868  -9.060  -0.922
  484    HA   ALA  62           HA       ALA  62 -15.712 -10.967  -1.904
  485   1HB   ALA  62          1HB       ALA  62 -14.163 -10.875   0.699
  486   2HB   ALA  62          2HB       ALA  62 -15.089 -12.281   0.174
  487   3HB   ALA  62          3HB       ALA  62 -13.716 -11.722  -0.782
  488    H    ALA  63           H        ALA  63 -16.115  -8.492   0.468
  489    HA   ALA  63           HA       ALA  63 -18.360  -9.709   1.856
  490   1HB   ALA  63          1HB       ALA  63 -16.862  -7.862   2.767
  491   2HB   ALA  63          2HB       ALA  63 -17.711  -6.758   1.684
  492   3HB   ALA  63          3HB       ALA  63 -18.595  -7.594   2.960
  493    H    LEU  64           H        LEU  64 -18.027  -8.543  -1.245
  494    HA   LEU  64           HA       LEU  64 -20.970  -7.978  -1.462
  495   1HB   LEU  64          1HB       LEU  64 -18.772  -6.636  -3.062
  496   2HB   LEU  64          2HB       LEU  64 -20.496  -6.283  -3.139
  497    HG   LEU  64           HG       LEU  64 -18.836  -5.978  -0.620
  498   1HD1  LEU  64          1HD1      LEU  64 -19.602  -3.947  -2.735
  499   2HD1  LEU  64          2HD1      LEU  64 -18.997  -3.517  -1.135
  500   3HD1  LEU  64          3HD1      LEU  64 -17.972  -4.418  -2.252
  501   1HD2  LEU  64          1HD2      LEU  64 -21.656  -5.235  -1.431
  502   2HD2  LEU  64          2HD2      LEU  64 -21.128  -6.154  -0.022
  503   3HD2  LEU  64          3HD2      LEU  64 -20.839  -4.420  -0.098
  504    HA   PRO  65           HA       PRO  65 -19.560 -11.515  -4.203
  505   1HB   PRO  65          1HB       PRO  65 -22.304 -12.489  -3.744
  506   2HB   PRO  65          2HB       PRO  65 -20.765 -13.295  -3.413
  507   1HG   PRO  65          1HG       PRO  65 -22.486 -12.277  -1.468
  508   2HG   PRO  65          2HG       PRO  65 -20.774 -12.648  -1.219
  509   1HD   PRO  65          1HD       PRO  65 -22.090 -10.007  -1.424
  510   2HD   PRO  65          2HD       PRO  65 -20.481 -10.412  -0.775

  No H/Q in entry =         510
  Start of MODEL   29
    1    H1   MET   1           H1       MET   1  32.621   6.169  15.920
    2    H2   MET   1           H2       MET   1  30.957   6.408  16.159
    3    H3   MET   1           H3       MET   1  31.608   4.839  16.206
    4    HA   MET   1           HA       MET   1  32.111   4.887  13.888
    5   1HB   MET   1          1HB       MET   1  29.750   4.371  14.666
    6   2HB   MET   1          2HB       MET   1  29.335   6.040  14.279
    7   1HG   MET   1          1HG       MET   1  30.033   5.685  11.950
    8   2HG   MET   1          2HG       MET   1  30.480   4.025  12.322
    9   1HE   MET   1          1HE       MET   1  29.130   2.306  13.096
   10   2HE   MET   1          2HE       MET   1  27.944   2.935  14.236
   11   3HE   MET   1          3HE       MET   1  27.413   2.075  12.786
   12    H    LYS   2           H        LYS   2  29.987   7.726  14.226
   13    HA   LYS   2           HA       LYS   2  32.049   9.424  12.891
   14   1HB   LYS   2          1HB       LYS   2  29.176   9.042  11.999
   15   2HB   LYS   2          2HB       LYS   2  30.177  10.391  11.471
   16   1HG   LYS   2          1HG       LYS   2  31.131   7.548  11.146
   17   2HG   LYS   2          2HG       LYS   2  30.055   8.271   9.959
   18   1HD   LYS   2          1HD       LYS   2  31.722  10.173   9.754
   19   2HD   LYS   2          2HD       LYS   2  32.824   9.220  10.749
   20   1HE   LYS   2          1HE       LYS   2  31.588   8.260   8.158
   21   2HE   LYS   2          2HE       LYS   2  33.226   8.894   8.314
   22   1HZ   LYS   2          1HZ       LYS   2  32.972   6.998  10.290
   23   2HZ   LYS   2          2HZ       LYS   2  32.240   6.302   8.923
   24   3HZ   LYS   2          3HZ       LYS   2  33.848   6.848   8.845
   25    H    ALA   3           H        ALA   3  31.431   9.460  15.615
   26    HA   ALA   3           HA       ALA   3  29.368  11.295  16.345
   27   1HB   ALA   3          1HB       ALA   3  32.016  10.696  17.694
   28   2HB   ALA   3          2HB       ALA   3  30.471   9.909  18.022
   29   3HB   ALA   3          3HB       ALA   3  30.701  11.608  18.435
   30    H    ILE   4           H        ILE   4  29.349  13.540  16.486
   31    HA   ILE   4           HA       ILE   4  31.833  15.023  15.739
   32    HB   ILE   4           HB       ILE   4  30.475  16.488  14.246
   33   1HG1  ILE   4          1HG1      ILE   4  28.341  14.350  14.507
   34   2HG1  ILE   4          2HG1      ILE   4  28.269  15.894  15.351
   35   1HG2  ILE   4          1HG2      ILE   4  31.783  14.473  13.439
   36   2HG2  ILE   4          2HG2      ILE   4  30.258  13.585  13.428
   37   3HG2  ILE   4          3HG2      ILE   4  30.471  14.988  12.379
   38   1HD1  ILE   4          1HD1      ILE   4  28.457  17.058  13.144
   39   2HD1  ILE   4          2HD1      ILE   4  28.362  15.484  12.353
   40   3HD1  ILE   4          3HD1      ILE   4  26.995  16.083  13.293
   41    H    PHE   5           H        PHE   5  29.936  17.459  15.607
   42    HA   PHE   5           HA       PHE   5  30.370  18.362  18.265
   43   1HB   PHE   5          1HB       PHE   5  29.856  19.742  16.129
   44   2HB   PHE   5          2HB       PHE   5  28.160  19.439  16.504
   45    HD1  PHE   5           HD1      PHE   5  31.151  21.301  17.391
   46    HD2  PHE   5           HD2      PHE   5  27.219  20.201  18.720
   47    HE1  PHE   5           HE1      PHE   5  31.209  23.119  19.075
   48    HE2  PHE   5           HE2      PHE   5  27.275  22.020  20.401
   49    HZ   PHE   5           HZ       PHE   5  29.272  23.480  20.580
   50    H    VAL   6           H        VAL   6  27.627  16.736  16.768
   51    HA   VAL   6           HA       VAL   6  26.362  16.470  19.479
   52    HB   VAL   6           HB       VAL   6  24.160  16.577  18.365
   53   1HG1  VAL   6          1HG1      VAL   6  25.454  18.677  19.145
   54   2HG1  VAL   6          2HG1      VAL   6  25.739  18.975  17.430
   55   3HG1  VAL   6          3HG1      VAL   6  24.091  18.922  18.053
   56   1HG2  VAL   6          1HG2      VAL   6  25.879  16.967  15.903
   57   2HG2  VAL   6          2HG2      VAL   6  24.650  15.733  16.178
   58   3HG2  VAL   6          3HG2      VAL   6  24.175  17.415  15.946
   59    H    LEU   7           H        LEU   7  25.075  14.465  19.675
   60    HA   LEU   7           HA       LEU   7  26.426  12.225  18.425
   61   1HB   LEU   7          1HB       LEU   7  25.069  10.822  19.803
   62   2HB   LEU   7          2HB       LEU   7  25.441  12.240  20.774
   63    HG   LEU   7           HG       LEU   7  22.844  11.759  19.263
   64   1HD1  LEU   7          1HD1      LEU   7  23.197  10.363  21.306
   65   2HD1  LEU   7          2HD1      LEU   7  23.412  11.844  22.238
   66   3HD1  LEU   7          3HD1      LEU   7  21.862  11.502  21.470
   67   1HD2  LEU   7          1HD2      LEU   7  23.881  14.061  20.934
   68   2HD2  LEU   7          2HD2      LEU   7  23.189  14.123  19.313
   69   3HD2  LEU   7          3HD2      LEU   7  22.155  13.789  20.698
   70    H    ASN   8           H        ASN   8  25.751  10.955  16.724
   71    HA   ASN   8           HA       ASN   8  23.652  12.056  15.007
   72   1HB   ASN   8          1HB       ASN   8  25.380   9.576  14.752
   73   2HB   ASN   8          2HB       ASN   8  24.268  10.149  13.509
   74   2HD2  ASN   8          2HD2      ASN   8  24.676  12.846  13.369
   75   1HD2  ASN   8          1HD2      ASN   8  26.299  13.209  13.036
   76    H    ALA   9           H        ALA   9  21.575  11.263  14.812
   77    HA   ALA   9           HA       ALA   9  20.873   8.572  15.668
   78   1HB   ALA   9          1HB       ALA   9  20.062  10.953  17.358
   79   2HB   ALA   9          2HB       ALA   9  20.947   9.519  17.879
   80   3HB   ALA   9          3HB       ALA   9  19.245   9.391  17.435
   81    H    GLN  10           H        GLN  10  20.528  10.895  13.564
   82    HA   GLN  10           HA       GLN  10  17.744  11.447  13.356
   83   1HB   GLN  10          1HB       GLN  10  19.480  12.629  12.041
   84   2HB   GLN  10          2HB       GLN  10  19.782  11.152  11.125
   85   1HG   GLN  10          1HG       GLN  10  17.452  11.165  10.316
   86   2HG   GLN  10          2HG       GLN  10  17.133  12.628  11.250
   87   2HE2  GLN  10          2HE2      GLN  10  16.617  13.559   9.014
   88   1HE2  GLN  10          1HE2      GLN  10  17.908  14.150   8.083
   89    H    HIS  11           H        HIS  11  16.053  10.290  12.439
   90    HA   HIS  11           HA       HIS  11  16.516   7.407  12.015
   91   1HB   HIS  11          1HB       HIS  11  14.571   8.114  13.337
   92   2HB   HIS  11          2HB       HIS  11  13.973   9.064  11.977
   93    HD1  HIS  11           HD1      HIS  11  11.832   7.646  11.668
   94    HD2  HIS  11           HD2      HIS  11  15.347   5.424  11.364
   95    HE1  HIS  11           HE1      HIS  11  11.172   5.386  10.735
   96    H    ASP  12           H        ASP  12  17.237   6.857  10.011
   97    HA   ASP  12           HA       ASP  12  15.750   7.906   7.643
   98   1HB   ASP  12          1HB       ASP  12  18.760   7.853   7.997
   99   2HB   ASP  12          2HB       ASP  12  17.969   8.041   6.432
  100    H    GLU  13           H        GLU  13  15.701   6.425   5.883
  101    HA   GLU  13           HA       GLU  13  17.097   3.843   6.136
  102   1HB   GLU  13          1HB       GLU  13  14.977   2.540   6.030
  103   2HB   GLU  13          2HB       GLU  13  15.108   3.469   7.524
