*HEADER    DNA BINDING PROTEIN                     23-DEC-99   1DP3              
*TITLE     SOLUTION STRUCTURE OF THE DNA BINDING DOMAIN OF THE TRAM              
*TITLE    2 PROTEIN                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRAM PROTEIN;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: TRAMM26;                                                   
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PET28A(+)                                 
*KEYWDS    HELIX-LOOP-HELIX                                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    T.STOCKNER, C.PLUGARIU, G.KORAIMANN, G.HOEGENAUER, W.BERMEL,          
*AUTHOR   2 S.PRYTULLA, H.STERK                                                  
*REVDAT   1   04-APR-01 1DP3    0                                                
! ANSIG v3.3 XPLOR distance restraints file
! Distance corrections applied.
! Trivial distances not output.
! 2D NOESY

! residue 2    Ala , intraresidue NOEs

! residue 2    Ala , NOEs forward in sequence

! residue 3    Lys , intraresidue NOEs

! residue 3    Lys , NOEs forward in sequence

! residue 4    Val , intraresidue NOEs

! residue 4    Val , NOEs forward in sequence

! residue 5    Gln , intraresidue NOEs

! residue 5    Gln , NOEs forward in sequence

! residue 6    Ala , intraresidue NOEs

! residue 6    Ala , NOEs forward in sequence

! residue 7    Tyr , intraresidue NOEs
assi (resi 7    and name HN  ) (resi 7    and name HD# )  3.00  1.20  3.00
assi (resi 7    and name HB1 ) (resi 7    and name HD# )  3.00  1.20  3.00
assi (resi 7    and name HB2 ) (resi 7    and name HD# )  3.00  1.20  3.00

! residue 7    Tyr , NOEs forward in sequence

! residue 8    Val , intraresidue NOEs

! residue 8    Val , NOEs forward in sequence

! residue 9    Ser , intraresidue NOEs

! residue 9    Ser , NOEs forward in sequence

! residue 10    Asp , intraresidue NOEs

! residue 10   Asp , NOEs forward in sequence

! residue 11   Glu , intraresidue NOEs

! residue 11   Glu , NOEs forward in sequence

! residue 12   Ile , intraresidue NOEs

! residue 12   Ile , NOEs forward in sequence
assi (resi 12   and name HG2#) (resi 35   and name HZ  )  4.00  2.20  2.30
assi (resi 12   and name HG2#) (resi 35   and name HE# )  4.00  2.20  4.30
assi (resi 12   and name HD1#) (resi 42   and name HD# )  3.00  1.20  3.70
assi (resi 12   and name HG2#) (resi 42   and name HD# )  3.00  1.20  3.70

! residue 13   Val , intraresidue NOEs

! residue 13   Val , NOEs forward in sequence
assi (resi 13   and name HA  ) (resi 16   and name HG2#)  4.00  2.20  2.30
assi (resi 13   and name HA  ) (resi 16   and name HG1#)  4.00  2.20  3.00
assi (resi 13   and name HG# ) (resi 17   and name HD2#)  3.00  1.20  4.40
assi (resi 13   and name HA  ) (resi 35   and name HZ  )  3.00  1.20  1.00
assi (resi 13   and name HA  ) (resi 35   and name HE# )  3.00  1.20  3.00
assi (resi 13   and name HG# ) (resi 35   and name HZ  )  3.00  1.20  3.40
assi (resi 13   and name HG# ) (resi 35   and name HD# )  3.00  1.20  5.40
assi (resi 13   and name HG# ) (resi 35   and name HE# )  3.00  1.20  5.40

! residue 14   Tyr , intraresidue NOEs
assi (resi 14   and name HN  ) (resi 14   and name HD# )  3.00  1.20  3.00
assi (resi 14   and name HA  ) (resi 14   and name HD# )  2.50  0.70  2.30
assi (resi 14   and name HA  ) (resi 14   and name HE# )  3.00  1.20  3.00
assi (resi 14   and name HB1 ) (resi 14   and name HD# )  2.50  0.70  2.30
assi (resi 14   and name HB1 ) (resi 14   and name HE# )  3.00  1.20  3.00
assi (resi 14   and name HB2 ) (resi 14   and name HD# )  2.50  0.70  2.30
assi (resi 14   and name HB2 ) (resi 14   and name HE# )  3.00  1.20  3.00

! residue 14   Tyr , NOEs forward in sequence
assi (resi 14   and name HD# ) (resi 15   and name HN  )  3.00  1.20  3.00
assi (resi 14   and name HD# ) (resi 15   and name HA  )  3.00  1.20  3.00
assi (resi 14   and name HD# ) (resi 15   and name HB# )  3.00  1.20  4.00
assi (resi 14   and name HE# ) (resi 15   and name HB# )  4.00  2.20  5.00

! residue 15   Lys , intraresidue NOEs

! residue 15   Lys , NOEs forward in sequence

! residue 16   Ile , intraresidue NOEs
assi (resi 16   and name HA  ) (resi 16   and name HG2#)  3.00  1.20  1.30

! residue 16   Ile , NOEs forward in sequence
assi (resi 16   and name HG2#) (resi 17   and name HA  )  4.00  2.20  2.30
assi (resi 16   and name HG2#) (resi 20   and name HG# )  4.00  2.20  4.70
assi (resi 16   and name HB  ) (resi 35   and name HD# )  4.00  2.20  3.00
assi (resi 16   and name HB  ) (resi 35   and name HE# )  3.00  1.20  3.00
assi (resi 16   and name HG2#) (resi 35   and name HZ  )  4.00  2.20  2.30
assi (resi 16   and name HG2#) (resi 35   and name HB# )  4.00  2.20  3.30
assi (resi 16   and name HG2#) (resi 35   and name HD# )  3.00  1.20  3.30
assi (resi 16   and name HG2#) (resi 35   and name HE# )  4.00  2.20  4.30
assi (resi 16   and name HD1#) (resi 35   and name HD# )  4.00  2.20  4.30
assi (resi 16   and name HG1#) (resi 35   and name HZ  )  3.00  1.20  2.00
assi (resi 16   and name HG1#) (resi 35   and name HD# )  4.00  2.20  5.00
assi (resi 16   and name HG1#) (resi 35   and name HE# )  4.00  2.20  5.00
assi (resi 16   and name HA  ) (resi 38   and name HG2#)  4.00  2.20  2.30
assi (resi 16   and name HG2#) (resi 38   and name HG2#)  2.50  0.70  0.90
assi (resi 16   and name HD1#) (resi 42   and name HD# )  2.50  0.70  3.00
assi (resi 16   and name HD1#) (resi 43   and name HD# )  4.00  2.20  4.70

! residue 17   Asn , intraresidue NOEs
assi (resi 17   and name HN  ) (resi 17   and name HD2#)  3.00  1.20  2.00
assi (resi 17   and name HB1 ) (resi 17   and name HD2#)  3.00  1.20  2.00
assi (resi 17   and name HB2 ) (resi 17   and name HD2#)  3.00  1.20  2.00
assi (resi 17   and name HB# ) (resi 17   and name HD2#)  4.00  2.20  4.00

! residue 17   Asn , NOEs forward in sequence
assi (resi 17   and name HA  ) (resi 20   and name HB  )  3.00  1.20  1.00
assi (resi 17   and name HA  ) (resi 20   and name HG# )  3.00  1.20  3.40

! residue 18   Lys , intraresidue NOEs

! residue 18   Lys , NOEs forward in sequence
assi (resi 18   and name HA  ) (resi 21   and name HB# )  3.00  1.20  2.00

! residue 19   Ile , intraresidue NOEs

! residue 19   Ile , NOEs forward in sequence
assi (resi 19   and name HG2#) (resi 50   and name HE# )  3.00  1.20  3.30
assi (resi 19   and name HD1#) (resi 50   and name HD# )  3.00  1.20  3.30
assi (resi 19   and name HD1#) (resi 50   and name HE# )  3.00  1.20  3.30
assi (resi 19   and name HG1#) (resi 50   and name HD# )  4.00  2.20  4.30
assi (resi 19   and name HG1#) (resi 50   and name HE# )  4.00  2.20  4.30


! residue 20   Val , intraresidue NOEs
assi (resi 20   and name HA  ) (resi 20   and name HG# )  2.50  0.70  2.80

! residue 20   Val , NOEs forward in sequence
assi (resi 20   and name HA  ) (resi 23   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HG# ) (resi 24   and name HE  )  4.00  2.20  4.40
assi (resi 20   and name HA  ) (resi 38   and name HD1#)  4.00  2.20  2.30
assi (resi 20   and name HB  ) (resi 38   and name HD1#)  4.00  2.20  2.30
assi (resi 20   and name HG# ) (resi 38   and name HD1#)  2.50  0.70  3.00

! residue 21   Glu , intraresidue NOEs

! residue 21   Glu , NOEs forward in sequence

! residue 22   Arg , intraresidue NOEs

! residue 22   Arg , NOEs forward in sequence
assi (resi 22   and name HA  ) (resi 25   and name HB# )  3.00  1.20  1.30

! residue 23   Arg , intraresidue NOEs

! residue 23   Arg , NOEs forward in sequence

! residue 24   Arg , intraresidue NOEs

! residue 24   Arg , NOEs forward in sequence

! residue 25   Ala , intraresidue NOEs

! residue 25   Ala , NOEs forward in sequence

! residue 26   Glu , intraresidue NOEs

! residue 26   Glu , NOEs forward in sequence

! residue 27   Gly , intraresidue NOEs

! residue 27   Gly , NOEs forward in sequence

! residue 28   Ala , intraresidue NOEs

! residue 28   Ala , NOEs forward in sequence

! residue 29   Lys , intraresidue NOEs

! residue 29   Lys , NOEs forward in sequence

! residue 30   Ser , intraresidue NOEs

! residue 30   Ser , NOEs forward in sequence

! residue 31   Thr , intraresidue NOEs

! residue 31   Thr , NOEs forward in sequence

! residue 32   Asp , intraresidue NOEs

! residue 32   Asp , NOEs forward in sequence

! residue 33   Val , intraresidue NOEs

! residue 33   Val , NOEs forward in sequence
assi (resi 33   and name HG# ) (resi 35   and name HD# )  4.00  2.20  6.40
assi (resi 33   and name HN  ) (resi 34   and name HN  )  4.00  2.20  2.00
assi (resi 33   and name HG# ) (resi 38   and name HD1#)  2.50  0.70  3.00

! 2 neue restraints nach Blatt 9
assi (resi 33   and name HG# ) (resi 38   and name HA  )  4.00  2.20  4.40
assi (resi 33   and name HG# ) (resi 38   and name HN  )  3.00  1.20  3.40



! residue 34   Ser , intraresidue NOEs

! residue 34   Ser , NOEs forward in sequence

! residue 35   Phe , intraresidue NOEs
assi (resi 35   and name HB# ) (resi 35   and name HD# )  2.50  0.70  1.80
assi (resi 35   and name HB# ) (resi 35   and name HE# )  3.00  1.20  4.00
assi (resi 35   and name HN  ) (resi 35   and name HD# )  4.00  2.20  4.00


! residue 35   Phe , NOEs forward in sequence
assi (resi 35   and name HD# ) (resi 36   and name HN  )  3.00  1.20  3.00
assi (resi 35   and name HD# ) (resi 36   and name HA  )  3.00  1.20  3.00
assi (resi 35   and name HE# ) (resi 36   and name HA  )  3.00  1.20  3.00
assi (resi 35   and name HN  ) (resi 36   and name HN  )  4.00  2.20  2.00
 

! residue 36   Ser , intraresidue NOEs

! residue 36   Ser , NOEs forward in sequence

! residue 37   Ser , intraresidue NOEs

! residue 37   Ser , NOEs forward in sequence

! residue 38   Ile , intraresidue NOEs
assi (resi 38   and name HA  ) (resi 38   and name HD1#)  2.50  0.70  1.00
assi (resi 38   and name HD1#) (resi 41   and name HE# )  3.00  1.20  1.60

! residue 39   Ser , intraresidue NOEs

! residue 39   Ser , NOEs forward in sequence
assi (resi 39   and name HB# ) (resi 43   and name HD# )  4.00  2.20  5.40

! residue 40   Thr , intraresidue NOEs

! residue 40   Thr , NOEs forward in sequence

! residue 41   Met , intraresidue NOEs
assi (resi 41   and name HA  ) (resi 41   and name HG# )  3.00  1.20  2.00
assi (resi 41   and name HB1 ) (resi 41   and name HE# )  4.00  2.20  2.30
assi (resi 41   and name HB2 ) (resi 41   and name HE# )  4.00  2.20  2.30
assi (resi 41   and name HG1 ) (resi 41   and name HE# )  4.00  2.20  2.30
assi (resi 41   and name HG2 ) (resi 41   and name HE# )  4.00  2.20  2.30

! residue 41   Met , NOEs forward in sequence
assi (resi 41   and name HE# ) (resi 42   and name HD1#)  4.00  2.20  2.60
assi (resi 41   and name HE# ) (resi 42   and name HD2#)  4.00  2.20  2.60
assi (resi 41   and name HE# ) (resi 50   and name HD# )  3.00  1.20  3.30
assi (resi 41   and name HE# ) (resi 50   and name HE# )  3.00  1.20  3.30

! residue 42   Leu , intraresidue NOEs
assi (resi 42   and name HA  ) (resi 42   and name HD# )  3.00  1.20  3.40
assi (resi 42   and name HB# ) (resi 42   and name HD# )  2.50  0.70  1.20

! residue 42   Leu , NOEs forward in sequence
assi (resi 42   and name HA  ) (resi 45   and name HD1#)  4.00  2.20  2.30
assi (resi 42   and name HA  ) (resi 45   and name HD2#)  4.00  2.20  2.30
assi (resi 42   and name HD# ) (resi 45   and name HD1#)  4.00  2.20  4.70
assi (resi 42   and name HD# ) (resi 45   and name HD2#)  4.00  2.20  4.70
assi (resi 42   and name HD# ) (resi 47   and name HD2#)  4.00  2.20  4.70
assi (resi 42   and name HD# ) (resi 49   and name HG# )  4.00  2.20  6.80
assi (resi 42   and name HD# ) (resi 50   and name HD# )  4.00  2.20  6.40
assi (resi 42   and name HD# ) (resi 50   and name HE# )  4.00  2.20  6.40

! residue 43   Leu , intraresidue NOEs

! residue 43   Leu , NOEs forward in sequence

! residue 44   Glu , intraresidue NOEs

! residue 44   Glu , NOEs forward in sequence

! residue 45   Leu , intraresidue NOEs
assi (resi 45   and name HA  ) (resi 45   and name HD# )  3.00  1.20  3.40

! residue 45   Leu , NOEs forward in sequence
assi (resi 45   and name HB# ) (resi 49   and name HG# )  4.00  2.20  5.40
assi (resi 45   and name HG  ) (resi 49   and name HG# )  4.00  2.20  4.40
assi (resi 45   and name HD# ) (resi 49   and name HB  )  3.00  1.20  3.40

! residue 46   Gly , intraresidue NOEs

! residue 46   Gly , NOEs forward in sequence

! residue 47   Leu , intraresidue NOEs

! residue 47   Leu , NOEs forward in sequence
assi (resi 47   and name HD# ) (resi 50   and name HD# )  4.00  2.20  6.40

! residue 48   Arg , intraresidue NOEs

! residue 48   Arg , NOEs forward in sequence

! residue 49   Val , intraresidue NOEs

! residue 49   Val , NOEs forward in sequence
assi (resi 49   and name HA  ) (resi 52   and name HB# )  3.00  1.20  1.30

! residue 50   Tyr , intraresidue NOEs
assi (resi 50   and name HN  ) (resi 50   and name HD# )  3.00  1.20  3.00
assi (resi 50   and name HA  ) (resi 50   and name HD# )  2.50  0.70  1.80
assi (resi 50   and name HA  ) (resi 50   and name HE# )  3.00  1.20  3.00
assi (resi 50   and name HB1 ) (resi 50   and name HD# )  2.50  0.70  1.80
assi (resi 50   and name HB1 ) (resi 50   and name HE# )  3.00  1.20  3.00
assi (resi 50   and name HB2 ) (resi 50   and name HD# )  2.50  0.70  1.80
assi (resi 50   and name HB2 ) (resi 50   and name HE# )  4.00  2.20  4.00