  104   1HG   GLU  13          1HG       GLU  13  13.694   5.244   6.543
  105   2HG   GLU  13          2HG       GLU  13  13.556   4.308   5.056
  106    H    ALA  14           H        ALA  14  16.819   2.536   4.149
  107    HA   ALA  14           HA       ALA  14  16.421   4.284   1.783
  108   1HB   ALA  14          1HB       ALA  14  17.331   1.395   1.839
  109   2HB   ALA  14          2HB       ALA  14  18.435   2.754   2.048
  110   3HB   ALA  14          3HB       ALA  14  17.545   2.566   0.537
  111    H    VAL  15           H        VAL  15  14.197   4.430   1.450
  112    HA   VAL  15           HA       VAL  15  12.833   1.918   0.634
  113    HB   VAL  15           HB       VAL  15  12.228   2.225   3.006
  114   1HG1  VAL  15          1HG1      VAL  15  12.599   4.729   2.967
  115   2HG1  VAL  15          2HG1      VAL  15  11.047   4.879   2.144
  116   3HG1  VAL  15          3HG1      VAL  15  11.117   4.222   3.778
  117   1HG2  VAL  15          1HG2      VAL  15  10.553   1.415   1.278
  118   2HG2  VAL  15          2HG2      VAL  15   9.839   2.126   2.727
  119   3HG2  VAL  15          3HG2      VAL  15   9.915   3.059   1.232
  120    H    ASP  16           H        ASP  16  11.319   2.279  -1.017
  121    HA   ASP  16           HA       ASP  16  11.430   4.935  -2.283
  122   1HB   ASP  16          1HB       ASP  16  11.541   2.804  -3.610
  123   2HB   ASP  16          2HB       ASP  16   9.869   2.482  -3.146
  124    H    ALA  17           H        ALA  17  10.104   6.455  -1.426
  125    HA   ALA  17           HA       ALA  17   7.577   5.723  -0.133
  126   1HB   ALA  17          1HB       ALA  17   8.790   7.538   0.862
  127   2HB   ALA  17          2HB       ALA  17   8.947   8.362  -0.687
  128   3HB   ALA  17          3HB       ALA  17   7.371   8.250   0.097
  129    H    ASN  18           H        ASN  18   6.821   4.730  -2.267
  130    HA   ASN  18           HA       ASN  18   5.029   6.640  -3.568
  131   1HB   ASN  18          1HB       ASN  18   7.235   6.853  -4.797
  132   2HB   ASN  18          2HB       ASN  18   7.045   5.166  -5.280
  133   2HD2  ASN  18          2HD2      ASN  18   5.181   8.257  -5.332
  134   1HD2  ASN  18          1HD2      ASN  18   4.443   7.956  -6.830
  135    H    SER  19           H        SER  19   6.466   3.368  -3.924
  136    HA   SER  19           HA       SER  19   4.150   2.169  -5.087
  137   1HB   SER  19          1HB       SER  19   6.373   1.076  -5.045
  138   2HB   SER  19          2HB       SER  19   6.242   0.896  -3.299
  139    HG   SER  19           HG       SER  19   4.022  -0.061  -4.252
  140    H    LEU  20           H        LEU  20   5.250   2.181  -1.681
  141    HA   LEU  20           HA       LEU  20   2.951   0.874  -0.622
  142   1HB   LEU  20          1HB       LEU  20   4.965   2.786   0.568
  143   2HB   LEU  20          2HB       LEU  20   3.634   2.160   1.530
  144    HG   LEU  20           HG       LEU  20   5.874   0.895   1.656
  145   1HD1  LEU  20          1HD1      LEU  20   3.576   0.004   2.334
  146   2HD1  LEU  20          2HD1      LEU  20   3.549  -0.831   0.782
  147   3HD1  LEU  20          3HD1      LEU  20   4.802  -1.203   1.960
  148   1HD2  LEU  20          1HD2      LEU  20   6.241   0.956  -0.843
  149   2HD2  LEU  20          2HD2      LEU  20   6.414  -0.639  -0.117
  150   3HD2  LEU  20          3HD2      LEU  20   4.947  -0.232  -1.002
  151    H    ALA  21           H        ALA  21   3.678   4.350  -0.933
  152    HA   ALA  21           HA       ALA  21   1.198   5.244   0.132
  153   1HB   ALA  21          1HB       ALA  21   2.966   6.616  -1.911
  154   2HB   ALA  21          2HB       ALA  21   3.186   6.702  -0.163
  155   3HB   ALA  21          3HB       ALA  21   1.744   7.396  -0.906
  156    H    GLU  22           H        GLU  22   2.224   4.810  -3.278
  157    HA   GLU  22           HA       GLU  22  -0.277   5.559  -4.419
  158   1HB   GLU  22          1HB       GLU  22   1.855   5.248  -5.705
  159   2HB   GLU  22          2HB       GLU  22   1.673   3.505  -5.501
  160   1HG   GLU  22          1HG       GLU  22  -0.496   3.585  -6.665
  161   2HG   GLU  22          2HG       GLU  22  -0.324   5.329  -6.870
  162    H    ALA  23           H        ALA  23   0.926   2.408  -3.305
  163    HA   ALA  23           HA       ALA  23  -1.292   0.847  -4.168
  164   1HB   ALA  23          1HB       ALA  23   0.367   0.453  -1.656
  165   2HB   ALA  23          2HB       ALA  23   0.849  -0.088  -3.266
  166   3HB   ALA  23          3HB       ALA  23  -0.578  -0.779  -2.493
  167    H    LYS  24           H        LYS  24  -0.680   2.462  -1.042
  168    HA   LYS  24           HA       LYS  24  -3.253   1.775   0.058
  169   1HB   LYS  24          1HB       LYS  24  -1.237   3.910   0.781
  170   2HB   LYS  24          2HB       LYS  24  -2.690   3.585   1.725
  171   1HG   LYS  24          1HG       LYS  24  -1.963   1.231   2.016
  172   2HG   LYS  24          2HG       LYS  24  -0.492   1.582   1.113
  173   1HD   LYS  24          1HD       LYS  24  -1.216   3.201   3.553
  174   2HD   LYS  24          2HD       LYS  24  -0.395   1.653   3.717
  175   1HE   LYS  24          1HE       LYS  24   1.404   2.475   2.205
  176   2HE   LYS  24          2HE       LYS  24   0.605   4.044   2.140
  177   1HZ   LYS  24          1HZ       LYS  24   0.749   4.030   4.637
  178   2HZ   LYS  24          2HZ       LYS  24   1.811   2.716   4.491
  179   3HZ   LYS  24          3HZ       LYS  24   2.220   4.217   3.808
  180    H    VAL  25           H        VAL  25  -2.013   4.655  -1.649
  181    HA   VAL  25           HA       VAL  25  -4.356   6.247  -1.287
  182    HB   VAL  25           HB       VAL  25  -2.262   6.261  -3.468
  183   1HG1  VAL  25          1HG1      VAL  25  -4.624   8.083  -2.982
  184   2HG1  VAL  25          2HG1      VAL  25  -3.203   8.613  -3.882
  185   3HG1  VAL  25          3HG1      VAL  25  -4.172   7.266  -4.478
  186   1HG2  VAL  25          1HG2      VAL  25  -1.760   6.886  -0.983
  187   2HG2  VAL  25          2HG2      VAL  25  -1.247   8.006  -2.243
  188   3HG2  VAL  25          3HG2      VAL  25  -2.710   8.333  -1.315
  189    H    LEU  26           H        LEU  26  -3.407   4.055  -3.948
  190    HA   LEU  26           HA       LEU  26  -5.797   4.449  -5.468
  191   1HB   LEU  26          1HB       LEU  26  -3.870   2.109  -5.338
  192   2HB   LEU  26          2HB       LEU  26  -5.200   2.198  -6.491
  193    HG   LEU  26           HG       LEU  26  -2.945   4.219  -6.240
  194   1HD1  LEU  26          1HD1      LEU  26  -2.233   2.034  -7.164
  195   2HD1  LEU  26          2HD1      LEU  26  -3.513   2.134  -8.372
  196   3HD1  LEU  26          3HD1      LEU  26  -2.188   3.299  -8.393
  197   1HD2  LEU  26          1HD2      LEU  26  -5.470   4.121  -7.873
  198   2HD2  LEU  26          2HD2      LEU  26  -4.652   5.509  -7.157
  199   3HD2  LEU  26          3HD2      LEU  26  -4.021   4.785  -8.630
  200    H    ALA  27           H        ALA  27  -5.001   2.145  -2.882
  201    HA   ALA  27           HA       ALA  27  -7.461   0.667  -3.084
  202   1HB   ALA  27          1HB       ALA  27  -5.444   1.044  -0.866
  203   2HB   ALA  27          2HB       ALA  27  -5.708  -0.381  -1.873
  204   3HB   ALA  27          3HB       ALA  27  -6.893   0.062  -0.645
  205    H    ASN  28           H        ASN  28  -6.486   3.432  -1.038
  206    HA   ASN  28           HA       ASN  28  -8.897   3.626   0.461
  207   1HB   ASN  28          1HB       ASN  28  -6.840   4.863   1.034
  208   2HB   ASN  28          2HB       ASN  28  -7.027   5.848  -0.417
  209   2HD2  ASN  28          2HD2      ASN  28  -7.123   6.675   2.490
  210   1HD2  ASN  28          1HD2      ASN  28  -8.622   7.448   2.680
  211    H    ARG  29           H        ARG  29  -8.013   5.017  -2.691
  212    HA   ARG  29           HA       ARG  29 -10.363   6.609  -3.017
  213   1HB   ARG  29          1HB       ARG  29  -8.513   5.333  -5.041
  214   2HB   ARG  29          2HB       ARG  29  -9.826   6.423  -5.485
  215   1HG   ARG  29          1HG       ARG  29  -8.862   8.179  -4.047
  216   2HG   ARG  29          2HG       ARG  29  -7.545   7.096  -3.603
  217   1HD   ARG  29          1HD       ARG  29  -6.724   8.512  -5.366
  218   2HD   ARG  29          2HD       ARG  29  -6.997   6.917  -6.072
  219    HE   ARG  29           HE       ARG  29  -9.387   8.229  -6.510
  220   1HH1  ARG  29          1HH1      ARG  29  -9.796   9.458  -8.356
  221   2HH1  ARG  29          2HH1      ARG  29  -8.472  10.153  -9.231
  222   1HH2  ARG  29          1HH2      ARG  29  -6.052   8.879  -7.097
  223   2HH2  ARG  29          2HH2      ARG  29  -6.351   9.825  -8.517
  224    H    GLU  30           H        GLU  30  -9.706   3.207  -3.799
  225    HA   GLU  30           HA       GLU  30 -12.074   2.706  -5.289
  226   1HB   GLU  30          1HB       GLU  30 -10.437   0.895  -3.496
  227   2HB   GLU  30          2HB       GLU  30 -11.768   0.319  -4.500
  228   1HG   GLU  30          1HG       GLU  30  -9.411   1.867  -5.598
  229   2HG   GLU  30          2HG       GLU  30  -9.484   0.106  -5.559
  230    H    LEU  31           H        LEU  31 -11.496   2.633  -1.782
  231    HA   LEU  31           HA       LEU  31 -14.004   1.548  -1.004
  232   1HB   LEU  31          1HB       LEU  31 -12.632   3.763   0.540
  233   2HB   LEU  31          2HB       LEU  31 -13.542   2.389   1.167
  234    HG   LEU  31           HG       LEU  31 -10.826   2.348  -0.149