! residue 50   Tyr , NOEs forward in sequence
assi (resi 50   and name HD# ) (resi 51   and name HN  )  3.00  1.20  3.00
assi (resi 50   and name HD# ) (resi 51   and name HG1 )  3.00  1.20  3.00
assi (resi 50   and name HD# ) (resi 51   and name HG2 )  3.00  1.20  3.00
assi (resi 50   and name HD# ) (resi 51   and name HB# )  3.00  1.20  4.00
assi (resi 50   and name HE# ) (resi 51   and name HB# )  3.00  1.20  4.00

! residue 51   Glu , intraresidue NOEs

! residue 51   Glu , NOEs forward in sequence

! residue 52   Ala , intraresidue NOEs

! residue 52   Ala , NOEs forward in sequence

! residue 53   Gln , intraresidue NOEs
assi (resi 53   and name HG# ) (resi 53   and name HE2#)  3.00  1.20  3.00

! residue 53   Gln , NOEs forward in sequence

! residue 54   Met , intraresidue NOEs

! residue 54   Met , NOEs forward in sequence

! residue 55   Glu , intraresidue NOEs

! residue 55   Glu , NOEs forward in sequence

! residue 56   Arg , intraresidue NOEs



! ANSIG v3.3 XPLOR distance restraints file.
! Distance corrections applied.
! Trivial distances not output.
! 15N 3D NOESY-HSQC






! residue 2    Ala , intraresidue NOEs
assi (resi 2    and name HN  ) (resi 2    and name HA  )  3.00  1.20  1.00
assi (resi 2    and name HN  ) (resi 2    and name HB# )  3.00  1.20  1.30

! residue 2    Ala , NOEs forward in sequence
assi (resi 2    and name HB# ) (resi 3    and name HN  )  3.00  1.20  1.30

! residue 3    Lys , intraresidue NOEs
assi (resi 3    and name HN  ) (resi 3    and name HA  )  3.00  1.20  1.00
assi (resi 3    and name HN  ) (resi 3    and name HB1 )  3.00  1.20  1.00
assi (resi 3    and name HN  ) (resi 3    and name HB2 )  3.00  1.20  1.00
assi (resi 3    and name HN  ) (resi 3    and name HG# )  3.00  1.20  2.00

! residue 3    Lys , NOEs forward in sequence
assi (resi 3    and name HA  ) (resi 4    and name HN  )  2.50  0.70  0.30

! residue 4    Val , intraresidue NOEs
assi (resi 4    and name HN  ) (resi 4    and name HA  )  3.00  1.20  1.00
assi (resi 4    and name HN  ) (resi 4    and name HB  )  3.00  1.20  1.00
assi (resi 4    and name HN  ) (resi 4    and name HG# )  3.00  1.20  3.40

! residue 4    Val , NOEs forward in sequence

! residue 5    Gln , intraresidue NOEs
assi (resi 5    and name HN  ) (resi 5    and name HA  )  3.00  1.20  1.00
assi (resi 5    and name HN  ) (resi 5    and name HB1 )  3.00  1.20  1.00
assi (resi 5    and name HN  ) (resi 5    and name HB2 )  3.00  1.20  1.00
assi (resi 5    and name HN  ) (resi 5    and name HG1 )  3.00  1.20  1.00
assi (resi 5    and name HN  ) (resi 5    and name HG2 )  3.00  1.20  1.00
assi (resi 5    and name HG# ) (resi 5    and name HE2#)  3.00  1.20  3.00

! residue 5    Gln , NOEs forward in sequence
assi (resi 5    and name HN  ) (resi 6    and name HN  )  4.00  2.20  2.00
assi (resi 5    and name HA  ) (resi 6    and name HN  )  2.50  0.70  0.30
assi (resi 5    and name HB1 ) (resi 6    and name HN  )  3.00  1.20  1.00
assi (resi 5    and name HB2 ) (resi 6    and name HN  )  3.00  1.20  1.00
assi (resi 5    and name HG# ) (resi 6    and name HN  )  4.00  2.20  3.00

! residue 6    Ala , intraresidue NOEs
assi (resi 6    and name HN  ) (resi 6    and name HA  )  3.00  1.20  1.00
assi (resi 6    and name HN  ) (resi 6    and name HB# )  3.00  1.20  1.30

! residue 6    Ala , NOEs forward in sequence
assi (resi 6    and name HN  ) (resi 7    and name HN  )  3.00  1.20  1.00
assi (resi 6    and name HA  ) (resi 7    and name HN  )  2.50  0.70  0.30
assi (resi 6    and name HB# ) (resi 7    and name HN  )  3.00  1.20  1.30

! residue 7    Tyr , intraresidue NOEs
assi (resi 7    and name HN  ) (resi 7    and name HA  )  3.00  1.20  1.00
assi (resi 7    and name HN  ) (resi 7    and name HB1 )  3.00  1.20  1.00
assi (resi 7    and name HN  ) (resi 7    and name HB2 )  3.00  1.20  1.00
assi (resi 7    and name HN  ) (resi 7    and name HD# )  3.00  1.20  3.00

! residue 7    Tyr , NOEs forward in sequence
assi (resi 7    and name HN  ) (resi 8    and name HG# )  4.00  2.20  4.40
assi (resi 7    and name HA  ) (resi 8    and name HN  )  2.50  0.70  0.30
assi (resi 7    and name HB# ) (resi 8    and name HN  )  4.00  2.20  2.00

! residue 8    Val , intraresidue NOEs
assi (resi 8    and name HN  ) (resi 8    and name HA  )  3.00  1.20  1.00
assi (resi 8    and name HN  ) (resi 8    and name HG# )  3.00  1.20  3.40

! residue 8    Val , NOEs forward in sequence
assi (resi 8    and name HA  ) (resi 9    and name HN  )  3.00  1.20  1.00

! residue 9    Ser , intraresidue NOEs
assi (resi 9    and name HN  ) (resi 9    and name HB# )  3.00  1.20  2.00

! residue 9    Ser , NOEs forward in sequence
assi (resi 9    and name HA  ) (resi 10   and name HN  )  2.50  0.70  0.30
assi (resi 9    and name HB# ) (resi 10   and name HN  )  3.00  1.20  2.00

! residue 10   Asp , intraresidue NOEs
assi (resi 10   and name HN  ) (resi 10   and name HA  )  2.50  0.70  0.30
assi (resi 10   and name HN  ) (resi 10   and name HB1 )  3.00  1.20  1.00
assi (resi 10   and name HN  ) (resi 10   and name HB2 )  3.00  1.20  1.00

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

! residue 11   Glu , intraresidue NOEs
assi (resi 11   and name HN  ) (resi 11   and name HA  )  3.00  1.20  1.00
assi (resi 11   and name HN  ) (resi 11   and name HB1 )  4.00  2.20  2.00
assi (resi 11   and name HN  ) (resi 11   and name HB2 )  4.00  2.20  2.00

! residue 11   Glu , NOEs forward in sequence
assi (resi 11   and name HN  ) (resi 12   and name HN  )  3.00  1.20  1.00
assi (resi 11   and name HA  ) (resi 12   and name HN  )  4.00  2.20  2.00
assi (resi 11   and name HB# ) (resi 12   and name HN  )  3.00  1.20  2.00
assi (resi 11   and name HA  ) (resi 14   and name HN  )  3.00  1.20  1.00
assi (resi 11   and name HA  ) (resi 15   and name HN  )  4.00  2.20  2.00

! residue 12   Ile , intraresidue NOEs
assi (resi 12   and name HN  ) (resi 12   and name HA  )  3.00  1.20  1.00
assi (resi 12   and name HN  ) (resi 12   and name HB  )  3.00  1.20  1.00
assi (resi 12   and name HN  ) (resi 12   and name HG11)  3.00  1.20  1.00
assi (resi 12   and name HN  ) (resi 12   and name HG12)  3.00  1.20  1.00
assi (resi 12   and name HN  ) (resi 12   and name HG2#)  4.00  2.20  2.30
assi (resi 12   and name HN  ) (resi 12   and name HD1#)  4.00  2.20  2.30

! residue 12   Ile , NOEs forward in sequence
assi (resi 12   and name HG2#) (resi 13   and name HN  )  4.00  2.20  2.30
assi (resi 12   and name HD1#) (resi 13   and name HN  )  4.00  2.20  2.30
assi (resi 12   and name HA  ) (resi 15   and name HN  )  3.00  1.20  1.00
assi (resi 12   and name HA  ) (resi 16   and name HN  )  4.00  2.20  2.00


! residue 13   Val , intraresidue NOEs
assi (resi 13   and name HN  ) (resi 13   and name HA  )  3.00  1.20  1.00
assi (resi 13   and name HN  ) (resi 13   and name HB  )  3.00  1.20  1.00
assi (resi 13   and name HN  ) (resi 13   and name HG# )  3.00  1.20  3.40

! residue 13   Val , NOEs forward in sequence
assi (resi 13   and name HN  ) (resi 14   and name HN  )  3.00  1.20  1.00
assi (resi 13   and name HA  ) (resi 14   and name HN  )  3.00  1.20  1.00
assi (resi 13   and name HB  ) (resi 14   and name HN  )  3.00  1.20  1.00
assi (resi 13   and name HG# ) (resi 14   and name HN  )  4.00  2.20  4.40
assi (resi 13   and name HA  ) (resi 16   and name HN  )  3.00  1.20  1.00
assi (resi 13   and name HA  ) (resi 17   and name HN  )  4.00  2.20  2.00
assi (resi 13   and name HG# ) (resi 17   and name HN  )  4.00  2.20  4.40
assi (resi 13   and name HG# ) (resi 17   and name HD21)  4.00  2.20  5.40
assi (resi 13   and name HG# ) (resi 17   and name HD22)  4.00  2.20  5.40

! residue 14   Tyr , intraresidue NOEs
assi (resi 14   and name HN  ) (resi 14   and name HA  )  3.00  1.20  1.00
assi (resi 14   and name HN  ) (resi 14   and name HB1 )  3.00  1.20  1.00
assi (resi 14   and name HN  ) (resi 14   and name HB2 )  3.00  1.20  1.00
assi (resi 14   and name HN  ) (resi 14   and name HD# )  3.00  1.20  3.00

! residue 14   Tyr , NOEs forward in sequence
assi (resi 14   and name HA  ) (resi 15   and name HN  )  4.00  2.20  2.00
assi (resi 14   and name HB# ) (resi 15   and name HN  )  3.00  1.20  2.00
assi (resi 14   and name HN  ) (resi 16   and name HN  )  4.00  2.20  2.00
assi (resi 14   and name HA  ) (resi 17   and name HN  )  3.00  1.20  1.00


! residue 15   Lys , intraresidue NOEs
assi (resi 15   and name HN  ) (resi 15   and name HA  )  3.00  1.20  1.00
assi (resi 15   and name HN  ) (resi 15   and name HB1 )  3.00  1.20  1.00
assi (resi 15   and name HN  ) (resi 15   and name HB2 )  3.00  1.20  1.00
assi (resi 15   and name HN  ) (resi 15   and name HG# )  3.00  1.20  2.00

! residue 15   Lys , NOEs forward in sequence
assi (resi 15   and name HN  ) (resi 16   and name HN  )  3.00  1.20  1.00
assi (resi 15   and name HB# ) (resi 16   and name HN  )  4.00  2.20  3.00
assi (resi 15   and name HN  ) (resi 17   and name HN  )  4.00  2.20  2.00
assi (resi 15   and name HN  ) (resi 18   and name HD# )  3.00  1.20  2.00
assi (resi 15   and name HA  ) (resi 18   and name HN  )  3.00  1.20  1.00

! residue 16   Ile , intraresidue NOEs
assi (resi 16   and name HN  ) (resi 16   and name HA  )  3.00  1.20  1.00
assi (resi 16   and name HN  ) (resi 16   and name HB  )  3.00  1.20  1.00
assi (resi 16   and name HN  ) (resi 16   and name HG11)  3.00  1.20  1.00
assi (resi 16   and name HN  ) (resi 16   and name HG12)  3.00  1.20  1.00
assi (resi 16   and name HN  ) (resi 16   and name HG2#)  4.00  2.20  2.30

! residue 16   Ile , NOEs forward in sequence
assi (resi 16   and name HN  ) (resi 17   and name HN  )  4.00  2.20  2.00
assi (resi 16   and name HA  ) (resi 17   and name HN  )  3.00  1.20  1.00
assi (resi 16   and name HB  ) (resi 17   and name HN  )  3.00  1.20  1.00
assi (resi 16   and name HG2#) (resi 17   and name HN  )  4.00  2.20  2.30
assi (resi 16   and name HG1#) (resi 17   and name HN  )  4.00  2.20  3.00
assi (resi 16   and name HN  ) (resi 18   and name HN  )  4.00  2.20  2.00
assi (resi 16   and name HA  ) (resi 19   and name HN  )  3.00  1.20  1.00

! residue 17   Asn , intraresidue NOEs
assi (resi 17   and name HN  ) (resi 17   and name HA  )  3.00  1.20  1.00
assi (resi 17   and name HN  ) (resi 17   and name HB1 )  3.00  1.20  1.00
assi (resi 17   and name HN  ) (resi 17   and name HB2 )  3.00  1.20  1.00
assi (resi 17   and name HN  ) (resi 17   and name HD2#)  3.00  1.20  2.00
assi (resi 17   and name HB1 ) (resi 17   and name HD2#)  3.00  1.20  2.00
assi (resi 17   and name HB2 ) (resi 17   and name HD2#)  3.00  1.20  2.00
assi (resi 17   and name HB# ) (resi 17   and name HD2#)  4.00  2.20  4.00

! residue 17   Asn , NOEs forward in sequence
assi (resi 17   and name HN  ) (resi 18   and name HN  )  3.00  1.20  1.00
assi (resi 17   and name HA  ) (resi 18   and name HN  )  3.00  1.20  1.00
assi (resi 17   and name HB1 ) (resi 18   and name HN  )  3.00  1.20  1.00
assi (resi 17   and name HB2 ) (resi 18   and name HN  )  3.00  1.20  1.00
assi (resi 17   and name HA  ) (resi 20   and name HN  )  3.00  1.20  1.00

! residue 18   Lys , intraresidue NOEs
assi (resi 18   and name HN  ) (resi 18   and name HA  )  3.00  1.20  1.00
assi (resi 18   and name HN  ) (resi 18   and name HB1 )  3.00  1.20  1.00
assi (resi 18   and name HN  ) (resi 18   and name HB2 )  3.00  1.20  1.00
assi (resi 18   and name HN  ) (resi 18   and name HG# )  3.00  1.20  2.00
assi (resi 18   and name HN  ) (resi 18   and name HD# )  3.00  1.20  2.00

! residue 18   Lys , NOEs forward in sequence
assi (resi 18   and name HN  ) (resi 19   and name HN  )  3.00  1.20  1.00
assi (resi 18   and name HA  ) (resi 19   and name HN  )  3.00  1.20  1.00
assi (resi 18   and name HB1 ) (resi 19   and name HN  )  3.00  1.20  1.00
assi (resi 18   and name HB2 ) (resi 19   and name HN  )  3.00  1.20  1.00
assi (resi 18   and name HN  ) (resi 20   and name HN  )  4.00  2.20  2.00
assi (resi 18   and name HA  ) (resi 21   and name HN  )  3.00  1.20  1.00
assi (resi 18   and name HA  ) (resi 22   and name HN  )  4.00  2.20  2.00

! residue 19   Ile , intraresidue NOEs
assi (resi 19   and name HN  ) (resi 19   and name HA  )  3.00  1.20  1.00
assi (resi 19   and name HN  ) (resi 19   and name HB  )  2.50  0.70  0.30
assi (resi 19   and name HN  ) (resi 19   and name HG2#)  4.00  2.20  2.30
assi (resi 19   and name HN  ) (resi 19   and name HD1#)  3.00  1.20  1.30
assi (resi 19   and name HN  ) (resi 19   and name HG1#)  3.00  1.20  2.00