  235   1HD1  LEU  31          1HD1      LEU  31 -11.017   2.973   2.285
  236   2HD1  LEU  31          2HD1      LEU  31 -11.716   1.381   2.579
  237   3HD1  LEU  31          3HD1      LEU  31 -10.060   1.523   1.987
  238   1HD2  LEU  31          1HD2      LEU  31 -12.738   0.107   0.540
  239   2HD2  LEU  31          2HD2      LEU  31 -11.898   0.393  -0.985
  240   3HD2  LEU  31          3HD2      LEU  31 -10.999  -0.167   0.426
  241    H    ASP  32           H        ASP  32 -13.002   4.889  -1.633
  242    HA   ASP  32           HA       ASP  32 -15.447   6.173  -0.975
  243   1HB   ASP  32          1HB       ASP  32 -13.326   7.366  -1.369
  244   2HB   ASP  32          2HB       ASP  32 -13.389   6.916  -3.073
  245    H    LYS  33           H        LYS  33 -14.313   4.753  -4.040
  246    HA   LYS  33           HA       LYS  33 -16.520   5.538  -5.660
  247   1HB   LYS  33          1HB       LYS  33 -14.365   4.488  -6.460
  248   2HB   LYS  33          2HB       LYS  33 -14.971   2.940  -5.872
  249   1HG   LYS  33          1HG       LYS  33 -17.064   3.440  -7.332
  250   2HG   LYS  33          2HG       LYS  33 -16.050   4.652  -8.113
  251   1HD   LYS  33          1HD       LYS  33 -15.407   1.698  -7.873
  252   2HD   LYS  33          2HD       LYS  33 -15.948   2.519  -9.337
  253   1HE   LYS  33          1HE       LYS  33 -13.594   2.415  -9.562
  254   2HE   LYS  33          2HE       LYS  33 -13.903   4.060  -9.007
  255   1HZ   LYS  33          1HZ       LYS  33 -13.596   2.152  -6.876
  256   2HZ   LYS  33          2HZ       LYS  33 -12.207   2.311  -7.841
  257   3HZ   LYS  33          3HZ       LYS  33 -12.871   3.675  -7.083
  258    H    TYR  34           H        TYR  34 -15.996   2.554  -3.769
  259    HA   TYR  34           HA       TYR  34 -18.592   1.461  -4.386
  260   1HB   TYR  34          1HB       TYR  34 -16.581   0.844  -2.209
  261   2HB   TYR  34          2HB       TYR  34 -18.076  -0.067  -2.432
  262    HD1  TYR  34           HD1      TYR  34 -14.658   0.094  -3.348
  263    HD2  TYR  34           HD2      TYR  34 -18.542  -0.835  -4.936
  264    HE1  TYR  34           HE1      TYR  34 -13.604  -1.226  -5.160
  265    HE2  TYR  34           HE2      TYR  34 -17.483  -2.161  -6.744
  266    HH   TYR  34           HH       TYR  34 -14.486  -3.295  -6.678
  267    H    GLY  35           H        GLY  35 -17.381   3.624  -1.898
  268   1HA   GLY  35          1HA       GLY  35 -20.173   4.166  -1.074
  269   2HA   GLY  35          2HA       GLY  35 -18.760   5.125  -0.640
  270    H    VAL  36           H        VAL  36 -17.270   2.654   0.180
  271    HA   VAL  36           HA       VAL  36 -18.674   1.281   2.249
  272    HB   VAL  36           HB       VAL  36 -15.725   1.930   2.396
  273   1HG1  VAL  36          1HG1      VAL  36 -17.006   0.560   4.166
  274   2HG1  VAL  36          2HG1      VAL  36 -17.150  -0.684   2.929
  275   3HG1  VAL  36          3HG1      VAL  36 -15.555  -0.173   3.487
  276   1HG2  VAL  36          1HG2      VAL  36 -17.161   0.030   0.524
  277   2HG2  VAL  36          2HG2      VAL  36 -16.047   1.324   0.092
  278   3HG2  VAL  36          3HG2      VAL  36 -15.446  -0.117   0.908
  279    H    SER  37           H        SER  37 -18.406   1.642   4.619
  280    HA   SER  37           HA       SER  37 -19.257   4.112   5.509
  281   1HB   SER  37          1HB       SER  37 -18.581   3.464   7.727
  282   2HB   SER  37          2HB       SER  37 -19.104   2.014   6.878
  283    HG   SER  37           HG       SER  37 -17.051   1.356   6.712
  284    H    ASP  38           H        ASP  38 -16.146   3.502   6.957
  285    HA   ASP  38           HA       ASP  38 -14.638   5.415   5.400
  286   1HB   ASP  38          1HB       ASP  38 -16.367   6.868   6.623
  287   2HB   ASP  38          2HB       ASP  38 -15.514   6.444   8.106
  288    H    TYR  39           H        TYR  39 -15.025   4.117   8.741
  289    HA   TYR  39           HA       TYR  39 -12.370   4.381   9.533
  290   1HB   TYR  39          1HB       TYR  39 -12.817   2.121  10.808
  291   2HB   TYR  39          2HB       TYR  39 -13.709   3.577  11.248
  292    HD1  TYR  39           HD1      TYR  39 -13.903   0.271   9.719
  293    HD2  TYR  39           HD2      TYR  39 -16.000   3.937  10.462
  294    HE1  TYR  39           HE1      TYR  39 -16.042  -0.838   9.167
  295    HE2  TYR  39           HE2      TYR  39 -18.131   2.835   9.912
  296    HH   TYR  39           HH       TYR  39 -19.088   0.599   9.822
  297    H    TYR  40           H        TYR  40 -13.586   2.469   6.992
  298    HA   TYR  40           HA       TYR  40 -11.525   0.440   6.969
  299   1HB   TYR  40          1HB       TYR  40 -13.328   1.523   4.788
  300   2HB   TYR  40          2HB       TYR  40 -12.201   0.191   4.542
  301    HD1  TYR  40           HD1      TYR  40 -15.444   1.151   5.795
  302    HD2  TYR  40           HD2      TYR  40 -12.402  -1.871   6.023
  303    HE1  TYR  40           HE1      TYR  40 -17.100  -0.447   6.719
  304    HE2  TYR  40           HE2      TYR  40 -14.054  -3.468   6.953
  305    HH   TYR  40           HH       TYR  40 -16.174  -3.454   8.105
  306    H    LYS  41           H        LYS  41 -11.747   3.742   5.773
  307    HA   LYS  41           HA       LYS  41  -9.516   3.563   3.982
  308   1HB   LYS  41          1HB       LYS  41  -9.744   5.878   3.696
  309   2HB   LYS  41          2HB       LYS  41 -11.379   5.377   4.126
  310   1HG   LYS  41          1HG       LYS  41 -10.755   5.940   6.547
  311   2HG   LYS  41          2HG       LYS  41  -9.326   6.731   5.886
  312   1HD   LYS  41          1HD       LYS  41 -12.199   7.382   5.159
  313   2HD   LYS  41          2HD       LYS  41 -11.148   8.361   6.182
  314   1HE   LYS  41          1HE       LYS  41  -9.527   8.383   4.161
  315   2HE   LYS  41          2HE       LYS  41 -10.912   7.826   3.220
  316   1HZ   LYS  41          1HZ       LYS  41 -12.053   9.814   4.491
  317   2HZ   LYS  41          2HZ       LYS  41 -10.460  10.402   4.517
  318   3HZ   LYS  41          3HZ       LYS  41 -11.208  10.050   3.037
  319    H    ASN  42           H        ASN  42  -9.774   4.471   7.431
  320    HA   ASN  42           HA       ASN  42  -6.964   5.152   7.568
  321   1HB   ASN  42          1HB       ASN  42  -7.246   5.355   9.937
  322   2HB   ASN  42          2HB       ASN  42  -8.733   5.959   9.211
  323   2HD2  ASN  42          2HD2      ASN  42  -7.350   3.342  11.134
  324   1HD2  ASN  42          1HD2      ASN  42  -8.827   2.603  11.522
  325    H    LEU  43           H        LEU  43  -8.802   2.233   7.738
  326    HA   LEU  43           HA       LEU  43  -6.939   0.575   9.139
  327   1HB   LEU  43          1HB       LEU  43  -9.271  -0.112   8.637
  328   2HB   LEU  43          2HB       LEU  43  -8.883  -0.157   6.920
  329    HG   LEU  43           HG       LEU  43  -7.186  -1.910   7.355
  330   1HD1  LEU  43          1HD1      LEU  43  -8.002  -1.357  10.196
  331   2HD1  LEU  43          2HD1      LEU  43  -7.535  -3.001   9.761
  332   3HD1  LEU  43          3HD1      LEU  43  -6.402  -1.674   9.530
  333   1HD2  LEU  43          1HD2      LEU  43  -9.624  -2.426   6.867
  334   2HD2  LEU  43          2HD2      LEU  43  -8.754  -3.706   7.711
  335   3HD2  LEU  43          3HD2      LEU  43  -9.849  -2.650   8.602
  336    H    ILE  44           H        ILE  44  -7.274   1.489   5.733
  337    HA   ILE  44           HA       ILE  44  -5.173  -0.204   4.728
  338    HB   ILE  44           HB       ILE  44  -6.191   2.446   3.644
  339   1HG1  ILE  44          1HG1      ILE  44  -8.065   0.932   3.847
  340   2HG1  ILE  44          2HG1      ILE  44  -7.592   0.973   2.153
  341   1HG2  ILE  44          1HG2      ILE  44  -4.590   0.188   2.431
  342   2HG2  ILE  44          2HG2      ILE  44  -5.427   1.398   1.455
  343   3HG2  ILE  44          3HG2      ILE  44  -4.142   1.889   2.559
  344   1HD1  ILE  44          1HD1      ILE  44  -6.114  -1.100   2.789
  345   2HD1  ILE  44          2HD1      ILE  44  -7.202  -1.212   4.173
  346   3HD1  ILE  44          3HD1      ILE  44  -7.844  -1.315   2.539
  347    H    ASN  45           H        ASN  45  -5.240   3.139   5.911
  348    HA   ASN  45           HA       ASN  45  -2.668   3.981   5.210
  349   1HB   ASN  45          1HB       ASN  45  -4.289   4.546   7.700
  350   2HB   ASN  45          2HB       ASN  45  -2.788   5.390   7.312
  351   2HD2  ASN  45          2HD2      ASN  45  -5.352   6.732   7.448
  352   1HD2  ASN  45          1HD2      ASN  45  -5.725   7.290   5.889
  353    H    ASN  46           H        ASN  46  -3.579   1.727   7.772
  354    HA   ASN  46           HA       ASN  46  -0.805   1.748   8.837
  355   1HB   ASN  46          1HB       ASN  46  -1.708   0.234  10.566
  356   2HB   ASN  46          2HB       ASN  46  -2.648   1.721  10.448
  357   2HD2  ASN  46          2HD2      ASN  46  -4.763   1.056  10.905
  358   1HD2  ASN  46          1HD2      ASN  46  -5.563  -0.209  10.106
  359    H    ALA  47           H        ALA  47  -1.831   0.482   6.139
  360    HA   ALA  47           HA       ALA  47  -1.490  -2.346   6.352
  361   1HB   ALA  47          1HB       ALA  47  -2.315  -0.996   4.325
  362   2HB   ALA  47          2HB       ALA  47  -1.240  -2.351   3.983
  363   3HB   ALA  47          3HB       ALA  47  -0.613  -0.702   3.968
  364    H    LYS  48           H        LYS  48   0.344  -3.557   6.678
  365    HA   LYS  48           HA       LYS  48   2.922  -2.109   6.939
  366   1HB   LYS  48          1HB       LYS  48   2.041  -4.896   7.721
  367   2HB   LYS  48          2HB       LYS  48   3.698  -4.316   7.899
  368   1HG   LYS  48          1HG       LYS  48   2.902  -2.466   9.325
  369   2HG   LYS  48          2HG       LYS  48   1.246  -3.047   9.152
  370   1HD   LYS  48          1HD       LYS  48   1.885  -5.191  10.195
  371   2HD   LYS  48          2HD       LYS  48   3.541  -4.610  10.372
  372   1HE   LYS  48          1HE       LYS  48   2.783  -2.797  11.831
  373   2HE   LYS  48          2HE       LYS  48   1.105  -3.292  11.608
  374   1HZ   LYS  48          1HZ       LYS  48   2.053  -5.572  12.429
  375   2HZ   LYS  48          2HZ       LYS  48   3.240  -4.586  13.142
  376   3HZ   LYS  48          3HZ       LYS  48   1.606  -4.365  13.539
  377    H    THR  49           H        THR  49   1.336  -4.306   4.749
  378    HA   THR  49           HA       THR  49   3.838  -4.384   3.114
  379    HB   THR  49           HB       THR  49   3.549  -6.759   2.661
  380    HG1  THR  49           HG1      THR  49   1.910  -7.828   4.033
  381   1HG2  THR  49          1HG2      THR  49   4.815  -6.029   4.703
  382   2HG2  THR  49          2HG2      THR  49   3.347  -6.284   5.645
  383   3HG2  THR  49          3HG2      THR  49   4.125  -7.646   4.841
  384    H    VAL  50           H        VAL  50   3.458  -4.534   0.860
  385    HA   VAL  50           HA       VAL  50   1.039  -3.315  -0.087
  386    HB   VAL  50           HB       VAL  50   3.153  -4.880  -1.580
  387   1HG1  VAL  50          1HG1      VAL  50   0.845  -3.169  -2.508
  388   2HG1  VAL  50          2HG1      VAL  50   2.251  -3.472  -3.529
  389   3HG1  VAL  50          3HG1      VAL  50   1.244  -4.817  -2.992
  390   1HG2  VAL  50          1HG2      VAL  50   2.765  -1.899  -1.165
  391   2HG2  VAL  50          2HG2      VAL  50   4.022  -2.885  -0.421
  392   3HG2  VAL  50          3HG2      VAL  50   4.017  -2.635  -2.166
  393    H    GLU  51           H        GLU  51   2.172  -6.686  -0.026
  394    HA   GLU  51           HA       GLU  51   0.034  -7.808  -1.536
  395   1HB   GLU  51          1HB       GLU  51   0.633  -9.928  -0.487
  396   2HB   GLU  51          2HB       GLU  51   2.112  -9.040  -0.849
  397   1HG   GLU  51          1HG       GLU  51   2.039  -8.152   1.525
  398   2HG   GLU  51          2HG       GLU  51   0.737  -9.299   1.837
  399    H    GLY  52           H        GLY  52   0.346  -6.893   1.843
  400   1HA   GLY  52          1HA       GLY  52  -1.261  -6.723   3.540
  401   2HA   GLY  52          2HA       GLY  52  -2.116  -8.051   2.751
  402    H    VAL  53           H        VAL  53  -1.302  -5.057   1.070
  403    HA   VAL  53           HA       VAL  53  -3.789  -3.706   1.574
  404    HB   VAL  53           HB       VAL  53  -1.935  -3.470  -0.816
  405   1HG1  VAL  53          1HG1      VAL  53  -4.254  -1.813   0.183
  406   2HG1  VAL  53          2HG1      VAL  53  -3.002  -1.124  -0.849
  407   3HG1  VAL  53          3HG1      VAL  53  -3.991  -2.461  -1.436
  408   1HG2  VAL  53          1HG2      VAL  53  -0.955  -3.039   1.494
  409   2HG2  VAL  53          2HG2      VAL  53  -0.878  -1.673   0.380
  410   3HG2  VAL  53          3HG2      VAL  53  -2.106  -1.712   1.645
  411    H    LYS  54           H        LYS  54  -2.736  -5.748  -1.181
  412    HA   LYS  54           HA       LYS  54  -5.276  -5.616  -2.529
  413   1HB   LYS  54          1HB       LYS  54  -3.006  -7.615  -2.684
  414   2HB   LYS  54          2HB       LYS  54  -4.425  -7.672  -3.729
  415   1HG   LYS  54          1HG       LYS  54  -3.924  -5.511  -4.662
  416   2HG   LYS  54          2HG       LYS  54  -2.657  -5.230  -3.470
  417   1HD   LYS  54          1HD       LYS  54  -1.615  -5.894  -5.566
  418   2HD   LYS  54          2HD       LYS  54  -1.412  -7.194  -4.395
  419   1HE   LYS  54          1HE       LYS  54  -3.774  -7.202  -6.270
  420   2HE   LYS  54          2HE       LYS  54  -2.204  -7.796  -6.809
  421   1HZ   LYS  54          1HZ       LYS  54  -2.816  -8.830  -4.250
  422   2HZ   LYS  54          2HZ       LYS  54  -4.090  -9.160  -5.318
  423   3HZ   LYS  54          3HZ       LYS  54  -2.513  -9.667  -5.697
  424    H    ALA  55           H        ALA  55  -3.903  -7.936  -0.210
  425    HA   ALA  55           HA       ALA  55  -6.032  -9.843  -0.366
  426   1HB   ALA  55          1HB       ALA  55  -5.204 -10.556   1.902
  427   2HB   ALA  55          2HB       ALA  55  -4.109  -9.173   1.877
  428   3HB   ALA  55          3HB       ALA  55  -3.938 -10.457   0.679
  429    H    LEU  56           H        LEU  56  -5.567  -6.982   1.670
  430    HA   LEU  56           HA       LEU  56  -7.909  -7.451   3.264
  431   1HB   LEU  56          1HB       LEU  56  -6.077  -6.048   4.043
  432   2HB   LEU  56          2HB       LEU  56  -6.371  -4.904   2.738
  433    HG   LEU  56           HG       LEU  56  -8.598  -4.410   3.641
  434   1HD1  LEU  56          1HD1      LEU  56  -7.883  -6.643   5.535
  435   2HD1  LEU  56          2HD1      LEU  56  -8.974  -5.366   6.071
  436   3HD1  LEU  56          3HD1      LEU  56  -9.395  -6.353   4.675
  437   1HD2  LEU  56          1HD2      LEU  56  -6.380  -3.344   4.533
  438   2HD2  LEU  56          2HD2      LEU  56  -7.866  -3.073   5.440
  439   3HD2  LEU  56          3HD2      LEU  56  -6.706  -4.280   5.992
  440    H    ILE  57           H        ILE  57  -7.324  -5.534   0.314
  441    HA   ILE  57           HA       ILE  57 -10.073  -4.554   0.249
  442    HB   ILE  57           HB       ILE  57  -8.025  -4.769  -1.972
  443   1HG1  ILE  57          1HG1      ILE  57  -7.245  -3.290  -0.176
  444   2HG1  ILE  57          2HG1      ILE  57  -7.705  -2.325  -1.573
  445   1HG2  ILE  57          1HG2      ILE  57 -10.738  -3.473  -1.802
  446   2HG2  ILE  57          2HG2      ILE  57  -9.522  -2.911  -2.951
  447   3HG2  ILE  57          3HG2      ILE  57 -10.108  -4.570  -3.029
  448   1HD1  ILE  57          1HD1      ILE  57 -10.044  -2.196  -0.354
  449   2HD1  ILE  57          2HD1      ILE  57  -9.100  -2.618   1.072
  450   3HD1  ILE  57          3HD1      ILE  57  -8.725  -1.154   0.170
  451    H    ASP  58           H        ASP  58  -8.239  -7.203  -1.193
  452    HA   ASP  58           HA       ASP  58 -10.360  -8.182  -2.864
  453   1HB   ASP  58          1HB       ASP  58  -7.936  -9.536  -1.665
  454   2HB   ASP  58          2HB       ASP  58  -9.025 -10.334  -2.799
  455    H    GLU  59           H        GLU  59  -9.434  -8.958   0.501
  456    HA   GLU  59           HA       GLU  59 -11.432 -11.043   0.718
  457   1HB   GLU  59          1HB       GLU  59 -10.793 -11.245   2.979
  458   2HB   GLU  59          2HB       GLU  59  -9.317 -10.685   2.199
  459   1HG   GLU  59          1HG       GLU  59  -9.987  -8.347   2.824
  460   2HG   GLU  59          2HG       GLU  59 -11.279  -9.032   3.800
  461    H    ILE  60           H        ILE  60 -11.306  -7.592   1.443
  462    HA   ILE  60           HA       ILE  60 -13.909  -7.484   2.668
  463    HB   ILE  60           HB       ILE  60 -12.158  -5.376   1.390
  464   1HG1  ILE  60          1HG1      ILE  60 -12.924  -5.825   4.284
  465   2HG1  ILE  60          2HG1      ILE  60 -11.480  -6.524   3.553
  466   1HG2  ILE  60          1HG2      ILE  60 -14.852  -5.122   2.745
  467   2HG2  ILE  60          2HG2      ILE  60 -13.722  -3.772   2.625
  468   3HG2  ILE  60          3HG2      ILE  60 -14.374  -4.510   1.161
  469   1HD1  ILE  60          1HD1      ILE  60 -10.799  -4.185   2.877
  470   2HD1  ILE  60          2HD1      ILE  60 -12.146  -3.581   3.839
  471   3HD1  ILE  60          3HD1      ILE  60 -10.828  -4.454   4.619
  472    H    LEU  61           H        LEU  61 -12.743  -6.895  -0.655
  473    HA   LEU  61           HA       LEU  61 -15.377  -6.250  -1.660
  474   1HB   LEU  61          1HB       LEU  61 -12.827  -7.129  -3.053
  475   2HB   LEU  61          2HB       LEU  61 -14.306  -6.723  -3.924
  476    HG   LEU  61           HG       LEU  61 -12.763  -4.868  -2.079
  477   1HD1  LEU  61          1HD1      LEU  61 -11.773  -5.476  -4.366
  478   2HD1  LEU  61          2HD1      LEU  61 -13.163  -4.653  -5.070
  479   3HD1  LEU  61          3HD1      LEU  61 -12.029  -3.756  -4.062
  480   1HD2  LEU  61          1HD2      LEU  61 -15.416  -4.645  -3.482
  481   2HD2  LEU  61          2HD2      LEU  61 -14.919  -4.003  -1.916
  482   3HD2  LEU  61          3HD2      LEU  61 -14.402  -3.204  -3.398
  483    H    ALA  62           H        ALA  62 -13.558  -9.225  -1.229
  484    HA   ALA  62           HA       ALA  62 -15.170 -10.929  -2.847
  485   1HB   ALA  62          1HB       ALA  62 -13.756 -11.565  -0.237
  486   2HB   ALA  62          2HB       ALA  62 -14.347 -12.756  -1.396
  487   3HB   ALA  62          3HB       ALA  62 -13.036 -11.664  -1.844
  488    H    ALA  63           H        ALA  63 -15.491  -9.972   0.579
  489    HA   ALA  63           HA       ALA  63 -17.804 -11.532   1.154
  490   1HB   ALA  63          1HB       ALA  63 -18.173  -9.954   3.008
  491   2HB   ALA  63          2HB       ALA  63 -16.466 -10.381   2.893
  492   3HB   ALA  63          3HB       ALA  63 -17.030  -8.824   2.284
  493    H    LEU  64           H        LEU  64 -17.549  -8.128   0.077
  494    HA   LEU  64           HA       LEU  64 -20.401  -7.805  -0.182
  495   1HB   LEU  64          1HB       LEU  64 -18.046  -6.268  -1.313
  496   2HB   LEU  64          2HB       LEU  64 -19.713  -5.760  -1.557
  497    HG   LEU  64           HG       LEU  64 -18.683  -6.305   1.231