! residue 19   Ile , NOEs forward in sequence
assi (resi 19   and name HN  ) (resi 20   and name HN  ) 3.00  1.20  1.00 
assi (resi 19   and name HB  ) (resi 20   and name HN  )  3.00  1.20  1.00
assi (resi 19   and name HG2#) (resi 20   and name HN  )  4.00  2.20  2.30
assi (resi 19   and name HA  ) (resi 22   and name HN  )  3.00  1.20  1.00
assi (resi 19   and name HA  ) (resi 23   and name HN  )  4.00  2.20  2.00


! residue 20   Val , intraresidue NOEs
assi (resi 20   and name HN  ) (resi 20   and name HA  )  3.00  1.20  1.00
assi (resi 20   and name HN  ) (resi 20   and name HB  )  3.00  1.20  1.00
assi (resi 20   and name HN  ) (resi 20   and name HG1#)  4.00  2.20  2.30
assi (resi 20   and name HN  ) (resi 20   and name HG2#)  4.00  2.20  2.30

! residue 20   Val , NOEs forward in sequence
assi (resi 20   and name HA  ) (resi 21   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HB  ) (resi 21   and name HN  )  2.50  0.70  0.30
assi (resi 20   and name HG1#) (resi 21   and name HN  )  3.00  1.20  1.30
assi (resi 20   and name HG2#) (resi 21   and name HN  )  3.00  1.20  1.30
assi (resi 20   and name HG# ) (resi 22   and name HN  )  4.00  2.20  4.40
assi (resi 20   and name HA  ) (resi 23   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HA  ) (resi 24   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HG# ) (resi 24   and name HE  )  4.00  2.20  4.40
assi (resi 20   and name HN  ) (resi 38   and name HD1#)  4.00  2.20  2.30
assi (resi 20   and name HA  ) (resi 38   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HB  ) (resi 38   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HG# ) (resi 38   and name HN  )  4.00  2.20  4.40
assi (resi 20   and name HG# ) (resi 39   and name HN  )  4.00  2.20  4.40

! residue 21   Glu , intraresidue NOEs
assi (resi 21   and name HN  ) (resi 21   and name HA  )  2.50  0.70  0.30
assi (resi 21   and name HN  ) (resi 21   and name HB# )  2.50  0.70  1.30

! residue 21   Glu , NOEs forward in sequence
assi (resi 21   and name HA  ) (resi 22   and name HN  )  3.00  1.20  1.00
assi (resi 21   and name HB# ) (resi 22   and name HN  )  3.00  1.20  2.00
assi (resi 21   and name HA  ) (resi 24   and name HN  )  3.00  1.20  1.00
assi (resi 21   and name HA  ) (resi 25   and name HN  )  4.00  1.20  2.00

! residue 22   Arg , intraresidue NOEs
assi (resi 22   and name HN  ) (resi 22   and name HA  )  3.00  1.20  1.00
assi (resi 22   and name HN  ) (resi 22   and name HB# )  2.50  0.70  1.30

! residue 22   Arg , NOEs forward in sequence
assi (resi 22   and name HN  ) (resi 23   and name HN  )  3.00  1.20  1.00
assi (resi 22   and name HA  ) (resi 23   and name HN  )  3.00  1.20  1.00
assi (resi 22   and name HB# ) (resi 23   and name HN  )  3.00  1.20  2.00
assi (resi 22   and name HA  ) (resi 25   and name HN  )  3.00  1.20  1.00
assi (resi 22   and name HA  ) (resi 26   and name HN  )  3.00  1.20  1.00

! residue 23   Arg , intraresidue NOEs
assi (resi 23   and name HN  ) (resi 23   and name HA  )  3.00  1.20  1.00
assi (resi 23   and name HN  ) (resi 23   and name HB# )  3.00  1.20  2.00

! residue 23   Arg , NOEs forward in sequence
assi (resi 23   and name HN  ) (resi 24   and name HN  )  3.00  1.20  1.00
assi (resi 23   and name HB# ) (resi 24   and name HN  )  3.00  1.20  2.00
assi (resi 23   and name HN  ) (resi 25   and name HN  )  4.00  1.20  2.00
assi (resi 23   and name HA  ) (resi 26   and name HN  )  3.00  1.20  1.00
assi (resi 23   and name HN  ) (resi 33   and name HG# )  4.00  2.20  4.40

! residue 24   Arg , intraresidue NOEs
assi (resi 24   and name HN  ) (resi 24   and name HA  )  3.00  1.20  1.00
assi (resi 24   and name HN  ) (resi 24   and name HB# )  2.50  0.70  1.30
assi (resi 24   and name HN  ) (resi 24   and name HG# )  4.00  2.20  3.00
assi (resi 24   and name HD1 ) (resi 24   and name HE  )  3.00  1.20  1.00
assi (resi 24   and name HD2 ) (resi 24   and name HE  )  3.00  1.20  1.00
assi (resi 24   and name HE  ) (resi 24   and name HB# )  3.00  1.20  2.00
assi (resi 24   and name HE  ) (resi 24   and name HG# )  3.00  1.20  2.00

! residue 24   Arg , NOEs forward in sequence
assi (resi 24   and name HN  ) (resi 25   and name HN  )  3.00  1.20  1.00
assi (resi 24   and name HB# ) (resi 25   and name HN  )  3.00  1.20  2.00
assi (resi 24   and name HN  ) (resi 26   and name HN  )  4.00  1.20  2.00
assi (resi 24   and name HA  ) (resi 27   and name HN  )  2.50  0.70  0.30
assi (resi 24   and name HA  ) (resi 28   and name HN  )  3.00  1.20  1.00

! residue 25   Ala , intraresidue NOEs
assi (resi 25   and name HN  ) (resi 25   and name HB# )  3.00  1.20  1.30

! residue 25   Ala , NOEs forward in sequence
assi (resi 25   and name HN  ) (resi 26   and name HN  )  3.00  1.20  1.00
assi (resi 25   and name HA  ) (resi 26   and name HN  )  4.00  2.20  2.00
assi (resi 25   and name HB# ) (resi 26   and name HN  )  3.00  1.20  1.30

! residue 26   Glu , intraresidue NOEs
assi (resi 26   and name HN  ) (resi 26   and name HA  )  2.50  0.70  0.30
assi (resi 26   and name HN  ) (resi 26   and name HG1 )  3.00  1.20  1.00
assi (resi 26   and name HN  ) (resi 26   and name HG2 )  3.00  1.20  1.00
assi (resi 26   and name HN  ) (resi 26   and name HB# )  2.50  0.70  1.30

! residue 26   Glu , NOEs forward in sequence
assi (resi 26   and name HN  ) (resi 27   and name HN  )  3.00  1.20  1.00
assi (resi 26   and name HA  ) (resi 27   and name HN  )  3.00  1.20  1.00
assi (resi 26   and name HB1 ) (resi 27   and name HN  )  4.00  2.20  2.00
assi (resi 26   and name HB2 ) (resi 27   and name HN  )  4.00  2.20  2.00
assi (resi 26   and name HN  ) (resi 28   and name HN  )  3.00  1.20  1.00

! residue 27   Gly , intraresidue NOEs
assi (resi 27   and name HN  ) (resi 27   and name HA# )  2.50  0.70  1.30

! residue 27   Gly , NOEs forward in sequence
assi (resi 27   and name HN  ) (resi 28   and name HN  )  2.50  0.70  0.30
assi (resi 27   and name HA# ) (resi 28   and name HN  )  3.00  1.20  2.00

! residue 28   Ala , intraresidue NOEs
assi (resi 28   and name HN  ) (resi 28   and name HB# )  3.00  1.20  1.30

! residue 28   Ala , NOEs forward in sequence
assi (resi 28   and name HN  ) (resi 29   and name HN  )  4.00  2.20  2.00
assi (resi 28   and name HA  ) (resi 29   and name HN  )  2.50  0.70  0.30
assi (resi 28   and name HB# ) (resi 29   and name HN  )  3.00  1.20  1.30

! residue 29   Lys , intraresidue NOEs
assi (resi 29   and name HN  ) (resi 29   and name HA  )  3.00  1.20  1.00
assi (resi 29   and name HN  ) (resi 29   and name HB1 )  3.00  1.20  1.00
assi (resi 29   and name HN  ) (resi 29   and name HB2 )  3.00  1.20  1.00
assi (resi 29   and name HN  ) (resi 29   and name HG1 )  4.00  2.20  2.30
assi (resi 29   and name HN  ) (resi 29   and name HG2 )  4.00  2.20  2.30

! residue 29   Lys , NOEs forward in sequence
assi (resi 29   and name HA  ) (resi 30   and name HN  )  4.00  2.20  2.00
assi (resi 29   and name HB# ) (resi 31   and name HN  )  4.00  2.20  3.00
assi (resi 29   and name HN  ) (resi 32   and name HB# )  4.00  2.20  3.00

! residue 30   Ser , intraresidue NOEs
assi (resi 30   and name HN  ) (resi 30   and name HA  )  3.00  1.20  1.00
assi (resi 30   and name HN  ) (resi 30   and name HB# )  3.00  1.20  2.00

! residue 30   Ser , NOEs forward in sequence
assi (resi 30   and name HN  ) (resi 31   and name HN  )  4.00  2.20  2.00
assi (resi 30   and name HA  ) (resi 31   and name HN  )  2.50  0.70  0.30
assi (resi 30   and name HB1 ) (resi 31   and name HN  )  4.00  2.20  2.00
assi (resi 30   and name HB2 ) (resi 31   and name HN  )  4.00  2.20  2.00
assi (resi 30   and name HA  ) (resi 32   and name HN  )  4.00  2.20  2.00

! residue 31   Thr , intraresidue NOEs
assi (resi 31   and name HN  ) (resi 31   and name HA  )  3.00  1.20  1.00
assi (resi 31   and name HN  ) (resi 31   and name HG2#)  3.00  1.20  1.30

! residue 31   Thr , NOEs forward in sequence
assi (resi 31   and name HN  ) (resi 32   and name HN  )  3.00  1.20  1.00
assi (resi 31   and name HA  ) (resi 32   and name HN  )  3.00  1.20  1.00

! residue 32   Asp , intraresidue NOEs
assi (resi 32   and name HN  ) (resi 32   and name HA  )  3.00  1.20  1.00
assi (resi 32   and name HN  ) (resi 32   and name HB1 )  3.00  1.20  1.00
assi (resi 32   and name HN  ) (resi 32   and name HB2 )  3.00  1.20  1.00

! residue 32   Asp , NOEs forward in sequence
assi (resi 32   and name HN  ) (resi 33   and name HN  )  2.50  0.70  0.30
assi (resi 32   and name HB# ) (resi 33   and name HN  )  3.00  1.20  2.00

! residue 33   Val , intraresidue NOEs
assi (resi 33   and name HN  ) (resi 33   and name HA  )  3.00  1.20  1.00
assi (resi 33   and name HN  ) (resi 33   and name HB  )  3.00  1.20  1.00
assi (resi 33   and name HN  ) (resi 33   and name HG# )  3.00  1.20  3.40

! residue 33   Val , NOEs forward in sequence
assi (resi 33   and name HN  ) (resi 34   and name HN  )  4.00  2.20  2.00
assi (resi 33   and name HA  ) (resi 34   and name HN  )  2.50  0.70  0.30
assi (resi 33   and name HG# ) (resi 34   and name HN  )  3.00  1.20  3.40
assi (resi 33   and name HN  ) (resi 38   and name HG1#)  4.00  2.20  3.00
assi (resi 33   and name HG# ) (resi 38   and name HN  )  3.00  1.20  3.40

! residue 34   Ser , intraresidue NOEs
assi (resi 34   and name HN  ) (resi 34   and name HA  )  3.00  1.20  1.00

! residue 34   Ser , NOEs forward in sequence
assi (resi 34   and name HN  ) (resi 37   and name HN  )  3.00  1.20  1.00
assi (resi 34   and name HN  ) (resi 38   and name HG2#)  4.00  2.20  2.30
assi (resi 34   and name HN  ) (resi 38   and name HD1#)  4.00  2.20  2.30

! residue 35   Phe , intraresidue NOEs
assi (resi 35   and name HN  ) (resi 35   and name HA  )  3.00  1.20  1.00
assi (resi 35   and name HN  ) (resi 35   and name HB# )  3.00  1.20  2.00

! residue 35   Phe , NOEs forward in sequence
assi (resi 35   and name HB# ) (resi 36   and name HN  )  3.00  1.20  2.00
assi (resi 35   and name HB# ) (resi 38   and name HN  )  4.00  2.20  3.00

! residue 36   Ser , intraresidue NOEs
assi (resi 36   and name HN  ) (resi 36   and name HA  )  3.00  1.20  1.00
assi (resi 36   and name HN  ) (resi 36   and name HB# )  3.00  1.20  2.00

! residue 36   Ser , NOEs forward in sequence
assi (resi 36   and name HN  ) (resi 37   and name HN  )  3.00  1.20  1.00
assi (resi 36   and name HA  ) (resi 39   and name HN  )  4.00  2.20  2.00

! residue 37   Ser , intraresidue NOEs
assi (resi 37   and name HN  ) (resi 37   and name HA  )  3.00  1.20  1.00
assi (resi 37   and name HN  ) (resi 37   and name HB1 )  3.00  1.20  1.00
assi (resi 37   and name HN  ) (resi 37   and name HB2 )  3.00  1.20  1.00

! residue 37   Ser , NOEs forward in sequence
assi (resi 37   and name HA  ) (resi 38   and name HN  )  3.00  1.20  1.00
assi (resi 37   and name HB# ) (resi 38   and name HN  )  3.00  1.20  2.00

! residue 38   Ile , intraresidue NOEs
assi (resi 38   and name HN  ) (resi 38   and name HA  )  3.00  1.20  1.00
assi (resi 38   and name HN  ) (resi 38   and name HB  )  2.50  0.70  0.30
assi (resi 38   and name HN  ) (resi 38   and name HG11)  3.00  1.20  1.00
assi (resi 38   and name HN  ) (resi 38   and name HG12)  3.00  1.20  1.00
assi (resi 38   and name HN  ) (resi 38   and name HG2#)  4.00  2.20  2.30
assi (resi 38   and name HN  ) (resi 38   and name HD1#)  3.00  1.20  1.30

! residue 38   Ile , NOEs forward in sequence
assi (resi 38   and name HN  ) (resi 39   and name HN  )  2.50  0.70  0.30
assi (resi 38   and name HA  ) (resi 39   and name HN  )  3.00  1.20  1.00
assi (resi 38   and name HB  ) (resi 39   and name HN  )  3.00  1.20  1.00
assi (resi 38   and name HG2#) (resi 39   and name HN  )  4.00  2.20  2.30
assi (resi 38   and name HG1#) (resi 39   and name HN  )  3.00  1.20  2.00
assi (resi 38   and name HA  ) (resi 41   and name HN  )  3.00  1.20  1.00

! residue 39   Ser , intraresidue NOEs
assi (resi 39   and name HN  ) (resi 39   and name HA  )  3.00  1.20  1.00
assi (resi 39   and name HN  ) (resi 39   and name HB1 )  3.00  1.20  1.00
assi (resi 39   and name HN  ) (resi 39   and name HB2 )  3.00  1.20  1.00

! residue 39   Ser , NOEs forward in sequence
assi (resi 39   and name HN  ) (resi 40   and name HN  )  3.00  1.20  1.00
assi (resi 39   and name HN  ) (resi 40   and name HA  )  4.00  2.20  2.00
assi (resi 39   and name HA  ) (resi 40   and name HN  )  3.00  1.20  1.00
assi (resi 39   and name HB1 ) (resi 40   and name HN  )  3.00  1.20  1.00
assi (resi 39   and name HB2 ) (resi 40   and name HN  )  3.00  1.20  1.00
assi (resi 39   and name HA  ) (resi 41   and name HN  )  4.00  2.20  2.00
assi (resi 39   and name HA  ) (resi 42   and name HN  )  3.00  1.20  1.00

! residue 40   Thr , intraresidue NOEs
assi (resi 40   and name HN  ) (resi 40   and name HB  )  2.50  0.70  0.30
assi (resi 40   and name HN  ) (resi 40   and name HA  )  3.00  1.20  1.00
assi (resi 40   and name HN  ) (resi 40   and name HG2#)  4.00  2.20  2.30

! residue 40   Thr , NOEs forward in sequence
assi (resi 40   and name HN  ) (resi 41   and name HN  )  3.00  1.20  1.00
assi (resi 40   and name HB  ) (resi 41   and name HN  )  3.00  1.20  1.00
assi (resi 40   and name HA  ) (resi 41   and name HN  )  3.00  1.20  1.00
assi (resi 40   and name HG2#) (resi 41   and name HN  )  4.00  2.20  2.30
assi (resi 40   and name HN  ) (resi 42   and name HN  )  4.00  2.20  2.00
assi (resi 40   and name HN  ) (resi 43   and name HD# )  4.00  2.20  4.40
assi (resi 40   and name HA  ) (resi 43   and name HN  )  3.00  1.20  1.00

! residue 41   Met , intraresidue NOEs
assi (resi 41   and name HN  ) (resi 41   and name HA  )  3.00  1.20  1.00
assi (resi 41   and name HN  ) (resi 41   and name HG1 )  3.00  1.20  1.00
assi (resi 41   and name HN  ) (resi 41   and name HG2 )  3.00  1.20  1.00
assi (resi 41   and name HN  ) (resi 41   and name HE# )  4.00  2.20  2.30
assi (resi 41   and name HN  ) (resi 41   and name HB# )  2.50  0.70  1.30

! residue 41   Met , NOEs forward in sequence
assi (resi 41   and name HN  ) (resi 42   and name HN  )  3.00  1.20  1.00
assi (resi 41   and name HA  ) (resi 42   and name HN  )  3.00  1.20  1.00
assi (resi 41   and name HB1 ) (resi 42   and name HN  )  3.00  1.20  1.00
assi (resi 41   and name HB2 ) (resi 42   and name HN  )  3.00  1.20  1.00
assi (resi 41   and name HE# ) (resi 42   and name HN  )  4.00  2.20  2.30
assi (resi 41   and name HG# ) (resi 42   and name HN  )  4.00  2.20  3.00
assi (resi 41   and name HN  ) (resi 43   and name HN  )  4.00  2.20  2.00
assi (resi 41   and name HA  ) (resi 44   and name HN  )  3.00  1.20  1.00

! residue 42   Leu , intraresidue NOEs
assi (resi 42   and name HN  ) (resi 42   and name HA  )  3.00  1.20  1.00
assi (resi 42   and name HN  ) (resi 42   and name HG  )  3.00  1.20  1.00
assi (resi 42   and name HN  ) (resi 42   and name HD1#)  4.00  2.20  2.30
assi (resi 42   and name HN  ) (resi 42   and name HD2#)  4.00  2.20  2.30
assi (resi 42   and name HN  ) (resi 42   and name HB# )  2.50  0.70  1.30

! residue 42   Leu , NOEs forward in sequence
assi (resi 42   and name HN  ) (resi 43   and name HN  )  3.00  1.20  1.00
assi (resi 42   and name HN  ) (resi 43   and name HD# )  4.00  2.20  4.40
assi (resi 42   and name HB1 ) (resi 43   and name HN  )  3.00  1.20  1.00
assi (resi 42   and name HB2 ) (resi 43   and name HN  )  3.00  1.20  1.00
assi (resi 42   and name HG  ) (resi 43   and name HN  )  4.00  2.20  2.00
assi (resi 42   and name HD# ) (resi 43   and name HN  )  4.00  2.20  4.40
assi (resi 42   and name HA  ) (resi 45   and name HN  )  3.00  1.20  1.00
assi (resi 42   and name HB# ) (resi 47   and name HN  )  3.00  1.20  2.00
assi (resi 42   and name HD# ) (resi 47   and name HN  )  4.00  2.20  4.40
assi (resi 42   and name HD# ) (resi 50   and name HN  )  4.00  2.20  4.40
assi (resi 42   and name HD# ) (resi 51   and name HN  )  4.00  2.20  4.40

! residue 43   Leu , intraresidue NOEs
assi (resi 43   and name HN  ) (resi 43   and name HA  )  3.00  1.20  1.00
assi (resi 43   and name HN  ) (resi 43   and name HG  )  4.00  2.20  2.00
assi (resi 43   and name HN  ) (resi 43   and name HB# )  3.00  1.20  2.00
assi (resi 43   and name HN  ) (resi 43   and name HD# )  4.00  2.20  4.40

! residue 43   Leu , NOEs forward in sequence
assi (resi 43   and name HB# ) (resi 44   and name HN  )  3.00  1.20  2.00
assi (resi 43   and name HD# ) (resi 44   and name HN  )  4.00  2.20  4.40
assi (resi 43   and name HA  ) (resi 46   and name HN  )  3.00  1.20  2.00
assi (resi 43   and name HA  ) (resi 47   and name HN  )  3.00  1.20  1.00
assi (resi 43   and name HG  ) (resi 47   and name HN  )  4.00  2.20  2.00

! residue 44   Glu , intraresidue NOEs
assi (resi 44   and name HN  ) (resi 44   and name HA  )  3.00  1.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HB1 )  3.00  1.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HB2 )  3.00  1.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HG1 )  3.00  1.20  1.00
assi (resi 44   and name HN  ) (resi 44   and name HG2 )  3.00  1.20  1.00

! residue 44   Glu , NOEs forward in sequence
assi (resi 44   and name HN  ) (resi 45   and name HG  )  4.00  2.20  2.00
assi (resi 44   and name HN  ) (resi 45   and name HB# )  3.00  1.20  2.00
assi (resi 44   and name HA  ) (resi 45   and name HN  )  3.00  1.20  1.00
assi (resi 44   and name HB1 ) (resi 45   and name HN  )  3.00  1.20  1.00
assi (resi 44   and name HB2 ) (resi 45   and name HN  )  3.00  1.20  1.00
assi (resi 44   and name HG# ) (resi 45   and name HN  )  4.00  2.20  3.00

! residue 45   Leu , intraresidue NOEs
assi (resi 45   and name HN  ) (resi 45   and name HA  )  3.00  1.20  1.00
assi (resi 45   and name HN  ) (resi 45   and name HB1 )  3.00  1.20  1.00
assi (resi 45   and name HN  ) (resi 45   and name HB2 )  3.00  1.20  1.00
assi (resi 45   and name HN  ) (resi 45   and name HG  )  3.00  1.20  1.00
assi (resi 45   and name HN  ) (resi 45   and name HD1#)  4.00  2.20  2.30
assi (resi 45   and name HN  ) (resi 45   and name HD2#)  4.00  2.20  2.30

! residue 45   Leu , NOEs forward in sequence
assi (resi 45   and name HN  ) (resi 46   and name HN  )  2.50  0.70  0.30
assi (resi 45   and name HN  ) (resi 46   and name HA# )  4.00  2.20  3.00
assi (resi 45   and name HA  ) (resi 46   and name HN  )  4.00  2.20  2.00
assi (resi 43   and name HG  ) (resi 46   and name HN  )  3.00  1.20  1.00
assi (resi 45   and name HD1#) (resi 46   and name HN  )  4.00  2.20  2.30
assi (resi 45   and name HD2#) (resi 46   and name HN  )  4.00  2.20  2.30
assi (resi 45   and name HB# ) (resi 48   and name HN  )  3.00  1.20  2.00
assi (resi 45   and name HD1#) (resi 50   and name HN  )  4.00  2.20  2.30
assi (resi 45   and name HD2#) (resi 50   and name HN  )  4.00  2.20  2.30


! residue 46   Gly , intraresidue NOEs
assi (resi 46   and name HN  ) (resi 46   and name HA1 )  3.00  1.20  1.00
assi (resi 46   and name HN  ) (resi 46   and name HA2 )  3.00  1.20  1.00

! residue 46   Gly , NOEs forward in sequence
assi (resi 46   and name HN  ) (resi 47   and name HN  )  2.50  0.70  0.50
assi (resi 46   and name HA1 ) (resi 47   and name HN  )  4.00  2.20  2.00
assi (resi 46   and name HA2 ) (resi 47   and name HN  )  4.00  2.20  2.00

! residue 47   Leu , intraresidue NOEs
assi (resi 47   and name HN  ) (resi 47   and name HA  )  3.00  1.20  1.00
assi (resi 47   and name HN  ) (resi 47   and name HG  )  4.00  2.20  2.00
assi (resi 47   and name HN  ) (resi 47   and name HB# )  3.00  1.20  2.00
assi (resi 47   and name HN  ) (resi 47   and name HD# )  4.00  2.20  4.40

! residue 47   Leu , NOEs forward in sequence
assi (resi 47   and name HN  ) (resi 48   and name HN  )  3.00  1.20  1.00
assi (resi 47   and name HB# ) (resi 48   and name HN  )  3.00  1.20  2.00
assi (resi 47   and name HA  ) (resi 50   and name HN  )  4.00  2.20  2.00
assi (resi 47   and name HD# ) (resi 51   and name HN  )  4.00  2.20  4.40

! residue 48   Arg , intraresidue NOEs
assi (resi 48   and name HN  ) (resi 48   and name HA  )  3.00  1.20  1.00
assi (resi 48   and name HN  ) (resi 48   and name HB1 )  3.00  1.20  1.00
assi (resi 48   and name HN  ) (resi 48   and name HB2 )  3.00  1.20  1.00
assi (resi 48   and name HN  ) (resi 48   and name HG# )  4.00  2.20  3.00
assi (resi 48   and name HE  ) (resi 48   and name HE  )  3.00  1.20  1.00

! residue 48   Arg , NOEs forward in sequence
assi (resi 48   and name HN  ) (resi 49   and name HN  )  3.00  1.20  1.00
assi (resi 48   and name HA  ) (resi 49   and name HN  )  3.00  1.20  1.00
assi (resi 48   and name HB# ) (resi 49   and name HN  )  4.00  2.20  3.00
assi (resi 48   and name HA  ) (resi 51   and name HN  )  3.00  1.20  1.00

! residue 49   Val , intraresidue NOEs
assi (resi 49   and name HN  ) (resi 49   and name HA  )  3.00  1.20  1.00
assi (resi 49   and name HN  ) (resi 49   and name HB  )  3.00  1.20  1.00
assi (resi 49   and name HN  ) (resi 49   and name HG1#)  3.00  1.20  1.30
assi (resi 49   and name HN  ) (resi 49   and name HG2#)  3.00  1.20  1.30

! residue 49   Val , NOEs forward in sequence
assi (resi 49   and name HN  ) (resi 50   and name HN  )  3.00  1.20  1.00
assi (resi 49   and name HA  ) (resi 50   and name HN  )  4.00  2.20  2.00
assi (resi 49   and name HB  ) (resi 50   and name HN  )  3.00  1.20  1.00
assi (resi 49   and name HG1#) (resi 50   and name HN  )  4.00  2.20  2.30
assi (resi 49   and name HG2#) (resi 50   and name HN  )  4.00  2.20  2.30
assi (resi 49   and name HA  ) (resi 52   and name HN  )  3.00  1.20  1.00
assi (resi 49   and name HG# ) (resi 52   and name HN  )  4.00  2.20  4.40
assi (resi 49   and name HA  ) (resi 53   and name HN  )  4.00  2.20  2.00
assi (resi 49   and name HG# ) (resi 53   and name HN  )  4.00  2.20  4.40

! residue 50   Tyr , intraresidue NOEs
assi (resi 50   and name HN  ) (resi 50   and name HA  )  3.00  1.20  1.00
assi (resi 50   and name HN  ) (resi 50   and name HB# )  2.50  0.70  1.30
assi (resi 50   and name HN  ) (resi 50   and name HD# )  4.00  2.20  4.00

! residue 50   Tyr , NOEs forward in sequence
assi (resi 50   and name HN  ) (resi 51   and name HN  )  3.00  1.20  1.00
assi (resi 50   and name HA  ) (resi 51   and name HN  )  3.00  1.20  1.00
assi (resi 50   and name HB# ) (resi 51   and name HN  )  3.00  1.20  1.30
assi (resi 50   and name HD# ) (resi 51   and name HN  )  3.00  1.20  3.00
assi (resi 50   and name HN  ) (resi 52   and name HN  )  4.00  2.20  2.00
assi (resi 50   and name HA  ) (resi 53   and name HN  )  3.00  1.20  1.00

! residue 51   Glu , intraresidue NOEs
assi (resi 51   and name HN  ) (resi 51   and name HA  )  2.50  0.70  0.30
assi (resi 51   and name HN  ) (resi 51   and name HB1 )  2.50  0.70  0.30
assi (resi 51   and name HN  ) (resi 51   and name HB2 )  2.50  0.70  0.30
assi (resi 51   and name HN  ) (resi 51   and name HG1 )  3.00  1.20  1.00
assi (resi 51   and name HN  ) (resi 51   and name HG2 )  3.00  1.20  1.00

! residue 51   Glu , NOEs forward in sequence
assi (resi 51   and name HN  ) (resi 52   and name HN  )  3.00  1.20  1.00
assi (resi 51   and name HN  ) (resi 52   and name HB# )  4.00  2.20  2.30
assi (resi 51   and name HA  ) (resi 52   and name HN  )  3.00  1.20  1.00
assi (resi 51   and name HN  ) (resi 53   and name HN  )  4.00  2.20  2.00
assi (resi 51   and name HA  ) (resi 54   and name HN  )  3.00  1.20  1.00

! residue 52   Ala , intraresidue NOEs
assi (resi 52   and name HN  ) (resi 52   and name HA  )  3.00  1.20  1.00
assi (resi 52   and name HN  ) (resi 52   and name HB# )  3.00  1.20  1.30

! residue 52   Ala , NOEs forward in sequence
assi (resi 52   and name HN  ) (resi 53   and name HN  )  2.50  0.70  0.30
assi (resi 52   and name HN  ) (resi 53   and name HB# )  4.00  2.20  3.00
assi (resi 52   and name HB# ) (resi 53   and name HN  )  3.00  1.20  1.30

! residue 53   Gln , intraresidue NOEs
assi (resi 53   and name HN  ) (resi 53   and name HA  )  2.50  0.70  0.30
assi (resi 53   and name HN  ) (resi 53   and name HG1 )  3.00  1.20  1.00
assi (resi 53   and name HN  ) (resi 53   and name HG2 )  3.00  1.20  1.00
assi (resi 53   and name HN  ) (resi 53   and name HB# )  3.00  1.20  2.00
assi (resi 53   and name HG# ) (resi 53   and name HE2#)  3.00  1.20  3.00

! residue 53   Gln , NOEs forward in sequence
assi (resi 53   and name HA  ) (resi 54   and name HN  )  3.00  1.20  1.00
assi (resi 53   and name HB# ) (resi 54   and name HN  )  3.00  1.20  2.00
assi (resi 53   and name HG# ) (resi 54   and name HN  )  3.00  1.20  2.00

! residue 54   Met , intraresidue NOEs
assi (resi 54   and name HN  ) (resi 54   and name HA  )  3.00  1.20  1.00
assi (resi 54   and name HN  ) (resi 54   and name HB1 )  3.00  1.20  1.00
assi (resi 54   and name HN  ) (resi 54   and name HB2 )  3.00  1.20  1.00
assi (resi 54   and name HN  ) (resi 54   and name HG1 )  3.00  1.20  1.00
assi (resi 54   and name HN  ) (resi 54   and name HG2 )  3.00  1.20  1.00

! residue 54   Met , NOEs forward in sequence
assi (resi 54   and name HN  ) (resi 55   and name HN  )  2.50  0.70  0.30
assi (resi 54   and name HA  ) (resi 55   and name HN  )  3.00  1.20  1.00

! residue 55   Glu , intraresidue NOEs
assi (resi 55   and name HN  ) (resi 55   and name HA  )  3.00  1.20  1.00
assi (resi 55   and name HN  ) (resi 55   and name HB1 )  3.00  1.20  1.00
assi (resi 55   and name HN  ) (resi 55   and name HB2 )  3.00  1.20  1.00
assi (resi 55   and name HN  ) (resi 55   and name HG# )  3.00  1.20  2.00