  498   1HD1  LEU  64          1HD1      LEU  64 -18.431  -3.703  -0.307
  499   2HD1  LEU  64          2HD1      LEU  64 -18.120  -3.899   1.418
  500   3HD1  LEU  64          3HD1      LEU  64 -17.096  -4.718   0.238
  501   1HD2  LEU  64          1HD2      LEU  64 -20.872  -4.565   0.042
  502   2HD2  LEU  64          2HD2      LEU  64 -21.077  -5.985   1.068
  503   3HD2  LEU  64          3HD2      LEU  64 -20.396  -4.505   1.737
  504    HA   PRO  65           HA       PRO  65 -21.032  -9.916  -4.052
  505   1HB   PRO  65          1HB       PRO  65 -22.782  -8.015  -5.261
  506   2HB   PRO  65          2HB       PRO  65 -23.245  -9.417  -4.291
  507   1HG   PRO  65          1HG       PRO  65 -23.215  -6.563  -3.539
  508   2HG   PRO  65          2HG       PRO  65 -24.088  -7.909  -2.793
  509   1HD   PRO  65          1HD       PRO  65 -21.841  -6.640  -1.692
  510   2HD   PRO  65          2HD       PRO  65 -22.432  -8.252  -1.225

  No H/Q in entry =         510
  Start of MODEL   30
    1    H1   MET   1           H1       MET   1  35.045  -1.387 -10.781
    2    H2   MET   1           H2       MET   1  35.073  -2.652  -9.648
    3    H3   MET   1           H3       MET   1  35.417  -2.968 -11.279
    4    HA   MET   1           HA       MET   1  33.242  -2.845 -11.935
    5   1HB   MET   1          1HB       MET   1  33.618  -4.701 -10.271
    6   2HB   MET   1          2HB       MET   1  32.985  -3.636  -9.019
    7   1HG   MET   1          1HG       MET   1  31.150  -5.003  -9.761
    8   2HG   MET   1          2HG       MET   1  30.887  -3.390 -10.417
    9   1HE   MET   1          1HE       MET   1  31.671  -6.971 -10.855
   10   2HE   MET   1          2HE       MET   1  31.919  -7.265 -12.580
   11   3HE   MET   1          3HE       MET   1  33.206  -6.556 -11.612
   12    H    LYS   2           H        LYS   2  32.755  -1.901  -8.536
   13    HA   LYS   2           HA       LYS   2  31.710   0.741  -9.372
   14   1HB   LYS   2          1HB       LYS   2  29.757  -0.773  -9.548
   15   2HB   LYS   2          2HB       LYS   2  30.012  -1.287  -7.880
   16   1HG   LYS   2          1HG       LYS   2  29.548   0.912  -7.039
   17   2HG   LYS   2          2HG       LYS   2  29.583   1.606  -8.659
   18   1HD   LYS   2          1HD       LYS   2  27.263   1.342  -7.959
   19   2HD   LYS   2          2HD       LYS   2  27.605   0.203  -9.260
   20   1HE   LYS   2          1HE       LYS   2  27.698  -1.639  -7.780
   21   2HE   LYS   2          2HE       LYS   2  27.886  -0.602  -6.367
   22   1HZ   LYS   2          1HZ       LYS   2  25.471  -0.360  -8.018
   23   2HZ   LYS   2          2HZ       LYS   2  25.594  -1.643  -6.911
   24   3HZ   LYS   2          3HZ       LYS   2  25.681  -0.036  -6.366
   25    H    ALA   3           H        ALA   3  31.367   2.151  -7.479
   26    HA   ALA   3           HA       ALA   3  33.424   1.805  -5.495
   27   1HB   ALA   3          1HB       ALA   3  32.709   3.895  -4.623
   28   2HB   ALA   3          2HB       ALA   3  32.391   4.003  -6.354
   29   3HB   ALA   3          3HB       ALA   3  31.069   3.682  -5.234
   30    H    ILE   4           H        ILE   4  32.306  -0.494  -5.108
   31    HA   ILE   4           HA       ILE   4  30.650  -0.226  -2.620
   32    HB   ILE   4           HB       ILE   4  29.287  -1.004  -4.563
   33   1HG1  ILE   4          1HG1      ILE   4  29.745  -3.281  -2.627
   34   2HG1  ILE   4          2HG1      ILE   4  28.955  -1.780  -2.144
   35   1HG2  ILE   4          1HG2      ILE   4  31.328  -2.176  -5.616
   36   2HG2  ILE   4          2HG2      ILE   4  30.973  -3.508  -4.516
   37   3HG2  ILE   4          3HG2      ILE   4  29.780  -3.013  -5.716
   38   1HD1  ILE   4          1HD1      ILE   4  27.298  -2.107  -3.985
   39   2HD1  ILE   4          2HD1      ILE   4  28.045  -3.667  -4.337
   40   3HD1  ILE   4          3HD1      ILE   4  27.250  -3.397  -2.787
   41    H    PHE   5           H        PHE   5  31.576  -1.270  -0.909
   42    HA   PHE   5           HA       PHE   5  33.892  -3.094  -1.457
   43   1HB   PHE   5          1HB       PHE   5  33.154  -1.424   0.960
   44   2HB   PHE   5          2HB       PHE   5  34.476  -2.591   0.947
   45    HD1  PHE   5           HD1      PHE   5  33.297   0.663  -0.290
   46    HD2  PHE   5           HD2      PHE   5  36.466  -2.233  -0.452
   47    HE1  PHE   5           HE1      PHE   5  34.781   2.345  -1.348
   48    HE2  PHE   5           HE2      PHE   5  37.949  -0.551  -1.509
   49    HZ   PHE   5           HZ       PHE   5  37.107   1.737  -1.956
   50    H    VAL   6           H        VAL   6  30.704  -3.403  -0.908
   51    HA   VAL   6           HA       VAL   6  31.034  -5.802   0.881
   52    HB   VAL   6           HB       VAL   6  28.655  -5.414   1.525
   53   1HG1  VAL   6          1HG1      VAL   6  30.535  -4.500   2.882
   54   2HG1  VAL   6          2HG1      VAL   6  30.449  -3.005   1.953
   55   3HG1  VAL   6          3HG1      VAL   6  29.093  -3.488   2.973
   56   1HG2  VAL   6          1HG2      VAL   6  29.042  -2.881  -0.097
   57   2HG2  VAL   6          2HG2      VAL   6  27.935  -4.197  -0.480
   58   3HG2  VAL   6          3HG2      VAL   6  27.661  -3.203   0.950
   59    H    LEU   7           H        LEU   7  29.868  -7.691   0.267
   60    HA   LEU   7           HA       LEU   7  29.483  -8.008  -2.591
   61   1HB   LEU   7          1HB       LEU   7  28.817  -9.819  -0.252
   62   2HB   LEU   7          2HB       LEU   7  28.642 -10.296  -1.938
   63    HG   LEU   7           HG       LEU   7  31.252  -9.340  -0.718
   64   1HD1  LEU   7          1HD1      LEU   7  30.373 -11.485   0.280
   65   2HD1  LEU   7          2HD1      LEU   7  30.409 -12.184  -1.339
   66   3HD1  LEU   7          3HD1      LEU   7  31.908 -11.663  -0.570
   67   1HD2  LEU   7          1HD2      LEU   7  30.425 -10.442  -3.407
   68   2HD2  LEU   7          2HD2      LEU   7  31.471  -9.067  -3.044
   69   3HD2  LEU   7          3HD2      LEU   7  32.067 -10.707  -2.820
   70    H    ASN   8           H        ASN   8  27.020  -9.619  -0.900
   71    HA   ASN   8           HA       ASN   8  24.970  -7.823  -2.124
   72   1HB   ASN   8          1HB       ASN   8  23.443  -9.713  -1.893
   73   2HB   ASN   8          2HB       ASN   8  24.915 -10.253  -2.700
   74   2HD2  ASN   8          2HD2      ASN   8  23.246 -12.106  -1.298
   75   1HD2  ASN   8          1HD2      ASN   8  24.086 -12.662   0.067
   76    H    ALA   9           H        ALA   9  25.838  -6.506  -0.027
   77    HA   ALA   9           HA       ALA   9  24.890  -7.267   2.553
   78   1HB   ALA   9          1HB       ALA   9  26.454  -5.470   2.459
   79   2HB   ALA   9          2HB       ALA   9  25.462  -4.569   1.312
   80   3HB   ALA   9          3HB       ALA   9  24.940  -4.741   2.987
   81    H    GLN  10           H        GLN  10  23.268  -5.879  -0.205
   82    HA   GLN  10           HA       GLN  10  20.880  -5.138   1.349
   83   1HB   GLN  10          1HB       GLN  10  19.930  -4.708  -0.985
   84   2HB   GLN  10          2HB       GLN  10  21.305  -3.711  -0.519
   85   1HG   GLN  10          1HG       GLN  10  21.739  -6.311  -1.990
   86   2HG   GLN  10          2HG       GLN  10  21.313  -4.849  -2.875
   87   2HE2  GLN  10          2HE2      GLN  10  23.036  -3.966  -0.093
   88   1HE2  GLN  10          1HE2      GLN  10  24.578  -3.830  -0.789
   89    H    HIS  11           H        HIS  11  21.561  -7.881   1.624
   90    HA   HIS  11           HA       HIS  11  20.206  -9.602  -0.198
   91   1HB   HIS  11          1HB       HIS  11  21.752 -10.432   1.548
   92   2HB   HIS  11          2HB       HIS  11  20.603  -9.946   2.794
   93    HD1  HIS  11           HD1      HIS  11  18.459 -11.371   3.075
   94    HD2  HIS  11           HD2      HIS  11  20.991 -12.756   0.067
   95    HE1  HIS  11           HE1      HIS  11  17.609 -13.667   2.425
   96    H    ASP  12           H        ASP  12  19.071  -7.936   2.739
   97    HA   ASP  12           HA       ASP  12  16.298  -8.865   2.219
   98   1HB   ASP  12          1HB       ASP  12  15.785  -7.778   4.370
   99   2HB   ASP  12          2HB       ASP  12  17.148  -8.882   4.542
  100    H    GLU  13           H        GLU  13  15.912  -7.636   0.252
  101    HA   GLU  13           HA       GLU  13  16.298  -4.771   0.174
  102   1HB   GLU  13          1HB       GLU  13  15.025  -4.832  -1.903
  103   2HB   GLU  13          2HB       GLU  13  16.159  -6.180  -1.873
  104   1HG   GLU  13          1HG       GLU  13  14.190  -7.237  -2.567
  105   2HG   GLU  13          2HG       GLU  13  14.146  -7.513  -0.827
  106    H    ALA  14           H        ALA  14  14.789  -3.127   0.467
  107    HA   ALA  14           HA       ALA  14  12.372  -3.878   2.059
  108   1HB   ALA  14          1HB       ALA  14  12.531  -1.287   2.549
  109   2HB   ALA  14          2HB       ALA  14  14.181  -1.480   1.959
  110   3HB   ALA  14          3HB       ALA  14  13.635  -2.402   3.357
  111    H    VAL  15           H        VAL  15  10.494  -2.288   1.746
  112    HA   VAL  15           HA       VAL  15   9.904  -2.113  -1.150
  113    HB   VAL  15           HB       VAL  15   8.162  -1.532   1.267
  114   1HG1  VAL  15          1HG1      VAL  15   7.542  -1.850  -1.682
  115   2HG1  VAL  15          2HG1      VAL  15   6.317  -1.825  -0.414
  116   3HG1  VAL  15          3HG1      VAL  15   7.318  -0.402  -0.701
  117   1HG2  VAL  15          1HG2      VAL  15   8.401  -3.997  -0.490
  118   2HG2  VAL  15          2HG2      VAL  15   8.865  -3.878   1.209
  119   3HG2  VAL  15          3HG2      VAL  15   7.168  -3.755   0.747
  120    H    ASP  16           H        ASP  16   9.775  -0.183  -2.261
  121    HA   ASP  16           HA       ASP  16  10.931   2.195  -1.200
  122   1HB   ASP  16          1HB       ASP  16   9.096   1.750  -3.573
  123   2HB   ASP  16          2HB       ASP  16   9.861   3.299  -3.218
  124    H    ALA  17           H        ALA  17  10.026   3.955  -0.169
  125    HA   ALA  17           HA       ALA  17   7.579   3.662   1.252
  126   1HB   ALA  17          1HB       ALA  17   9.369   5.172   1.986
  127   2HB   ALA  17          2HB       ALA  17   9.117   6.185   0.564
  128   3HB   ALA  17          3HB       ALA  17   7.860   6.065   1.796
  129    H    ASN  18           H        ASN  18   8.306   5.354  -1.797
  130    HA   ASN  18           HA       ASN  18   5.764   6.597  -2.122
  131   1HB   ASN  18          1HB       ASN  18   7.807   5.639  -4.137
  132   2HB   ASN  18          2HB       ASN  18   6.347   6.514  -4.601
  133   2HD2  ASN  18          2HD2      ASN  18   6.117   8.437  -2.609
  134   1HD2  ASN  18          1HD2      ASN  18   7.479   9.451  -2.610
  135    H    SER  19           H        SER  19   6.887   3.344  -3.050
  136    HA   SER  19           HA       SER  19   4.580   2.583  -4.532
  137   1HB   SER  19          1HB       SER  19   6.459   0.923  -2.835
  138   2HB   SER  19          2HB       SER  19   5.234   0.240  -3.900
  139    HG   SER  19           HG       SER  19   6.342   1.767  -5.500
  140    H    LEU  20           H        LEU  20   5.252   2.423  -1.041
  141    HA   LEU  20           HA       LEU  20   2.849   1.035  -0.341
  142   1HB   LEU  20          1HB       LEU  20   4.771   2.808   1.150
  143   2HB   LEU  20          2HB       LEU  20   3.293   2.266   1.940
  144    HG   LEU  20           HG       LEU  20   5.089   0.261   0.561
  145   1HD1  LEU  20          1HD1      LEU  20   5.400   1.285   3.402
  146   2HD1  LEU  20          2HD1      LEU  20   6.260  -0.088   2.708
  147   3HD1  LEU  20          3HD1      LEU  20   6.549   1.535   2.086
  148   1HD2  LEU  20          1HD2      LEU  20   3.145   0.163   2.897
  149   2HD2  LEU  20          2HD2      LEU  20   2.919  -0.562   1.308
  150   3HD2  LEU  20          3HD2      LEU  20   4.150  -1.193   2.397
  151    H    ALA  21           H        ALA  21   3.604   4.523  -0.413
  152    HA   ALA  21           HA       ALA  21   1.048   5.405   0.431
  153   1HB   ALA  21          1HB       ALA  21   3.013   6.770  -1.430
  154   2HB   ALA  21          2HB       ALA  21   2.986   6.909   0.327
  155   3HB   ALA  21          3HB       ALA  21   1.656   7.560  -0.629
  156    H    GLU  22           H        GLU  22   2.311   4.968  -2.899
  157    HA   GLU  22           HA       GLU  22  -0.091   5.740  -4.213
  158   1HB   GLU  22          1HB       GLU  22   2.151   5.376  -5.314
  159   2HB   GLU  22          2HB       GLU  22   1.861   3.640  -5.185
  160   1HG   GLU  22          1HG       GLU  22  -0.200   3.870  -6.499
  161   2HG   GLU  22          2HG       GLU  22   0.060   5.609  -6.621
  162    H    ALA  23           H        ALA  23   1.003   2.504  -3.166
  163    HA   ALA  23           HA       ALA  23  -1.249   1.071  -4.160
  164   1HB   ALA  23          1HB       ALA  23   0.446   0.523  -1.701
  165   2HB   ALA  23          2HB       ALA  23   0.766  -0.070  -3.331
  166   3HB   ALA  23          3HB       ALA  23  -0.655  -0.633  -2.450
  167    H    LYS  24           H        LYS  24  -0.677   2.666  -1.032
  168    HA   LYS  24           HA       LYS  24  -3.248   1.953   0.072
  169   1HB   LYS  24          1HB       LYS  24  -1.238   4.109   0.770
  170   2HB   LYS  24          2HB       LYS  24  -2.706   3.813   1.704
  171   1HG   LYS  24          1HG       LYS  24  -2.001   1.478   2.085
  172   2HG   LYS  24          2HG       LYS  24  -0.531   1.770   1.155
  173   1HD   LYS  24          1HD       LYS  24   0.148   3.511   2.764
  174   2HD   LYS  24          2HD       LYS  24  -1.318   3.223   3.697
  175   1HE   LYS  24          1HE       LYS  24  -0.630   1.006   4.266
  176   2HE   LYS  24          2HE       LYS  24   0.686   1.040   3.095
  177   1HZ   LYS  24          1HZ       LYS  24   1.700   2.838   4.392
  178   2HZ   LYS  24          2HZ       LYS  24   0.458   2.706   5.542
  179   3HZ   LYS  24          3HZ       LYS  24   1.534   1.415   5.300
  180    H    VAL  25           H        VAL  25  -2.007   4.793  -1.679
  181    HA   VAL  25           HA       VAL  25  -4.406   6.350  -1.419
  182    HB   VAL  25           HB       VAL  25  -2.144   6.446  -3.420
  183   1HG1  VAL  25          1HG1      VAL  25  -4.571   8.224  -3.111
  184   2HG1  VAL  25          2HG1      VAL  25  -3.096   8.762  -3.913
  185   3HG1  VAL  25          3HG1      VAL  25  -4.010   7.404  -4.567
  186   1HG2  VAL  25          1HG2      VAL  25  -1.836   7.049  -0.926
  187   2HG2  VAL  25          2HG2      VAL  25  -1.334   8.257  -2.108
  188   3HG2  VAL  25          3HG2      VAL  25  -2.871   8.433  -1.260
  189    H    LEU  26           H        LEU  26  -3.244   4.176  -4.015
  190    HA   LEU  26           HA       LEU  26  -5.459   4.566  -5.765
  191   1HB   LEU  26          1HB       LEU  26  -3.665   2.164  -5.326
  192   2HB   LEU  26          2HB       LEU  26  -4.867   2.240  -6.611
  193    HG   LEU  26           HG       LEU  26  -2.639   4.268  -6.241
  194   1HD1  LEU  26          1HD1      LEU  26  -2.846   1.855  -8.069
  195   2HD1  LEU  26          2HD1      LEU  26  -1.607   3.103  -8.202
  196   3HD1  LEU  26          3HD1      LEU  26  -1.685   2.084  -6.763
  197   1HD2  LEU  26          1HD2      LEU  26  -4.829   3.848  -8.277
  198   2HD2  LEU  26          2HD2      LEU  26  -4.256   5.347  -7.552
  199   3HD2  LEU  26          3HD2      LEU  26  -3.298   4.554  -8.793
  200    H    ALA  27           H        ALA  27  -4.961   2.179  -3.173
  201    HA   ALA  27           HA       ALA  27  -7.538   0.931  -3.524
  202   1HB   ALA  27          1HB       ALA  27  -5.948  -0.392  -2.397
  203   2HB   ALA  27          2HB       ALA  27  -5.465   0.931  -1.337
  204   3HB   ALA  27          3HB       ALA  27  -7.019   0.135  -1.099
  205    H    ASN  28           H        ASN  28  -6.399   3.690  -1.662
  206    HA   ASN  28           HA       ASN  28  -8.564   3.922   0.160
  207   1HB   ASN  28          1HB       ASN  28  -6.501   5.257   0.334
  208   2HB   ASN  28          2HB       ASN  28  -6.936   6.128  -1.137
  209   2HD2  ASN  28          2HD2      ASN  28  -7.766   5.698   2.283
  210   1HD2  ASN  28          1HD2      ASN  28  -8.785   7.052   2.386
  211    H    ARG  29           H        ARG  29  -8.208   5.431  -3.088
  212    HA   ARG  29           HA       ARG  29 -10.822   6.637  -2.962
  213   1HB   ARG  29          1HB       ARG  29 -10.523   6.888  -5.463
  214   2HB   ARG  29          2HB       ARG  29  -9.275   7.625  -4.463
  215   1HG   ARG  29          1HG       ARG  29  -7.706   5.918  -4.948
  216   2HG   ARG  29          2HG       ARG  29  -8.952   4.807  -5.497
  217   1HD   ARG  29          1HD       ARG  29  -8.736   5.548  -7.634
  218   2HD   ARG  29          2HD       ARG  29  -9.018   7.213  -7.152
  219    HE   ARG  29           HE       ARG  29  -6.526   6.100  -7.958
  220   1HH1  ARG  29          1HH1      ARG  29  -4.566   7.086  -7.487
  221   2HH1  ARG  29          2HH1      ARG  29  -4.466   8.204  -6.169
  222   1HH2  ARG  29          1HH2      ARG  29  -7.815   7.947  -5.346
  223   2HH2  ARG  29          2HH2      ARG  29  -6.302   8.693  -4.960
  224    H    GLU  30           H        GLU  30  -9.731   3.455  -4.012
  225    HA   GLU  30           HA       GLU  30 -11.985   2.775  -5.609
  226   1HB   GLU  30          1HB       GLU  30 -10.205   1.060  -3.868
  227   2HB   GLU  30          2HB       GLU  30 -11.446   0.393  -4.931
  228   1HG   GLU  30          1HG       GLU  30 -10.385   1.315  -6.879
  229   2HG   GLU  30          2HG       GLU  30  -9.262   2.254  -5.896
  230    H    LEU  31           H        LEU  31 -11.491   2.244  -2.102
  231    HA   LEU  31           HA       LEU  31 -14.075   1.100  -1.647
  232   1HB   LEU  31          1HB       LEU  31 -12.590   2.804   0.367
  233   2HB   LEU  31          2HB       LEU  31 -13.636   1.418   0.672
  234    HG   LEU  31           HG       LEU  31 -10.895   1.418  -0.589
  235   1HD1  LEU  31          1HD1      LEU  31 -11.220   1.430   1.957
  236   2HD1  LEU  31          2HD1      LEU  31 -11.916  -0.178   1.768
  237   3HD1  LEU  31          3HD1      LEU  31 -10.241   0.118   1.302
  238   1HD2  LEU  31          1HD2      LEU  31 -13.037  -0.717  -0.516
  239   2HD2  LEU  31          2HD2      LEU  31 -12.076  -0.175  -1.892
  240   3HD2  LEU  31          3HD2      LEU  31 -11.330  -1.146  -0.625
  241    H    ASP  32           H        ASP  32 -12.882   4.417  -1.599
  242    HA   ASP  32           HA       ASP  32 -15.234   5.701  -0.658
  243   1HB   ASP  32          1HB       ASP  32 -13.033   6.799  -0.866
  244   2HB   ASP  32          2HB       ASP  32 -13.144   6.687  -2.621
  245    H    LYS  33           H        LYS  33 -14.219   4.763  -3.939
  246    HA   LYS  33           HA       LYS  33 -16.364   5.979  -5.361
  247   1HB   LYS  33          1HB       LYS  33 -14.373   5.027  -6.474
  248   2HB   LYS  33          2HB       LYS  33 -14.890   3.408  -6.001