! residue 55   Glu , NOEs forward in sequence
assi (resi 55   and name HA  ) (resi 56   and name HN  )  2.50  0.70  0.30
assi (resi 55   and name HB1 ) (resi 56   and name HN  )  3.00  1.20  1.00
assi (resi 55   and name HB2 ) (resi 56   and name HN  )  3.00  1.20  1.00

! residue 56   Arg , intraresidue NOEs
assi (resi 56   and name HN  ) (resi 56   and name HA  )  3.00  1.20  1.00
assi (resi 56   and name HN  ) (resi 56   and name HB1 )  3.00  1.20  1.00
assi (resi 56   and name HN  ) (resi 56   and name HB2 )  3.00  1.20  1.00
assi (resi 56   and name HN  ) (resi 56   and name HG# )  3.00  1.20  2.00


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   2          1H        ALA   2 -10.235 -17.673  -7.817
    2   2H    ALA   2          2H        ALA   2  -9.225 -16.840  -6.733
    3   3H    ALA   2          3H        ALA   2  -8.695 -18.285  -7.454
    4    HA   ALA   2           HA       ALA   2  -9.143 -16.925  -9.662
    5   1HB   ALA   2          1HB       ALA   2  -9.014 -15.042  -7.342
    6   2HB   ALA   2          2HB       ALA   2  -9.958 -14.923  -8.827
    7   3HB   ALA   2          3HB       ALA   2  -8.236 -14.544  -8.845
    8    H    LYS   3           H        LYS   3  -7.315 -17.925 -10.472
    9    HA   LYS   3           HA       LYS   3  -4.685 -17.137  -9.281
   10   1HB   LYS   3          2HB       LYS   3  -5.580 -19.911 -10.133
   11   2HB   LYS   3          1HB       LYS   3  -3.983 -19.496  -9.509
   12   1HG   LYS   3          2HG       LYS   3  -5.315 -18.526  -7.475
   13   2HG   LYS   3          1HG       LYS   3  -6.616 -19.564  -8.060
   14   1HD   LYS   3          2HD       LYS   3  -4.048 -20.950  -8.012
   15   2HD   LYS   3          1HD       LYS   3  -4.510 -20.355  -6.417
   16   1HE   LYS   3          2HE       LYS   3  -5.639 -22.393  -6.420
   17   2HE   LYS   3          1HE       LYS   3  -6.888 -21.367  -7.157
   18   1HZ   LYS   3          1HZ       LYS   3  -6.528 -23.246  -8.577
   19   2HZ   LYS   3          2HZ       LYS   3  -4.848 -22.993  -8.581
   20   3HZ   LYS   3          3HZ       LYS   3  -5.879 -21.878  -9.342
   21    H    VAL   4           H        VAL   4  -4.316 -15.722 -11.086
   22    HA   VAL   4           HA       VAL   4  -4.202 -17.033 -13.777
   23    HB   VAL   4           HB       VAL   4  -4.206 -14.101 -12.987
   24   1HG1  VAL   4          1HG1      VAL   4  -4.972 -15.284 -15.653
   25   2HG1  VAL   4          2HG1      VAL   4  -3.288 -14.913 -15.279
   26   3HG1  VAL   4          3HG1      VAL   4  -4.496 -13.628 -15.277
   27   1HG2  VAL   4          1HG2      VAL   4  -6.369 -16.103 -13.343
   28   2HG2  VAL   4          2HG2      VAL   4  -6.624 -14.551 -14.140
   29   3HG2  VAL   4          3HG2      VAL   4  -6.359 -14.614 -12.398
   30    H    GLN   5           H        GLN   5  -2.078 -18.015 -13.164
   31    HA   GLN   5           HA       GLN   5   0.287 -18.003 -13.052
   32   1HB   GLN   5          2HB       GLN   5  -0.327 -15.607 -14.812
   33   2HB   GLN   5          1HB       GLN   5   1.240 -16.410 -14.722
   34   1HG   GLN   5          2HG       GLN   5  -0.335 -18.557 -15.188
   35   2HG   GLN   5          1HG       GLN   5  -1.276 -17.315 -16.015
   36   1HE2  GLN   5          1HE2      GLN   5  -0.091 -19.271 -17.609
   37   2HE2  GLN   5          2HE2      GLN   5   1.220 -18.613 -18.463
   38    H    ALA   6           H        ALA   6   2.102 -15.862 -13.044
   39    HA   ALA   6           HA       ALA   6   3.053 -14.258 -11.589
   40   1HB   ALA   6          1HB       ALA   6   1.608 -12.528 -11.712
   41   2HB   ALA   6          2HB       ALA   6   0.698 -13.223 -10.370
   42   3HB   ALA   6          3HB       ALA   6   0.279 -13.642 -12.032
   43    H    TYR   7           H        TYR   7   4.022 -14.842  -9.688
   44    HA   TYR   7           HA       TYR   7   2.958 -16.836  -7.917
   45   1HB   TYR   7          2HB       TYR   7   5.362 -16.251  -8.310
   46   2HB   TYR   7          1HB       TYR   7   5.099 -14.735  -7.448
   47    HD1  TYR   7           1HD      TYR   7   5.432 -18.375  -7.136
   48    HD2  TYR   7           2HD      TYR   7   4.616 -14.721  -5.032
   49    HE1  TYR   7           1HE      TYR   7   5.788 -19.540  -4.976
   50    HE2  TYR   7           2HE      TYR   7   4.973 -15.885  -2.871
   51    HH   TYR   7           HH       TYR   7   5.652 -17.771  -1.892
   52    H    VAL   8           H        VAL   8   2.061 -16.575  -5.806
   53    HA   VAL   8           HA       VAL   8   0.538 -14.088  -5.402
   54    HB   VAL   8           HB       VAL   8   0.763 -16.774  -4.022
   55   1HG1  VAL   8          1HG1      VAL   8  -1.291 -15.943  -2.736
   56   2HG1  VAL   8          2HG1      VAL   8  -0.828 -14.320  -3.249
   57   3HG1  VAL   8          3HG1      VAL   8   0.262 -15.270  -2.239
   58   1HG2  VAL   8          1HG2      VAL   8  -0.677 -17.257  -5.707
   59   2HG2  VAL   8          2HG2      VAL   8  -0.916 -15.554  -6.098
   60   3HG2  VAL   8          3HG2      VAL   8  -1.854 -16.301  -4.806
   61    H    SER   9           H        SER   9   1.650 -12.393  -4.477
   62    HA   SER   9           HA       SER   9   3.466 -13.018  -2.168
   63   1HB   SER   9          2HB       SER   9   4.097 -11.944  -4.634
   64   2HB   SER   9          1HB       SER   9   3.891 -10.504  -3.639
   65    HG   SER   9           HG       SER   9   5.750 -12.577  -3.462
   66    H    ASP  10           H        ASP  10   3.854 -10.518  -1.169
   67    HA   ASP  10           HA       ASP  10   1.510  -9.948   0.327
   68   1HB   ASP  10          2HB       ASP  10   4.121  -8.595  -0.279
   69   2HB   ASP  10          1HB       ASP  10   2.895  -7.714   0.633
   70    H    GLU  11           H        GLU  11  -0.092  -9.841  -1.524
   71    HA   GLU  11           HA       GLU  11  -0.221  -8.060  -3.629
   72   1HB   GLU  11          2HB       GLU  11  -2.005  -9.591  -3.171
   73   2HB   GLU  11          1HB       GLU  11  -2.289  -8.887  -1.578
   74   1HG   GLU  11          2HG       GLU  11  -3.971  -8.171  -3.302
   75   2HG   GLU  11          1HG       GLU  11  -3.097  -6.826  -2.568
   76    H    ILE  12           H        ILE  12  -0.333  -7.274  -0.207
   77    HA   ILE  12           HA       ILE  12  -1.487  -4.715  -0.200
   78    HB   ILE  12           HB       ILE  12   0.807  -5.991   1.299
   79   1HG1  ILE  12          2HG1      ILE  12  -1.513  -6.851   1.619
   80   2HG1  ILE  12          1HG1      ILE  12  -0.859  -6.130   3.089
   81   1HG2  ILE  12          1HG2      ILE  12  -0.379  -3.229   1.598
   82   2HG2  ILE  12          2HG2      ILE  12   1.323  -3.684   1.508
   83   3HG2  ILE  12          3HG2      ILE  12   0.386  -4.059   2.954
   84   1HD1  ILE  12          1HD1      ILE  12  -2.004  -3.949   1.912
   85   2HD1  ILE  12          2HD1      ILE  12  -2.815  -4.962   3.106
   86   3HD1  ILE  12          3HD1      ILE  12  -3.099  -5.227   1.385
   87    H    VAL  13           H        VAL  13   1.512  -5.751  -1.632
   88    HA   VAL  13           HA       VAL  13   3.131  -3.492  -1.674
   89    HB   VAL  13           HB       VAL  13   3.597  -5.686  -2.729
   90   1HG1  VAL  13          1HG1      VAL  13   1.258  -5.869  -3.712
   91   2HG1  VAL  13          2HG1      VAL  13   2.568  -6.327  -4.802
   92   3HG1  VAL  13          3HG1      VAL  13   1.789  -4.754  -4.972
   93   1HG2  VAL  13          1HG2      VAL  13   4.401  -3.196  -3.609
   94   2HG2  VAL  13          2HG2      VAL  13   3.835  -3.956  -5.097
   95   3HG2  VAL  13          3HG2      VAL  13   5.099  -4.727  -4.138
   96    H    TYR  14           H        TYR  14   0.241  -4.102  -3.674
   97    HA   TYR  14           HA       TYR  14   0.453  -1.684  -5.241
   98   1HB   TYR  14          2HB       TYR  14  -0.844  -3.806  -5.741
   99   2HB   TYR  14          1HB       TYR  14  -2.011  -3.300  -4.519
  100    HD1  TYR  14           1HD      TYR  14  -3.949  -2.704  -5.722
  101    HD2  TYR  14           2HD      TYR  14  -0.118  -1.242  -7.000
  102    HE1  TYR  14           1HE      TYR  14  -5.063  -1.242  -7.388
  103    HE2  TYR  14           2HE      TYR  14  -1.231   0.220  -8.666
  104    HH   TYR  14           HH       TYR  14  -3.462   1.276  -8.982
  105    H    LYS  15           H        LYS  15  -0.937  -2.458  -2.098
  106    HA   LYS  15           HA       LYS  15  -2.578  -0.098  -1.820
  107   1HB   LYS  15          2HB       LYS  15  -1.893  -2.465  -0.402
  108   2HB   LYS  15          1HB       LYS  15  -1.562  -1.110   0.678
  109   1HG   LYS  15          2HG       LYS  15  -3.785  -1.187   1.130
  110   2HG   LYS  15          1HG       LYS  15  -3.970  -0.374  -0.424
  111   1HD   LYS  15          2HD       LYS  15  -3.726  -3.354  -0.418
  112   2HD   LYS  15          1HD       LYS  15  -5.258  -2.645   0.097
  113   1HE   LYS  15          2HE       LYS  15  -4.324  -1.293  -2.283
  114   2HE   LYS  15          1HE       LYS  15  -4.396  -3.044  -2.566
  115   1HZ   LYS  15          1HZ       LYS  15  -6.550  -1.403  -1.338
  116   2HZ   LYS  15          2HZ       LYS  15  -6.609  -3.080  -1.600
  117   3HZ   LYS  15          3HZ       LYS  15  -6.564  -2.011  -2.921
  118    H    ILE  16           H        ILE  16   0.681  -0.912  -0.561
  119    HA   ILE  16           HA       ILE  16   1.177   1.665   0.613
  120    HB   ILE  16           HB       ILE  16   3.105  -0.419  -0.463
  121   1HG1  ILE  16          2HG1      ILE  16   1.644  -0.187   2.186
  122   2HG1  ILE  16          1HG1      ILE  16   1.527  -1.504   1.016
  123   1HG2  ILE  16          1HG2      ILE  16   4.730   0.540   0.934
  124   2HG2  ILE  16          2HG2      ILE  16   3.527   1.369   1.923
  125   3HG2  ILE  16          3HG2      ILE  16   3.888   1.954   0.298
  126   1HD1  ILE  16          1HD1      ILE  16   3.470  -1.110   3.133
  127   2HD1  ILE  16          2HD1      ILE  16   4.271  -1.254   1.569
  128   3HD1  ILE  16          3HD1      ILE  16   3.194  -2.533   2.128
  129    H    ASN  17           H        ASN  17   1.739   0.331  -2.623
  130    HA   ASN  17           HA       ASN  17   3.463   2.337  -3.666
  131   1HB   ASN  17          2HB       ASN  17   1.800   0.144  -4.558
  132   2HB   ASN  17          1HB       ASN  17   1.677   1.491  -5.689
  133   1HD2  ASN  17          1HD2      ASN  17   3.380  -1.262  -5.343
  134   2HD2  ASN  17          2HD2      ASN  17   4.885  -0.784  -5.967
  135    H    LYS  18           H        LYS  18  -0.083   2.244  -3.370
  136    HA   LYS  18           HA       LYS  18  -0.597   4.653  -4.867
  137   1HB   LYS  18          2HB       LYS  18  -2.086   3.121  -2.716
  138   2HB   LYS  18          1HB       LYS  18  -2.792   4.477  -3.595
  139   1HG   LYS  18          2HG       LYS  18  -2.915   3.309  -5.584
  140   2HG   LYS  18          1HG       LYS  18  -1.530   2.291  -5.192
  141   1HD   LYS  18          2HD       LYS  18  -3.670   1.022  -5.134
  142   2HD   LYS  18          1HD       LYS  18  -2.867   1.044  -3.565
  143   1HE   LYS  18          2HE       LYS  18  -4.328   2.913  -2.842
  144   2HE   LYS  18          1HE       LYS  18  -5.156   2.858  -4.411
  145   1HZ   LYS  18          1HZ       LYS  18  -6.448   1.381  -3.289
  146   2HZ   LYS  18          2HZ       LYS  18  -5.213   0.931  -2.213
  147   3HZ   LYS  18          3HZ       LYS  18  -5.238   0.303  -3.792
  148    H    ILE  19           H        ILE  19   0.044   4.001  -1.433
  149    HA   ILE  19           HA       ILE  19  -0.564   6.611  -0.425
  150    HB   ILE  19           HB       ILE  19   1.477   4.571   0.518
  151   1HG1  ILE  19          2HG1      ILE  19  -0.617   3.431   0.236
  152   2HG1  ILE  19          1HG1      ILE  19  -0.484   3.809   1.954
  153   1HG2  ILE  19          1HG2      ILE  19   1.121   7.067   1.490
  154   2HG2  ILE  19          2HG2      ILE  19   1.538   5.694   2.516
  155   3HG2  ILE  19          3HG2      ILE  19  -0.140   6.222   2.388
  156   1HD1  ILE  19          1HD1      ILE  19  -1.708   6.058   1.119
  157   2HD1  ILE  19          2HD1      ILE  19  -2.604   4.622   1.614
  158   3HD1  ILE  19          3HD1      ILE  19  -2.321   4.938  -0.098
  159    H    VAL  20           H        VAL  20   2.660   5.180  -1.112
  160    HA   VAL  20           HA       VAL  20   4.270   7.424  -0.769
  161    HB   VAL  20           HB       VAL  20   4.449   5.409  -3.032
  162   1HG1  VAL  20          1HG1      VAL  20   6.070   7.341  -3.012
  163   2HG1  VAL  20          2HG1      VAL  20   6.837   5.760  -2.859
  164   3HG1  VAL  20          3HG1      VAL  20   6.630   6.782  -1.436
  165   1HG2  VAL  20          1HG2      VAL  20   4.301   4.951  -0.232
  166   2HG2  VAL  20          2HG2      VAL  20   5.987   4.723  -0.697
  167   3HG2  VAL  20          3HG2      VAL  20   4.720   3.788  -1.491
  168    H    GLU  21           H        GLU  21   2.700   6.466  -3.854
  169    HA   GLU  21           HA       GLU  21   3.449   8.681  -5.419
  170   1HB   GLU  21          2HB       GLU  21   1.751   6.449  -5.555
  171   2HB   GLU  21          1HB       GLU  21   0.702   7.832  -5.871
  172   1HG   GLU  21          2HG       GLU  21   3.001   8.406  -7.331
  173   2HG   GLU  21          1HG       GLU  21   2.785   6.671  -7.555
  174    H    ARG  22           H        ARG  22   0.562   8.321  -3.331