  249   1HG   LYS  33          1HG       LYS  33 -16.875   3.556  -7.353
  250   2HG   LYS  33          2HG       LYS  33 -16.603   5.271  -7.661
  251   1HD   LYS  33          1HD       LYS  33 -15.915   3.934  -9.606
  252   2HD   LYS  33          2HD       LYS  33 -14.518   4.719  -8.872
  253   1HE   LYS  33          1HE       LYS  33 -15.286   1.928  -8.038
  254   2HE   LYS  33          2HE       LYS  33 -14.351   2.189  -9.509
  255   1HZ   LYS  33          1HZ       LYS  33 -13.348   3.715  -7.316
  256   2HZ   LYS  33          2HZ       LYS  33 -13.359   2.051  -6.970
  257   3HZ   LYS  33          3HZ       LYS  33 -12.536   2.626  -8.337
  258    H    TYR  34           H        TYR  34 -16.083   2.663  -4.044
  259    HA   TYR  34           HA       TYR  34 -18.771   1.935  -4.801
  260   1HB   TYR  34          1HB       TYR  34 -16.815   0.740  -2.828
  261   2HB   TYR  34          2HB       TYR  34 -18.395   0.032  -3.162
  262    HD1  TYR  34           HD1      TYR  34 -14.977   0.200  -4.219
  263    HD2  TYR  34           HD2      TYR  34 -18.982  -0.393  -5.660
  264    HE1  TYR  34           HE1      TYR  34 -14.084  -0.877  -6.264
  265    HE2  TYR  34           HE2      TYR  34 -18.086  -1.473  -7.703
  266    HH   TYR  34           HH       TYR  34 -15.518  -1.189  -8.954
  267    H    GLY  35           H        GLY  35 -17.364   3.489  -1.981
  268   1HA   GLY  35          1HA       GLY  35 -20.120   4.023  -0.988
  269   2HA   GLY  35          2HA       GLY  35 -18.670   4.912  -0.531
  270    H    VAL  36           H        VAL  36 -17.321   2.132  -0.194
  271    HA   VAL  36           HA       VAL  36 -18.676   0.785   1.940
  272    HB   VAL  36           HB       VAL  36 -15.664   0.886   1.717
  273   1HG1  VAL  36          1HG1      VAL  36 -17.655  -1.314   2.355
  274   2HG1  VAL  36          2HG1      VAL  36 -15.902  -1.494   2.349
  275   3HG1  VAL  36          3HG1      VAL  36 -16.675  -0.441   3.532
  276   1HG2  VAL  36          1HG2      VAL  36 -17.650  -0.427  -0.149
  277   2HG2  VAL  36          2HG2      VAL  36 -16.294   0.621  -0.563
  278   3HG2  VAL  36          3HG2      VAL  36 -15.995  -1.016   0.021
  279    H    SER  37           H        SER  37 -17.864   0.772   4.258
  280    HA   SER  37           HA       SER  37 -18.060   3.348   5.414
  281   1HB   SER  37          1HB       SER  37 -16.783   0.857   6.580
  282   2HB   SER  37          2HB       SER  37 -17.280   2.272   7.503
  283    HG   SER  37           HG       SER  37 -19.346   1.633   6.058
  284    H    ASP  38           H        ASP  38 -16.476   4.758   6.291
  285    HA   ASP  38           HA       ASP  38 -13.999   4.899   4.820
  286   1HB   ASP  38          1HB       ASP  38 -13.514   6.843   6.219
  287   2HB   ASP  38          2HB       ASP  38 -15.201   6.897   5.707
  288    H    TYR  39           H        TYR  39 -14.935   3.135   7.550
  289    HA   TYR  39           HA       TYR  39 -12.567   3.131   9.122
  290   1HB   TYR  39          1HB       TYR  39 -14.609   2.118   9.952
  291   2HB   TYR  39          2HB       TYR  39 -14.618   0.953   8.627
  292    HD1  TYR  39           HD1      TYR  39 -13.062   1.886  11.826
  293    HD2  TYR  39           HD2      TYR  39 -12.997  -0.869   8.533
  294    HE1  TYR  39           HE1      TYR  39 -11.617   0.352  13.136
  295    HE2  TYR  39           HE2      TYR  39 -11.558  -2.398   9.835
  296    HH   TYR  39           HH       TYR  39 -10.843  -2.872  11.981
  297    H    TYR  40           H        TYR  40 -13.502   1.084   6.355
  298    HA   TYR  40           HA       TYR  40 -11.245  -0.625   6.386
  299   1HB   TYR  40          1HB       TYR  40 -12.923   0.344   4.059
  300   2HB   TYR  40          2HB       TYR  40 -11.754  -0.974   3.961
  301    HD1  TYR  40           HD1      TYR  40 -12.095  -3.056   5.257
  302    HD2  TYR  40           HD2      TYR  40 -15.048   0.056   5.169
  303    HE1  TYR  40           HE1      TYR  40 -13.787  -4.641   6.137
  304    HE2  TYR  40           HE2      TYR  40 -16.743  -1.525   6.053
  305    HH   TYR  40           HH       TYR  40 -16.440  -4.761   5.990
  306    H    LYS  41           H        LYS  41 -11.656   2.567   4.819
  307    HA   LYS  41           HA       LYS  41  -9.145   2.518   3.440
  308   1HB   LYS  41          1HB       LYS  41 -10.814   4.817   4.499
  309   2HB   LYS  41          2HB       LYS  41  -9.366   5.042   3.517
  310   1HG   LYS  41          1HG       LYS  41 -10.402   3.622   1.740
  311   2HG   LYS  41          2HG       LYS  41 -11.873   3.540   2.706
  312   1HD   LYS  41          1HD       LYS  41 -10.674   6.209   1.969
  313   2HD   LYS  41          2HD       LYS  41 -11.712   5.351   0.837
  314   1HE   LYS  41          1HE       LYS  41 -13.476   5.237   2.590
  315   2HE   LYS  41          2HE       LYS  41 -12.454   6.216   3.643
  316   1HZ   LYS  41          1HZ       LYS  41 -12.549   7.510   1.200
  317   2HZ   LYS  41          2HZ       LYS  41 -14.143   7.046   1.538
  318   3HZ   LYS  41          3HZ       LYS  41 -13.282   7.995   2.653
  319    H    ASN  42           H        ASN  42 -10.138   3.585   6.655
  320    HA   ASN  42           HA       ASN  42  -7.633   4.628   7.482
  321   1HB   ASN  42          1HB       ASN  42  -9.719   4.967   8.762
  322   2HB   ASN  42          2HB       ASN  42  -9.755   3.247   9.152
  323   2HD2  ASN  42          2HD2      ASN  42  -7.700   6.170   9.548
  324   1HD2  ASN  42          1HD2      ASN  42  -6.982   5.654  10.998
  325    H    LEU  43           H        LEU  43  -8.988   1.345   7.639
  326    HA   LEU  43           HA       LEU  43  -6.819   0.145   9.037
  327   1HB   LEU  43          1HB       LEU  43  -8.986  -0.985   8.701
  328   2HB   LEU  43          2HB       LEU  43  -8.675  -1.081   6.970
  329    HG   LEU  43           HG       LEU  43  -6.737  -2.522   7.363
  330   1HD1  LEU  43          1HD1      LEU  43  -7.319  -1.857  10.244
  331   2HD1  LEU  43          2HD1      LEU  43  -6.561  -3.400   9.846
  332   3HD1  LEU  43          3HD1      LEU  43  -5.770  -1.891   9.401
  333   1HD2  LEU  43          1HD2      LEU  43  -9.133  -3.429   7.296
  334   2HD2  LEU  43          2HD2      LEU  43  -7.928  -4.486   8.032
  335   3HD2  LEU  43          3HD2      LEU  43  -9.026  -3.556   9.051
  336    H    ILE  44           H        ILE  44  -7.356   0.722   5.579
  337    HA   ILE  44           HA       ILE  44  -5.065  -0.668   4.601
  338    HB   ILE  44           HB       ILE  44  -6.534   1.780   3.581
  339   1HG1  ILE  44          1HG1      ILE  44  -7.566  -0.650   3.687
  340   2HG1  ILE  44          2HG1      ILE  44  -7.774   0.323   2.237
  341   1HG2  ILE  44          1HG2      ILE  44  -4.237   0.243   2.365
  342   2HG2  ILE  44          2HG2      ILE  44  -5.350   1.196   1.384
  343   3HG2  ILE  44          3HG2      ILE  44  -4.373   1.983   2.624
  344   1HD1  ILE  44          1HD1      ILE  44  -5.515  -1.677   2.567
  345   2HD1  ILE  44          2HD1      ILE  44  -7.060  -2.077   1.822
  346   3HD1  ILE  44          3HD1      ILE  44  -6.021  -0.862   1.087
  347    H    ASN  45           H        ASN  45  -5.499   2.623   5.835
  348    HA   ASN  45           HA       ASN  45  -2.976   3.698   5.242
  349   1HB   ASN  45          1HB       ASN  45  -4.927   4.895   6.317
  350   2HB   ASN  45          2HB       ASN  45  -4.461   4.136   7.839
  351   2HD2  ASN  45          2HD2      ASN  45  -4.087   6.495   8.509
  352   1HD2  ASN  45          1HD2      ASN  45  -2.585   7.192   8.139
  353    H    ASN  46           H        ASN  46  -3.881   1.332   7.670
  354    HA   ASN  46           HA       ASN  46  -1.135   1.412   8.847
  355   1HB   ASN  46          1HB       ASN  46  -3.169   1.471  10.336
  356   2HB   ASN  46          2HB       ASN  46  -3.550  -0.159   9.781
  357   2HD2  ASN  46          2HD2      ASN  46  -2.966  -1.544  11.467
  358   1HD2  ASN  46          1HD2      ASN  46  -1.484  -1.492  12.294
  359    H    ALA  47           H        ALA  47  -2.077   0.102   6.169
  360    HA   ALA  47           HA       ALA  47  -1.932  -2.729   6.477
  361   1HB   ALA  47          1HB       ALA  47  -2.504  -1.319   4.364
  362   2HB   ALA  47          2HB       ALA  47  -1.632  -2.835   4.140
  363   3HB   ALA  47          3HB       ALA  47  -0.763  -1.303   4.085
  364    H    LYS  48           H        LYS  48  -0.201  -4.089   6.823
  365    HA   LYS  48           HA       LYS  48   2.296  -2.957   7.707
  366   1HB   LYS  48          1HB       LYS  48   1.468  -5.797   7.076
  367   2HB   LYS  48          2HB       LYS  48   3.052  -5.378   7.727
  368   1HG   LYS  48          1HG       LYS  48   1.917  -4.260   9.654
  369   2HG   LYS  48          2HG       LYS  48   0.369  -4.822   9.032
  370   1HD   LYS  48          1HD       LYS  48   2.693  -6.617   9.802
  371   2HD   LYS  48          2HD       LYS  48   1.270  -6.329  10.799
  372   1HE   LYS  48          1HE       LYS  48   1.474  -7.826   8.193
  373   2HE   LYS  48          2HE       LYS  48   0.741  -8.339   9.708
  374   1HZ   LYS  48          1HZ       LYS  48  -0.804  -6.313   9.260
  375   2HZ   LYS  48          2HZ       LYS  48  -0.324  -6.544   7.647
  376   3HZ   LYS  48          3HZ       LYS  48  -1.095  -7.798   8.489
  377    H    THR  49           H        THR  49   1.312  -4.579   4.681
  378    HA   THR  49           HA       THR  49   3.675  -3.367   3.354
  379    HB   THR  49           HB       THR  49   4.269  -5.564   2.308