  175    HA   ARG  22           HA       ARG  22  -0.716  10.767  -3.801
  176   1HB   ARG  22          2HB       ARG  22  -1.485   8.880  -2.357
  177   2HB   ARG  22          1HB       ARG  22  -0.291   9.351  -1.148
  178   1HG   ARG  22          2HG       ARG  22  -1.408  11.693  -1.270
  179   2HG   ARG  22          1HG       ARG  22  -2.750  10.847  -2.040
  180   1HD   ARG  22          2HD       ARG  22  -3.275   9.643  -0.113
  181   2HD   ARG  22          1HD       ARG  22  -1.622   9.755   0.527
  182    HE   ARG  22           HE       ARG  22  -2.637  12.398   0.290
  183   1HH1  ARG  22          1HH1      ARG  22  -4.558  10.019   1.504
  184   2HH1  ARG  22          2HH1      ARG  22  -4.566  10.573   3.146
  185   1HH2  ARG  22          1HH2      ARG  22  -2.046  12.902   2.649
  186   2HH2  ARG  22          2HH2      ARG  22  -3.145  12.206   3.793
  187    H    ARG  23           H        ARG  23   2.266  10.143  -2.050
  188    HA   ARG  23           HA       ARG  23   2.462  12.559  -0.545
  189   1HB   ARG  23          2HB       ARG  23   4.604  10.864  -1.871
  190   2HB   ARG  23          1HB       ARG  23   4.864  11.977  -0.529
  191   1HG   ARG  23          2HG       ARG  23   3.211   9.441  -0.524
  192   2HG   ARG  23          1HG       ARG  23   4.653   9.787   0.431
  193   1HD   ARG  23          2HD       ARG  23   1.911  11.057   0.711
  194   2HD   ARG  23          1HD       ARG  23   2.805  10.122   1.926
  195    HE   ARG  23           HE       ARG  23   3.503  12.872   1.021
  196   1HH1  ARG  23          1HH1      ARG  23   5.520  10.529   1.916
  197   2HH1  ARG  23          2HH1      ARG  23   5.932  11.146   3.481
  198   1HH2  ARG  23          1HH2      ARG  23   3.389  13.502   3.516
  199   2HH2  ARG  23          2HH2      ARG  23   4.727  12.829   4.386
  200    H    ARG  24           H        ARG  24   4.002  11.789  -3.698
  201    HA   ARG  24           HA       ARG  24   4.796  14.517  -4.207
  202   1HB   ARG  24          2HB       ARG  24   4.659  11.903  -5.646
  203   2HB   ARG  24          1HB       ARG  24   4.845  13.356  -6.629
  204   1HG   ARG  24          2HG       ARG  24   7.057  13.172  -6.183
  205   2HG   ARG  24          1HG       ARG  24   6.647  13.782  -4.580
  206   1HD   ARG  24          2HD       ARG  24   7.920  11.722  -4.300
  207   2HD   ARG  24          1HD       ARG  24   6.231  11.376  -3.875
  208    HE   ARG  24           HE       ARG  24   6.170  10.801  -6.506
  209   1HH1  ARG  24          1HH1      ARG  24   9.290  10.712  -5.737
  210   2HH1  ARG  24          2HH1      ARG  24   9.507   8.994  -5.778
  211   1HH2  ARG  24          1HH2      ARG  24   6.108   8.303  -5.855
  212   2HH2  ARG  24          2HH2      ARG  24   7.704   7.629  -5.844
  213    H    ALA  25           H        ALA  25   2.117  12.506  -5.494
  214    HA   ALA  25           HA       ALA  25   0.898  14.247  -7.272
  215   1HB   ALA  25          1HB       ALA  25  -0.400  12.566  -5.098
  216   2HB   ALA  25          2HB       ALA  25   0.117  11.978  -6.678
  217   3HB   ALA  25          3HB       ALA  25  -1.208  13.135  -6.558
  218    H    GLU  26           H        GLU  26   0.897  14.427  -3.739
  219    HA   GLU  26           HA       GLU  26  -0.944  16.694  -3.661
  220   1HB   GLU  26          2HB       GLU  26   0.638  15.008  -1.754
  221   2HB   GLU  26          1HB       GLU  26   0.009  16.557  -1.187
  222   1HG   GLU  26          2HG       GLU  26  -2.178  15.542  -2.476
  223   2HG   GLU  26          1HG       GLU  26  -1.436  14.068  -1.850
  224    H    GLY  27           H        GLY  27   2.529  16.144  -3.688
  225   1HA   GLY  27          2HA       GLY  27   3.832  18.118  -4.592
  226   2HA   GLY  27          1HA       GLY  27   2.942  19.097  -3.425
  227    H    ALA  28           H        ALA  28   4.030  15.876  -2.600
  228    HA   ALA  28           HA       ALA  28   5.268  16.549  -0.181
  229   1HB   ALA  28          1HB       ALA  28   6.636  14.378  -0.806
  230   2HB   ALA  28          2HB       ALA  28   5.567  14.350  -2.208
  231   3HB   ALA  28          3HB       ALA  28   4.890  14.275  -0.582
  232    H    LYS  29           H        LYS  29   7.746  16.276   0.218
  233    HA   LYS  29           HA       LYS  29   9.336  17.558  -1.971
  234   1HB   LYS  29          2HB       LYS  29   8.871  18.432   0.880
  235   2HB   LYS  29          1HB       LYS  29  10.326  18.926   0.013
  236   1HG   LYS  29          2HG       LYS  29   8.386  19.451  -1.849
  237   2HG   LYS  29          1HG       LYS  29   7.534  19.810  -0.347
  238   1HD   LYS  29          2HD       LYS  29   8.571  21.818  -0.401
  239   2HD   LYS  29          1HD       LYS  29  10.038  20.949   0.048
  240   1HE   LYS  29          2HE       LYS  29   9.265  21.017  -2.852
  241   2HE   LYS  29          1HE       LYS  29  10.019  22.455  -2.134
  242   1HZ   LYS  29          1HZ       LYS  29  11.139  19.817  -1.508
  243   2HZ   LYS  29          2HZ       LYS  29  11.916  21.325  -1.606
  244   3HZ   LYS  29          3HZ       LYS  29  11.488  20.493  -3.024
  245    H    SER  30           H        SER  30  11.761  17.487  -1.315
  246    HA   SER  30           HA       SER  30  13.648  16.208  -0.682
  247   1HB   SER  30          2HB       SER  30  11.912  14.848   1.355
  248   2HB   SER  30          1HB       SER  30  13.566  15.432   1.518
  249    HG   SER  30           HG       SER  30  12.482  17.588   1.138
  250    H    THR  31           H        THR  31  14.507  14.159  -1.232
  251    HA   THR  31           HA       THR  31  12.668  12.355  -2.682
  252    HB   THR  31           HB       THR  31  14.912  13.194  -3.514
  253    HG1  THR  31           1HG      THR  31  15.113  10.425  -3.301
  254   1HG2  THR  31          1HG2      THR  31  16.259  11.117  -1.870
  255   2HG2  THR  31          2HG2      THR  31  15.817  12.612  -1.043
  256   3HG2  THR  31          3HG2      THR  31  16.873  12.664  -2.454
  257    H    ASP  32           H        ASP  32  12.550  12.476   0.296
  258    HA   ASP  32           HA       ASP  32  13.806   9.991   1.247
  259   1HB   ASP  32          2HB       ASP  32  13.313  12.262   2.461
  260   2HB   ASP  32          1HB       ASP  32  11.692  11.597   2.671
  261    H    VAL  33           H        VAL  33  10.743  10.996  -0.084
  262    HA   VAL  33           HA       VAL  33   9.066   8.925   0.984
  263    HB   VAL  33           HB       VAL  33   9.045  10.663  -1.491
  264   1HG1  VAL  33          1HG1      VAL  33   6.503   9.879  -1.386
  265   2HG1  VAL  33          2HG1      VAL  33   7.225   8.431  -0.682
  266   3HG1  VAL  33          3HG1      VAL  33   7.701   8.959  -2.296
  267   1HG2  VAL  33          1HG2      VAL  33   7.737  12.088  -0.247
  268   2HG2  VAL  33          2HG2      VAL  33   8.599  11.323   1.088
  269   3HG2  VAL  33          3HG2      VAL  33   6.981  10.774   0.653
  270    H    SER  34           H        SER  34   8.724   6.821   0.269
  271    HA   SER  34           HA       SER  34   9.493   5.834  -2.330
  272   1HB   SER  34          2HB       SER  34  11.502   6.048  -0.233
  273   2HB   SER  34          1HB       SER  34  11.313   4.381  -0.765
  274    HG   SER  34           HG       SER  34  11.689   5.051  -2.871
  275    H    PHE  35           H        PHE  35   8.866   3.613  -2.575
  276    HA   PHE  35           HA       PHE  35   6.701   2.607  -1.188
  277   1HB   PHE  35          2HB       PHE  35   7.718   1.714  -3.276
  278   2HB   PHE  35          1HB       PHE  35   9.035   1.031  -2.320
  279    HD1  PHE  35           1HD      PHE  35   8.808  -1.074  -1.279
  280    HD2  PHE  35           2HD      PHE  35   5.320   0.983  -2.715
  281    HE1  PHE  35           1HE      PHE  35   7.430  -3.083  -0.810
  282    HE2  PHE  35           2HE      PHE  35   3.943  -1.027  -2.246
  283    HZ   PHE  35           HZ       PHE  35   4.998  -3.059  -1.294
  284    H    SER  36           H        SER  36   9.984   1.286  -0.612
  285    HA   SER  36           HA       SER  36   9.463  -0.117   1.748
  286   1HB   SER  36          2HB       SER  36  11.970   0.609   2.185
  287   2HB   SER  36          1HB       SER  36  11.575  -0.410   0.803
  288    HG   SER  36           HG       SER  36  12.568   1.159  -0.221
  289    H    SER  37           H        SER  37  10.241   3.346   1.390
  290    HA   SER  37           HA       SER  37  10.440   3.981   4.170
  291   1HB   SER  37          2HB       SER  37   9.742   5.482   1.647
  292   2HB   SER  37          1HB       SER  37   9.774   6.298   3.207
  293    HG   SER  37           HG       SER  37  11.827   6.470   2.686
  294    H    ILE  38           H        ILE  38   7.664   4.534   1.957
  295    HA   ILE  38           HA       ILE  38   5.808   5.261   4.003
  296    HB   ILE  38           HB       ILE  38   5.610   4.160   1.196
  297   1HG1  ILE  38          2HG1      ILE  38   6.455   6.485   1.603
  298   2HG1  ILE  38          1HG1      ILE  38   4.955   6.450   0.676
  299   1HG2  ILE  38          1HG2      ILE  38   3.155   5.060   1.476
  300   2HG2  ILE  38          2HG2      ILE  38   3.436   4.737   3.187
  301   3HG2  ILE  38          3HG2      ILE  38   3.548   3.427   2.012
  302   1HD1  ILE  38          1HD1      ILE  38   4.732   8.152   2.383
  303   2HD1  ILE  38          2HD1      ILE  38   5.253   7.026   3.636
  304   3HD1  ILE  38          3HD1      ILE  38   3.700   6.793   2.832
  305    H    SER  39           H        SER  39   7.035   2.159   3.022
  306    HA   SER  39           HA       SER  39   4.802   0.556   3.967
  307   1HB   SER  39          2HB       SER  39   6.363  -0.287   2.318
  308   2HB   SER  39          1HB       SER  39   7.730   0.020   3.385
  309    HG   SER  39           HG       SER  39   7.321  -2.064   3.749
  310    H    THR  40           H        THR  40   8.062   1.223   5.315
  311    HA   THR  40           HA       THR  40   7.873  -0.122   7.755
  312    HB   THR  40           HB       THR  40   9.052   2.614   7.159
  313    HG1  THR  40           1HG      THR  40  10.357   1.500   5.980
  314   1HG2  THR  40          1HG2      THR  40  10.692   1.872   8.965
  315   2HG2  THR  40          2HG2      THR  40   9.531   0.606   9.366
  316   3HG2  THR  40          3HG2      THR  40   9.076   2.302   9.526
  317    H    MET  41           H        MET  41   6.871   3.269   7.135
  318    HA   MET  41           HA       MET  41   5.822   3.830   9.710
  319   1HB   MET  41          2HB       MET  41   4.531   5.565   8.435
  320   2HB   MET  41          1HB       MET  41   6.234   5.507   7.984
  321   1HG   MET  41          2HG       MET  41   5.789   4.414   5.949
  322   2HG   MET  41          1HG       MET  41   4.194   3.883   6.478
  323   1HE   MET  41          1HE       MET  41   2.099   5.290   6.594
  324   2HE   MET  41          2HE       MET  41   2.499   4.652   5.001
  325   3HE   MET  41          3HE       MET  41   1.865   6.288   5.152
  326    H    LEU  42           H        LEU  42   4.438   2.048   7.003
  327    HA   LEU  42           HA       LEU  42   1.700   2.044   7.910
  328   1HB   LEU  42          2HB       LEU  42   3.195   1.184   5.722
  329   2HB   LEU  42          1HB       LEU  42   2.594  -0.315   6.433
  330    HG   LEU  42           HG       LEU  42   0.746   2.026   6.023
  331   1HD1  LEU  42          1HD1      LEU  42   2.090   0.526   3.955
  332   2HD1  LEU  42          2HD1      LEU  42   0.922   1.837   3.787
  333   3HD1  LEU  42          3HD1      LEU  42   0.363   0.170   3.924
  334   1HD2  LEU  42          1HD2      LEU  42  -0.387  -0.552   5.532
  335   2HD2  LEU  42          2HD2      LEU  42  -0.725   0.545   6.871
  336   3HD2  LEU  42          3HD2      LEU  42   0.560  -0.654   7.016
  337    H    LEU  43           H        LEU  43   4.365  -0.322   8.289
  338    HA   LEU  43           HA       LEU  43   3.002  -2.352   9.659
  339   1HB   LEU  43          2HB       LEU  43   5.448  -2.121   8.837
  340   2HB   LEU  43          1HB       LEU  43   5.763  -1.405  10.420
  341    HG   LEU  43           HG       LEU  43   4.341  -3.576  11.178
  342   1HD1  LEU  43          1HD1      LEU  43   6.001  -5.058   9.318
  343   2HD1  LEU  43          2HD1      LEU  43   4.857  -4.038   8.446
  344   3HD1  LEU  43          3HD1      LEU  43   4.271  -5.210   9.626
  345   1HD2  LEU  43          1HD2      LEU  43   6.896  -2.666  11.487
  346   2HD2  LEU  43          2HD2      LEU  43   7.191  -4.174  10.622
  347   3HD2  LEU  43          3HD2      LEU  43   6.316  -4.193  12.153
  348    H    GLU  44           H        GLU  44   3.986   0.814  10.854
  349    HA   GLU  44           HA       GLU  44   3.824   0.299  13.654
  350   1HB   GLU  44          2HB       GLU  44   4.826   2.312  13.048
  351   2HB   GLU  44          1HB       GLU  44   3.692   2.598  11.737
  352   1HG   GLU  44          2HG       GLU  44   2.302   3.769  13.061
  353   2HG   GLU  44          1HG       GLU  44   2.400   2.565  14.341
  354    H    LEU  45           H        LEU  45   1.496   0.938  11.130
  355    HA   LEU  45           HA       LEU  45  -0.767   1.065  13.056
  356   1HB   LEU  45          2HB       LEU  45  -0.144   1.863  10.272
  357   2HB   LEU  45          1HB       LEU  45  -1.795   1.302  10.531
  358    HG   LEU  45           HG       LEU  45  -1.054   3.023  12.706
  359   1HD1  LEU  45          1HD1      LEU  45  -0.530   4.081   9.916
  360   2HD1  LEU  45          2HD1      LEU  45   0.574   4.081  11.291
  361   3HD1  LEU  45          3HD1      LEU  45  -0.843   5.130  11.299
  362   1HD2  LEU  45          1HD2      LEU  45  -3.312   2.403  11.437
  363   2HD2  LEU  45          2HD2      LEU  45  -2.915   3.849  10.508
  364   3HD2  LEU  45          3HD2      LEU  45  -3.131   3.954  12.255
  365    H    GLY  46           H        GLY  46   0.985  -1.315  11.515
  366   1HA   GLY  46          2HA       GLY  46   0.501  -3.510  10.822
  367   2HA   GLY  46          1HA       GLY  46  -0.704  -3.457  12.110
  368    H    LEU  47           H        LEU  47  -0.594  -1.550   9.103
  369    HA   LEU  47           HA       LEU  47  -2.289  -1.251   7.473
  370   1HB   LEU  47          2HB       LEU  47  -1.213  -3.550   7.111
  371   2HB   LEU  47          1HB       LEU  47  -2.635  -4.227   7.907
  372    HG   LEU  47           HG       LEU  47  -3.985  -2.802   6.195
  373   1HD1  LEU  47          1HD1      LEU  47  -1.298  -2.192   5.440
  374   2HD1  LEU  47          2HD1      LEU  47  -2.793  -1.637   4.685
  375   3HD1  LEU  47          3HD1      LEU  47  -2.027  -3.127   4.134
  376   1HD2  LEU  47          1HD2      LEU  47  -4.104  -4.674   4.750
  377   2HD2  LEU  47          2HD2      LEU  47  -3.584  -5.362   6.287
  378   3HD2  LEU  47          3HD2      LEU  47  -2.408  -5.085   5.003
  379    H    ARG  48           H        ARG  48  -3.085  -1.317  10.464
  380    HA   ARG  48           HA       ARG  48  -5.755  -2.461  10.544
  381   1HB   ARG  48          2HB       ARG  48  -4.072  -2.010  12.435
  382   2HB   ARG  48          1HB       ARG  48  -4.575  -0.323  12.332
  383   1HG   ARG  48          2HG       ARG  48  -6.091  -1.053  13.909
  384   2HG   ARG  48          1HG       ARG  48  -7.004  -1.439  12.449
  385   1HD   ARG  48          2HD       ARG  48  -5.114  -3.557  13.257
  386   2HD   ARG  48          1HD       ARG  48  -6.426  -3.267  14.418
  387    HE   ARG  48           HE       ARG  48  -7.654  -3.226  11.908
  388   1HH1  ARG  48          1HH2      ARG  48  -5.182  -5.366  12.605
  389   2HH1  ARG  48          2HH2      ARG  48  -6.133  -6.804  12.441
  390   1HH2  ARG  48          1HH1      ARG  48  -9.145  -5.102  12.190
  391   2HH2  ARG  48          2HH1      ARG  48  -8.376  -6.655  12.206
  392    H    VAL  49           H        VAL  49  -6.188   0.511  11.920
  393    HA   VAL  49           HA       VAL  49  -8.265   1.458  10.392
  394    HB   VAL  49           HB       VAL  49  -7.480   3.737  11.193
  395   1HG1  VAL  49          1HG1      VAL  49  -8.253   3.238  13.278
  396   2HG1  VAL  49          2HG1      VAL  49  -7.060   1.962  13.521
  397   3HG1  VAL  49          3HG1      VAL  49  -8.522   1.636  12.589
  398   1HG2  VAL  49          1HG2      VAL  49  -5.099   3.515  11.016
  399   2HG2  VAL  49          2HG2      VAL  49  -5.099   2.042  11.986
  400   3HG2  VAL  49          3HG2      VAL  49  -5.453   3.597  12.742
  401    H    TYR  50           H        TYR  50  -4.852   1.567   9.560
  402    HA   TYR  50           HA       TYR  50  -4.834   3.528   7.523
  403   1HB   TYR  50          2HB       TYR  50  -2.784   2.586   8.249
  404   2HB   TYR  50          1HB       TYR  50  -3.365   0.937   8.025
  405    HD1  TYR  50           1HD      TYR  50  -3.058  -0.195   5.967
  406    HD2  TYR  50           2HD      TYR  50  -2.458   4.053   6.180
  407    HE1  TYR  50           1HE      TYR  50  -2.131  -0.211   3.668
  408    HE2  TYR  50           2HE      TYR  50  -1.531   4.037   3.879
  409    HH   TYR  50           HH       TYR  50  -1.869   1.423   1.782
  410    H    GLU  51           H        GLU  51  -5.808   0.097   7.394
  411    HA   GLU  51           HA       GLU  51  -6.196  -0.032   4.565
  412   1HB   GLU  51          2HB       GLU  51  -6.140  -1.715   6.711
  413   2HB   GLU  51          1HB       GLU  51  -7.865  -1.675   6.364
  414   1HG   GLU  51          2HG       GLU  51  -6.430  -1.867   3.892
  415   2HG   GLU  51          1HG       GLU  51  -5.843  -3.120   4.985
  416    H    ALA  52           H        ALA  52  -7.982   1.532   7.046
  417    HA   ALA  52           HA       ALA  52 -10.641   1.296   5.916
  418   1HB   ALA  52          1HB       ALA  52 -10.080   1.848   8.281
  419   2HB   ALA  52          2HB       ALA  52 -11.129   3.065   7.554
  420   3HB   ALA  52          3HB       ALA  52  -9.405   3.385   7.741
  421    H    GLN  53           H        GLN  53  -7.942   3.544   5.485
  422    HA   GLN  53           HA       GLN  53  -9.092   5.750   4.262
  423   1HB   GLN  53          2HB       GLN  53  -6.603   4.137   3.701
  424   2HB   GLN  53          1HB       GLN  53  -6.938   5.624   2.816
  425   1HG   GLN  53          2HG       GLN  53  -7.410   6.427   5.387
  426   2HG   GLN  53          1HG       GLN  53  -6.115   5.254   5.627
  427   1HE2  GLN  53          1HE2      GLN  53  -4.500   5.583   3.414
  428   2HE2  GLN  53          2HE2      GLN  53  -3.922   7.176   3.323
  429    H    MET  54           H        MET  54  -8.695   2.509   2.895
  430    HA   MET  54           HA       MET  54  -9.586   3.331   0.217
  431   1HB   MET  54          2HB       MET  54  -8.820   0.782   1.631
  432   2HB   MET  54          1HB       MET  54  -9.547   0.725   0.025
  433   1HG   MET  54          2HG       MET  54  -7.170   0.770  -0.303
  434   2HG   MET  54          1HG       MET  54  -7.766   2.378  -0.717
  435   1HE   MET  54          1HE       MET  54  -5.734   3.232  -0.752
  436   2HE   MET  54          2HE       MET  54  -4.690   3.713   0.583
  437   3HE   MET  54          3HE       MET  54  -6.223   4.544   0.331
  438    H    GLU  55           H        GLU  55 -11.016   2.033   3.146
  439    HA   GLU  55           HA       GLU  55 -13.234   1.343   3.624
  440   1HB   GLU  55          2HB       GLU  55 -13.337   3.695   1.745
  441   2HB   GLU  55          1HB       GLU  55 -14.835   2.966   2.325
  442   1HG   GLU  55          2HG       GLU  55 -13.105   3.247   4.568
  443   2HG   GLU  55          1HG       GLU  55 -13.100   4.784   3.701
  444    H    ARG  56           H        ARG  56 -15.500   1.046   2.169
  445    HA   ARG  56           HA       ARG  56 -15.131  -1.336   0.670
  446   1HB   ARG  56          2HB       ARG  56 -17.489  -0.921   0.016
  447   2HB   ARG  56          1HB       ARG  56 -17.233  -0.585   1.729
  448   1HG   ARG  56          2HG       ARG  56 -16.967   1.825   1.199
  449   2HG   ARG  56          1HG       ARG  56 -17.289   1.472  -0.499
  450   1HD   ARG  56          2HD       ARG  56 -19.364   0.268   1.087
  451   2HD   ARG  56          1HD       ARG  56 -19.205   1.976   1.543
  452    HE   ARG  56           HE       ARG  56 -19.020   1.963  -1.242
  453   1HH1  ARG  56          1HH1      ARG  56 -20.957  -0.412  -0.610
  454   2HH1  ARG  56          2HH1      ARG  56 -22.478   0.383  -0.842
  455   1HH2  ARG  56          1HH2      ARG  56 -21.121   3.573  -0.788
  456   2HH2  ARG  56          2HH2      ARG  56 -22.571   2.638  -0.943
  Start of MODEL    2
    1   1H    ALA   2          1H        ALA   2  -1.026 -21.016 -20.332
    2   2H    ALA   2          2H        ALA   2  -2.084 -22.133 -19.608
    3   3H    ALA   2          3H        ALA   2  -0.475 -22.570 -19.935
    4    HA   ALA   2           HA       ALA   2  -0.005 -20.481 -18.383
    5   1HB   ALA   2          1HB       ALA   2  -2.659 -21.669 -17.518
    6   2HB   ALA   2          2HB       ALA   2  -2.456 -20.084 -18.266
    7   3HB   ALA   2          3HB       ALA   2  -1.769 -20.403 -16.674
    8    H    LYS   3           H        LYS   3   1.484 -22.539 -18.699
    9    HA   LYS   3           HA       LYS   3   1.005 -24.765 -16.857
   10   1HB   LYS   3          2HB       LYS   3   2.438 -24.336 -19.160
   11   2HB   LYS   3          1HB       LYS   3   3.710 -24.289 -17.940
   12   1HG   LYS   3          2HG       LYS   3   2.645 -26.449 -17.012
   13   2HG   LYS   3          1HG       LYS   3   1.789 -26.534 -18.553
   14   1HD   LYS   3          2HD       LYS   3   3.619 -27.514 -19.425
   15   2HD   LYS   3          1HD       LYS   3   4.456 -25.972 -19.232
   16   1HE   LYS   3          2HE       LYS   3   5.481 -26.626 -17.237
   17   2HE   LYS   3          1HE       LYS   3   4.225 -27.824 -16.869
   18   1HZ   LYS   3          1HZ       LYS   3   5.744 -28.129 -19.353
   19   2HZ   LYS   3          2HZ       LYS   3   5.071 -29.320 -18.345
   20   3HZ   LYS   3          3HZ       LYS   3   6.519 -28.548 -17.904
   21    H    VAL   4           H        VAL   4   3.007 -25.297 -15.348
   22    HA   VAL   4           HA       VAL   4   4.258 -24.698 -13.435
   23    HB   VAL   4           HB       VAL   4   4.412 -22.007 -14.823
   24   1HG1  VAL   4          1HG1      VAL   4   5.808 -23.357 -12.603
   25   2HG1  VAL   4          2HG1      VAL   4   5.662 -21.637 -12.959
   26   3HG1  VAL   4          3HG1      VAL   4   6.878 -22.608 -13.787
   27   1HG2  VAL   4          1HG2      VAL   4   5.938 -24.576 -15.351
   28   2HG2  VAL   4          2HG2      VAL   4   6.446 -22.995 -15.945
   29   3HG2  VAL   4          3HG2      VAL   4   4.921 -23.693 -16.488
   30    H    GLN   5           H        GLN   5   3.283 -24.328 -11.488
   31    HA   GLN   5           HA       GLN   5   0.839 -22.871 -11.169
   32   1HB   GLN   5          2HB       GLN   5   1.226 -23.327  -8.808
   33   2HB   GLN   5          1HB       GLN   5   1.766 -24.725  -9.739
   34   1HG   GLN   5          2HG       GLN   5   4.076 -23.425  -9.732
   35   2HG   GLN   5          1HG       GLN   5   3.394 -22.670  -8.292
   36   1HE2  GLN   5          1HE2      GLN   5   2.064 -24.677  -6.997
   37   2HE2  GLN   5          2HE2      GLN   5   3.100 -25.975  -6.643
   38    H    ALA   6           H        ALA   6   0.627 -20.937  -9.669
   39    HA   ALA   6           HA       ALA   6   2.923 -19.170  -9.312
   40   1HB   ALA   6          1HB       ALA   6   2.610 -18.892 -11.693
   41   2HB   ALA   6          2HB       ALA   6   1.969 -17.446 -10.912
   42   3HB   ALA   6          3HB       ALA   6   0.869 -18.697 -11.492
   43    H    TYR   7           H        TYR   7   2.039 -19.134  -7.140
   44    HA   TYR   7           HA       TYR   7  -0.283 -17.281  -6.859
   45   1HB   TYR   7          2HB       TYR   7   0.029 -20.106  -5.889
   46   2HB   TYR   7          1HB       TYR   7  -0.919 -18.970  -4.927
   47    HD1  TYR   7           1HD      TYR   7  -2.438 -17.358  -6.599
   48    HD2  TYR   7           2HD      TYR   7  -1.247 -21.423  -7.315
   49    HE1  TYR   7           1HE      TYR   7  -4.354 -17.646  -8.147
   50    HE2  TYR   7           2HE      TYR   7  -3.165 -21.711  -8.862
   51    HH   TYR   7           HH       TYR   7  -4.775 -19.336 -10.252
   52    H    VAL   8           H        VAL   8   2.213 -16.326  -6.484
   53    HA   VAL   8           HA       VAL   8   2.314 -15.853  -3.574
   54    HB   VAL   8           HB       VAL   8   3.619 -17.848  -3.680
   55   1HG1  VAL   8          1HG1      VAL   8   3.830 -17.972  -6.119
   56   2HG1  VAL   8          2HG1      VAL   8   5.417 -18.144  -5.371
   57   3HG1  VAL   8          3HG1      VAL   8   4.953 -16.611  -6.109
   58   1HG2  VAL   8          1HG2      VAL   8   4.817 -15.340  -3.112
   59   2HG2  VAL   8          2HG2      VAL   8   6.031 -16.294  -3.967
   60   3HG2  VAL   8          3HG2      VAL   8   5.292 -16.920  -2.491
   61    H    SER   9           H        SER   9   2.057 -13.625  -4.003
   62    HA   SER   9           HA       SER   9   4.439 -12.278  -5.166
   63   1HB   SER   9          2HB       SER   9   1.637 -12.314  -6.223
   64   2HB   SER   9          1HB       SER   9   2.564 -10.825  -6.377
   65    HG   SER   9           HG       SER   9   3.034 -13.371  -7.473
   66    H    ASP  10           H        ASP  10   4.944 -10.522  -3.904
   67    HA   ASP  10           HA       ASP  10   3.537  -9.851  -1.534
   68   1HB   ASP  10          2HB       ASP  10   5.061  -7.835  -1.635
   69   2HB   ASP  10          1HB       ASP  10   5.891  -9.375  -1.870
   70    H    GLU  11           H        GLU  11   1.289  -9.659  -2.500
   71    HA   GLU  11           HA       GLU  11   0.499  -7.643  -4.335
   72   1HB   GLU  11          2HB       GLU  11  -0.661  -9.631  -2.803
   73   2HB   GLU  11          1HB       GLU  11  -1.333  -8.164  -2.093
   74   1HG   GLU  11          2HG       GLU  11  -1.263  -8.254  -5.058
   75   2HG   GLU  11          1HG       GLU  11  -2.393  -9.362  -4.278
   76    H    ILE  12           H        ILE  12   1.029  -7.488  -0.823
   77    HA   ILE  12           HA       ILE  12  -0.053  -4.923  -0.294
   78    HB   ILE  12           HB       ILE  12   2.226  -6.557   0.835
   79   1HG1  ILE  12          2HG1      ILE  12  -0.142  -7.321   1.113
   80   2HG1  ILE  12          1HG1      ILE  12   0.640  -6.945   2.650
   81   1HG2  ILE  12          1HG2      ILE  12   2.777  -4.222   1.287
   82   2HG2  ILE  12          2HG2      ILE  12   2.199  -4.981   2.770
   83   3HG2  ILE  12          3HG2      ILE  12   1.135  -3.917   1.852
   84   1HD1  ILE  12          1HD1      ILE  12  -1.744  -5.803   1.558