  380    HG1  THR  49           HG1      THR  49   2.019  -6.263   3.579
  381   1HG2  THR  49          1HG2      THR  49   5.435  -4.654   4.347
  382   2HG2  THR  49          2HG2      THR  49   4.368  -5.651   5.334
  383   3HG2  THR  49          3HG2      THR  49   5.492  -6.412   4.212
  384    H    VAL  50           H        VAL  50   3.514  -3.598   0.949
  385    HA   VAL  50           HA       VAL  50   0.942  -2.875  -0.018
  386    HB   VAL  50           HB       VAL  50   1.906  -3.201  -2.270
  387   1HG1  VAL  50          1HG1      VAL  50   2.485  -1.184  -0.973
  388   2HG1  VAL  50          2HG1      VAL  50   3.865  -2.028  -0.274
  389   3HG1  VAL  50          3HG1      VAL  50   3.826  -1.679  -2.005
  390   1HG2  VAL  50          1HG2      VAL  50   4.071  -4.612  -0.688
  391   2HG2  VAL  50          2HG2      VAL  50   3.121  -5.253  -2.030
  392   3HG2  VAL  50          3HG2      VAL  50   4.334  -4.010  -2.326
  393    H    GLU  51           H        GLU  51   2.515  -6.017   0.272
  394    HA   GLU  51           HA       GLU  51   0.758  -7.516  -1.391
  395   1HB   GLU  51          1HB       GLU  51   2.851  -8.439  -0.427
  396   2HB   GLU  51          2HB       GLU  51   2.117  -8.391   1.177
  397   1HG   GLU  51          1HG       GLU  51   0.362  -9.949   0.447
  398   2HG   GLU  51          2HG       GLU  51   1.042  -9.970  -1.181
  399    H    GLY  52           H        GLY  52   0.540  -6.611   2.032
  400   1HA   GLY  52          1HA       GLY  52  -1.265  -6.754   3.531
  401   2HA   GLY  52          2HA       GLY  52  -1.933  -8.021   2.500
  402    H    VAL  53           H        VAL  53  -1.117  -4.805   1.312
  403    HA   VAL  53           HA       VAL  53  -3.666  -3.576   1.631
  404    HB   VAL  53           HB       VAL  53  -1.522  -3.171  -0.474
  405   1HG1  VAL  53          1HG1      VAL  53  -4.154  -1.775  -0.014
  406   2HG1  VAL  53          2HG1      VAL  53  -2.777  -0.871  -0.650
  407   3HG1  VAL  53          3HG1      VAL  53  -3.406  -2.260  -1.535
  408   1HG2  VAL  53          1HG2      VAL  53  -0.940  -2.667   1.905
  409   2HG2  VAL  53          2HG2      VAL  53  -0.928  -1.232   0.880
  410   3HG2  VAL  53          3HG2      VAL  53  -2.289  -1.532   1.960
  411    H    LYS  54           H        LYS  54  -2.322  -5.356  -1.166
  412    HA   LYS  54           HA       LYS  54  -4.747  -5.212  -2.711
  413   1HB   LYS  54          1HB       LYS  54  -2.346  -7.051  -2.857
  414   2HB   LYS  54          2HB       LYS  54  -3.657  -7.073  -4.036
  415   1HG   LYS  54          1HG       LYS  54  -3.248  -4.691  -4.540
  416   2HG   LYS  54          2HG       LYS  54  -1.934  -4.668  -3.364
  417   1HD   LYS  54          1HD       LYS  54  -0.740  -6.399  -4.661
  418   2HD   LYS  54          2HD       LYS  54  -2.052  -6.415  -5.840
  419   1HE   LYS  54          1HE       LYS  54  -0.416  -3.959  -5.148
  420   2HE   LYS  54          2HE       LYS  54  -0.112  -4.992  -6.544
  421   1HZ   LYS  54          1HZ       LYS  54  -2.541  -4.570  -7.108
  422   2HZ   LYS  54          2HZ       LYS  54  -2.467  -3.296  -5.990
  423   3HZ   LYS  54          3HZ       LYS  54  -1.451  -3.289  -7.353
  424    H    ALA  55           H        ALA  55  -3.429  -7.685  -0.520
  425    HA   ALA  55           HA       ALA  55  -5.454  -9.650  -1.070
  426   1HB   ALA  55          1HB       ALA  55  -4.666 -10.707   1.030
  427   2HB   ALA  55          2HB       ALA  55  -3.724  -9.260   1.388
  428   3HB   ALA  55          3HB       ALA  55  -3.324 -10.247  -0.018
  429    H    LEU  56           H        LEU  56  -5.416  -6.842   1.016
  430    HA   LEU  56           HA       LEU  56  -7.551  -7.678   2.734
  431   1HB   LEU  56          1HB       LEU  56  -5.935  -5.809   3.235
  432   2HB   LEU  56          2HB       LEU  56  -6.736  -4.850   1.996
  433    HG   LEU  56           HG       LEU  56  -8.902  -5.187   3.247
  434   1HD1  LEU  56          1HD1      LEU  56  -7.008  -6.566   5.140
  435   2HD1  LEU  56          2HD1      LEU  56  -8.407  -5.714   5.788
  436   3HD1  LEU  56          3HD1      LEU  56  -8.636  -7.036   4.650
  437   1HD2  LEU  56          1HD2      LEU  56  -6.551  -3.622   4.261
  438   2HD2  LEU  56          2HD2      LEU  56  -8.100  -3.055   3.641
  439   3HD2  LEU  56          3HD2      LEU  56  -7.990  -3.679   5.280
  440    H    ILE  57           H        ILE  57  -7.460  -5.509  -0.117
  441    HA   ILE  57           HA       ILE  57 -10.164  -4.879  -0.343
  442    HB   ILE  57           HB       ILE  57  -8.499  -5.724  -2.722
  443   1HG1  ILE  57          1HG1      ILE  57  -7.071  -4.280  -1.426
  444   2HG1  ILE  57          2HG1      ILE  57  -7.742  -3.305  -2.727
  445   1HG2  ILE  57          1HG2      ILE  57 -10.723  -3.715  -2.289
  446   2HG2  ILE  57          2HG2      ILE  57  -9.762  -3.808  -3.765
  447   3HG2  ILE  57          3HG2      ILE  57 -10.769  -5.169  -3.282
  448   1HD1  ILE  57          1HD1      ILE  57  -9.590  -2.660  -1.042
  449   2HD1  ILE  57          2HD1      ILE  57  -8.515  -3.317   0.191
  450   3HD1  ILE  57          3HD1      ILE  57  -7.994  -1.955  -0.798
  451    H    ASP  58           H        ASP  58  -8.554  -7.925  -1.152
  452    HA   ASP  58           HA       ASP  58 -10.804  -9.128  -2.474
  453   1HB   ASP  58          1HB       ASP  58  -8.545 -10.351  -0.858
  454   2HB   ASP  58          2HB       ASP  58  -9.733 -11.305  -1.744
  455    H    GLU  59           H        GLU  59  -9.829  -8.893   0.917
  456    HA   GLU  59           HA       GLU  59 -11.999 -10.487   1.942
  457   1HB   GLU  59          1HB       GLU  59 -10.171  -8.455   3.237
  458   2HB   GLU  59          2HB       GLU  59 -11.381  -9.375   4.129
  459   1HG   GLU  59          1HG       GLU  59  -9.239 -10.669   2.425
  460   2HG   GLU  59          2HG       GLU  59  -9.059 -10.384   4.156
  461    H    ILE  60           H        ILE  60 -11.499  -7.012   1.432
  462    HA   ILE  60           HA       ILE  60 -13.964  -6.261   2.696
  463    HB   ILE  60           HB       ILE  60 -12.664  -4.639   0.507
  464   1HG1  ILE  60          1HG1      ILE  60 -10.771  -5.260   1.809
  465   2HG1  ILE  60          2HG1      ILE  60 -11.227  -3.673   2.394
  466   1HG2  ILE  60          1HG2      ILE  60 -14.787  -3.889   1.626
  467   2HG2  ILE  60          2HG2      ILE  60 -13.905  -3.835   3.152
  468   3HG2  ILE  60          3HG2      ILE  60 -13.442  -2.766   1.828
  469   1HD1  ILE  60          1HD1      ILE  60 -12.628  -5.048   4.142
  470   2HD1  ILE  60          2HD1      ILE  60 -11.516  -6.348   3.709
  471   3HD1  ILE  60          3HD1      ILE  60 -10.894  -4.843   4.372
  472    H    LEU  61           H        LEU  61 -13.073  -6.702  -0.737
  473    HA   LEU  61           HA       LEU  61 -15.657  -6.136  -1.789
  474   1HB   LEU  61          1HB       LEU  61 -13.425  -7.906  -2.824
  475   2HB   LEU  61          2HB       LEU  61 -14.889  -7.565  -3.747
  476    HG   LEU  61           HG       LEU  61 -12.987  -5.458  -2.679
  477   1HD1  LEU  61          1HD1      LEU  61 -13.335  -6.585  -5.476
  478   2HD1  LEU  61          2HD1      LEU  61 -12.300  -5.220  -5.054
  479   3HD1  LEU  61          3HD1      LEU  61 -11.936  -6.830  -4.431
  480   1HD2  LEU  61          1HD2      LEU  61 -15.582  -5.375  -4.196
  481   2HD2  LEU  61          2HD2      LEU  61 -14.969  -4.275  -2.962
  482   3HD2  LEU  61          3HD2      LEU  61 -14.348  -4.181  -4.605
  483    H    ALA  62           H        ALA  62 -14.232  -9.152  -0.584
  484    HA   ALA  62           HA       ALA  62 -16.588 -10.731  -1.253
  485   1HB   ALA  62          1HB       ALA  62 -14.286 -11.314   0.637
  486   2HB   ALA  62          2HB       ALA  62 -14.369 -11.784  -1.061
  487   3HB   ALA  62          3HB       ALA  62 -15.490 -12.488   0.106
  488    H    ALA  63           H        ALA  63 -15.892  -8.468   1.169
  489    HA   ALA  63           HA       ALA  63 -17.281  -9.652   3.395
  490   1HB   ALA  63          1HB       ALA  63 -15.712  -7.648   3.469
  491   2HB   ALA  63          2HB       ALA  63 -17.037  -6.692   2.804
  492   3HB   ALA  63          3HB       ALA  63 -17.211  -7.463   4.380
  493    H    LEU  64           H        LEU  64 -18.332  -7.132   1.075
  494    HA   LEU  64           HA       LEU  64 -21.072  -7.242   1.940
  495   1HB   LEU  64          1HB       LEU  64 -21.510  -5.873  -0.087
  496   2HB   LEU  64          2HB       LEU  64 -20.160  -5.256   0.852
  497    HG   LEU  64           HG       LEU  64 -19.207  -7.207  -1.121
  498   1HD1  LEU  64          1HD1      LEU  64 -20.740  -4.826  -2.204
  499   2HD1  LEU  64          2HD1      LEU  64 -19.673  -5.863  -3.149
  500   3HD1  LEU  64          3HD1      LEU  64 -21.149  -6.524  -2.447
  501   1HD2  LEU  64          1HD2      LEU  64 -18.717  -4.245  -0.679
  502   2HD2  LEU  64          2HD2      LEU  64 -17.726  -5.582  -0.095
  503   3HD2  LEU  64          3HD2      LEU  64 -17.814  -5.236  -1.822
  504    HA   PRO  65           HA       PRO  65 -22.370 -10.900  -0.259
  505   1HB   PRO  65          1HB       PRO  65 -24.929 -10.006  -1.102
  506   2HB   PRO  65          2HB       PRO  65 -24.550 -10.829   0.415
  507   1HG   PRO  65          1HG       PRO  65 -25.134  -7.971  -0.061
  508   2HG   PRO  65          2HG       PRO  65 -25.247  -8.903   1.437
  509   1HD   PRO  65          1HD       PRO  65 -23.244  -7.026   0.852
  510   2HD   PRO  65          2HD       PRO  65 -23.131  -8.282   2.107

  No H/Q in entry =         510