   85   2HD1  ILE  12          2HD1      ILE  12  -0.519  -4.536   1.646
   86   3HD1  ILE  12          3HD1      ILE  12  -0.964  -5.435   3.097
   87    H    VAL  13           H        VAL  13   3.254  -5.824  -1.329
   88    HA   VAL  13           HA       VAL  13   4.596  -3.412  -1.277
   89    HB   VAL  13           HB       VAL  13   4.466  -5.609  -3.353
   90   1HG1  VAL  13          1HG1      VAL  13   6.744  -4.650  -4.056
   91   2HG1  VAL  13          2HG1      VAL  13   6.252  -3.175  -3.224
   92   3HG1  VAL  13          3HG1      VAL  13   5.315  -3.767  -4.595
   93   1HG2  VAL  13          1HG2      VAL  13   6.354  -6.482  -2.234
   94   2HG2  VAL  13          2HG2      VAL  13   5.333  -5.900  -0.918
   95   3HG2  VAL  13          3HG2      VAL  13   6.714  -4.942  -1.453
   96    H    TYR  14           H        TYR  14   2.512  -4.485  -3.999
   97    HA   TYR  14           HA       TYR  14   2.637  -1.932  -5.362
   98   1HB   TYR  14          2HB       TYR  14   2.128  -4.336  -6.208
   99   2HB   TYR  14          1HB       TYR  14   0.484  -4.026  -5.653
  100    HD1  TYR  14           1HD      TYR  14   3.133  -2.947  -8.003
  101    HD2  TYR  14           2HD      TYR  14  -0.958  -2.455  -6.788
  102    HE1  TYR  14           1HE      TYR  14   2.673  -1.660 -10.072
  103    HE2  TYR  14           2HE      TYR  14  -1.417  -1.168  -8.859
  104    HH   TYR  14           HH       TYR  14  -0.074  -1.207 -11.381
  105    H    LYS  15           H        LYS  15   0.586  -3.283  -2.858
  106    HA   LYS  15           HA       LYS  15  -1.636  -1.449  -3.179
  107   1HB   LYS  15          2HB       LYS  15  -1.596  -3.702  -2.021
  108   2HB   LYS  15          1HB       LYS  15  -0.689  -2.942  -0.713
  109   1HG   LYS  15          2HG       LYS  15  -2.890  -1.246  -1.204
  110   2HG   LYS  15          1HG       LYS  15  -3.535  -2.887  -1.211
  111   1HD   LYS  15          2HD       LYS  15  -1.667  -2.734   0.928
  112   2HD   LYS  15          1HD       LYS  15  -2.706  -1.314   1.040
  113   1HE   LYS  15          2HE       LYS  15  -3.895  -4.052   0.576
  114   2HE   LYS  15          1HE       LYS  15  -3.537  -3.471   2.215
  115   1HZ   LYS  15          1HZ       LYS  15  -5.773  -2.825   1.542
  116   2HZ   LYS  15          2HZ       LYS  15  -5.151  -2.029   0.177
  117   3HZ   LYS  15          3HZ       LYS  15  -4.790  -1.457   1.734
  118    H    ILE  16           H        ILE  16   1.389  -1.396  -1.332
  119    HA   ILE  16           HA       ILE  16   0.719   0.941   0.255
  120    HB   ILE  16           HB       ILE  16   3.394  -0.263  -0.529
  121   1HG1  ILE  16          2HG1      ILE  16   1.699  -1.852   0.497
  122   2HG1  ILE  16          1HG1      ILE  16   3.186  -1.657   1.425
  123   1HG2  ILE  16          1HG2      ILE  16   2.499   1.597   1.682
  124   2HG2  ILE  16          2HG2      ILE  16   3.755   1.875   0.476
  125   3HG2  ILE  16          3HG2      ILE  16   4.010   0.694   1.760
  126   1HD1  ILE  16          1HD1      ILE  16   1.154  -1.540   2.862
  127   2HD1  ILE  16          2HD1      ILE  16   0.616  -0.132   1.945
  128   3HD1  ILE  16          3HD1      ILE  16   2.094  -0.049   2.905
  129    H    ASN  17           H        ASN  17   2.663   0.427  -2.707
  130    HA   ASN  17           HA       ASN  17   3.685   2.963  -3.179
  131   1HB   ASN  17          2HB       ASN  17   2.403   0.928  -5.021
  132   2HB   ASN  17          1HB       ASN  17   3.282   2.333  -5.625
  133   1HD2  ASN  17          1HD2      ASN  17   5.330   1.627  -6.253
  134   2HD2  ASN  17          2HD2      ASN  17   6.317   0.582  -5.349
  135    H    LYS  18           H        LYS  18   0.323   1.915  -3.477
  136    HA   LYS  18           HA       LYS  18  -0.703   4.160  -4.927
  137   1HB   LYS  18          2HB       LYS  18  -1.738   2.039  -3.079
  138   2HB   LYS  18          1HB       LYS  18  -2.810   3.375  -3.501
  139   1HG   LYS  18          2HG       LYS  18  -3.029   2.686  -5.663
  140   2HG   LYS  18          1HG       LYS  18  -1.342   2.182  -5.776
  141   1HD   LYS  18          2HD       LYS  18  -1.772   0.066  -4.944
  142   2HD   LYS  18          1HD       LYS  18  -3.167   0.604  -4.009
  143   1HE   LYS  18          2HE       LYS  18  -3.973  -0.731  -5.889
  144   2HE   LYS  18          1HE       LYS  18  -4.385   0.966  -6.207
  145   1HZ   LYS  18          1HZ       LYS  18  -2.327   1.196  -7.459
  146   2HZ   LYS  18          2HZ       LYS  18  -3.296  -0.029  -8.128
  147   3HZ   LYS  18          3HZ       LYS  18  -1.947  -0.433  -7.176
  148    H    ILE  19           H        ILE  19  -0.727   3.525  -1.394
  149    HA   ILE  19           HA       ILE  19  -1.767   6.049  -0.597
  150    HB   ILE  19           HB       ILE  19   0.061   4.015   0.708
  151   1HG1  ILE  19          2HG1      ILE  19  -2.460   4.152   1.949
  152   2HG1  ILE  19          1HG1      ILE  19  -2.792   4.254   0.219
  153   1HG2  ILE  19          1HG2      ILE  19   0.431   6.119   1.852
  154   2HG2  ILE  19          2HG2      ILE  19  -0.629   5.132   2.858
  155   3HG2  ILE  19          3HG2      ILE  19  -1.300   6.451   1.896
  156   1HD1  ILE  19          1HD1      ILE  19  -1.041   2.144   1.516
  157   2HD1  ILE  19          2HD1      ILE  19  -1.489   2.227  -0.188
  158   3HD1  ILE  19          3HD1      ILE  19  -2.719   1.899   1.032
  159    H    VAL  20           H        VAL  20   1.583   4.986  -1.178
  160    HA   VAL  20           HA       VAL  20   2.841   7.411  -0.239
  161    HB   VAL  20           HB       VAL  20   3.790   5.378  -2.283
  162   1HG1  VAL  20          1HG1      VAL  20   5.781   6.324  -0.441
  163   2HG1  VAL  20          2HG1      VAL  20   4.975   7.711  -1.171
  164   3HG1  VAL  20          3HG1      VAL  20   5.740   6.496  -2.195
  165   1HG2  VAL  20          1HG2      VAL  20   3.195   5.139   0.572
  166   2HG2  VAL  20          2HG2      VAL  20   4.867   4.729   0.196
  167   3HG2  VAL  20          3HG2      VAL  20   3.549   3.876  -0.608
  168    H    GLU  21           H        GLU  21   2.453   6.205  -3.601
  169    HA   GLU  21           HA       GLU  21   3.251   8.424  -5.045
  170   1HB   GLU  21          2HB       GLU  21   1.179   6.296  -5.358
  171   2HB   GLU  21          1HB       GLU  21   1.153   7.625  -6.519
  172   1HG   GLU  21          2HG       GLU  21   3.004   6.865  -7.565
  173   2HG   GLU  21          1HG       GLU  21   3.861   6.650  -6.038
  174    H    ARG  22           H        ARG  22   0.244   8.045  -3.227
  175    HA   ARG  22           HA       ARG  22  -1.319  10.146  -4.232
  176   1HB   ARG  22          2HB       ARG  22  -1.812   8.426  -2.421
  177   2HB   ARG  22          1HB       ARG  22  -0.919   9.461  -1.306
  178   1HG   ARG  22          2HG       ARG  22  -2.672  10.857  -1.086
  179   2HG   ARG  22          1HG       ARG  22  -2.837  11.011  -2.835
  180   1HD   ARG  22          2HD       ARG  22  -4.382   9.272  -2.980
  181   2HD   ARG  22          1HD       ARG  22  -3.777   8.479  -1.511
  182    HE   ARG  22           HE       ARG  22  -5.125   9.943  -0.218
  183   1HH1  ARG  22          1HH2      ARG  22  -6.624   9.990  -2.999
  184   2HH1  ARG  22          2HH2      ARG  22  -7.021  11.674  -3.068
  185   1HH2  ARG  22          1HH1      ARG  22  -4.861  12.562  -0.505
  186   2HH2  ARG  22          2HH1      ARG  22  -6.023  13.131  -1.657
  187    H    ARG  23           H        ARG  23   1.401  10.303  -1.936
  188    HA   ARG  23           HA       ARG  23   1.217  12.994  -1.121
  189   1HB   ARG  23          2HB       ARG  23   3.178  10.847  -1.270
  190   2HB   ARG  23          1HB       ARG  23   3.939  12.421  -1.512
  191   1HG   ARG  23          2HG       ARG  23   2.087  11.729   0.788
  192   2HG   ARG  23          1HG       ARG  23   3.846  11.791   0.891
  193   1HD   ARG  23          2HD       ARG  23   3.856  14.166   0.364
  194   2HD   ARG  23          1HD       ARG  23   2.108  14.141   0.056
  195    HE   ARG  23           HE       ARG  23   3.351  14.184   2.680
  196   1HH1  ARG  23          1HH2      ARG  23   0.669  15.339   2.144
  197   2HH1  ARG  23          2HH2      ARG  23  -0.392  14.202   2.907
  198   1HH2  ARG  23          1HH1      ARG  23   2.000  11.699   3.101
  199   2HH2  ARG  23          2HH1      ARG  23   0.362  12.141   3.449
  200    H    ARG  24           H        ARG  24   3.551  11.942  -3.624
  201    HA   ARG  24           HA       ARG  24   3.929  14.515  -4.759
  202   1HB   ARG  24          2HB       ARG  24   4.847  13.188  -6.667
  203   2HB   ARG  24          1HB       ARG  24   5.409  12.589  -5.107
  204   1HG   ARG  24          2HG       ARG  24   3.357  10.999  -5.229
  205   2HG   ARG  24          1HG       ARG  24   3.342  11.397  -6.946
  206   1HD   ARG  24          2HD       ARG  24   6.040  10.847  -6.356
  207   2HD   ARG  24          1HD       ARG  24   5.107   9.583  -5.529
  208    HE   ARG  24           HE       ARG  24   4.068   9.019  -7.673
  209   1HH1  ARG  24          1HH1      ARG  24   5.128  12.013  -8.408
  210   2HH1  ARG  24          2HH1      ARG  24   6.042  11.587  -9.817
  211   1HH2  ARG  24          1HH2      ARG  24   5.872   8.175  -9.219
  212   2HH2  ARG  24          2HH2      ARG  24   6.464   9.414 -10.275
  213    H    ALA  25           H        ALA  25   1.709  11.889  -5.774
  214    HA   ALA  25           HA       ALA  25   0.578  12.971  -8.069
  215   1HB   ALA  25          1HB       ALA  25  -0.363  11.332  -5.759
  216   2HB   ALA  25          2HB       ALA  25  -0.323  10.927  -7.475
  217   3HB   ALA  25          3HB       ALA  25  -1.605  11.961  -6.843
  218    H    GLU  26           H        GLU  26  -0.020  13.908  -4.704
  219    HA   GLU  26           HA       GLU  26  -2.073  15.856  -5.394
  220   1HB   GLU  26          2HB       GLU  26  -0.613  14.885  -2.966
  221   2HB   GLU  26          1HB       GLU  26  -1.475  16.419  -2.866
  222   1HG   GLU  26          2HG       GLU  26  -2.746  13.864  -3.876
  223   2HG   GLU  26          1HG       GLU  26  -2.849  14.402  -2.200
  224    H    GLY  27           H        GLY  27   1.410  15.845  -4.824
  225   1HA   GLY  27          2HA       GLY  27   2.510  17.792  -6.104
  226   2HA   GLY  27          1HA       GLY  27   1.430  18.816  -5.157
  227    H    ALA  28           H        ALA  28   3.047  15.929  -3.917
  228    HA   ALA  28           HA       ALA  28   4.132  17.435  -1.665
  229   1HB   ALA  28          1HB       ALA  28   5.171  15.081  -1.278
  230   2HB   ALA  28          2HB       ALA  28   4.217  14.593  -2.679
  231   3HB   ALA  28          3HB       ALA  28   3.412  15.220  -1.240
  232    H    LYS  29           H        LYS  29   6.637  16.476  -1.235
  233    HA   LYS  29           HA       LYS  29   8.410  16.436  -3.491
  234   1HB   LYS  29          2HB       LYS  29   9.273  18.835  -3.059
  235   2HB   LYS  29          1HB       LYS  29   7.739  18.678  -3.916
  236   1HG   LYS  29          2HG       LYS  29   6.697  19.849  -2.305
  237   2HG   LYS  29          1HG       LYS  29   7.210  18.671  -1.098
  238   1HD   LYS  29          2HD       LYS  29   8.730  20.107  -0.266
  239   2HD   LYS  29          1HD       LYS  29   9.449  20.325  -1.862
  240   1HE   LYS  29          2HE       LYS  29   8.043  22.153  -2.382
  241   2HE   LYS  29          1HE       LYS  29   6.877  21.728  -1.113
  242   1HZ   LYS  29          1HZ       LYS  29   8.683  23.561  -0.692
  243   2HZ   LYS  29          2HZ       LYS  29   9.667  22.218  -0.353
  244   3HZ   LYS  29          3HZ       LYS  29   8.244  22.480   0.538
  245    H    SER  30           H        SER  30   7.913  17.270  -0.087
  246    HA   SER  30           HA       SER  30  10.587  17.302   0.832
  247   1HB   SER  30          2HB       SER  30   8.071  16.220   2.141
  248   2HB   SER  30          1HB       SER  30   9.535  16.698   2.995
  249    HG   SER  30           HG       SER  30   7.729  18.291   2.746
  250    H    THR  31           H        THR  31  11.950  15.614   1.639
  251    HA   THR  31           HA       THR  31  11.627  13.020   0.310
  252    HB   THR  31           HB       THR  31  13.681  14.143   2.246
  253    HG1  THR  31           1HG      THR  31  13.351  14.167  -0.540
  254   1HG2  THR  31          1HG2      THR  31  13.664  11.676   0.496
  255   2HG2  THR  31          2HG2      THR  31  13.832  11.744   2.251
  256   3HG2  THR  31          3HG2      THR  31  15.128  12.346   1.217
  257    H    ASP  32           H        ASP  32  10.083  14.163   2.906
  258    HA   ASP  32           HA       ASP  32  10.631  12.120   4.914
  259   1HB   ASP  32          2HB       ASP  32   8.968  14.506   4.507
  260   2HB   ASP  32          1HB       ASP  32   8.158  13.254   5.448
  261    H    VAL  33           H        VAL  33   9.207  11.872   1.943
  262    HA   VAL  33           HA       VAL  33   7.293   9.757   2.880
  263    HB   VAL  33           HB       VAL  33   7.209  11.759   0.612
  264   1HG1  VAL  33          1HG1      VAL  33   6.485   9.740  -0.427
  265   2HG1  VAL  33          2HG1      VAL  33   5.004  10.564   0.057
  266   3HG1  VAL  33          3HG1      VAL  33   5.618   9.219   1.017
  267   1HG2  VAL  33          1HG2      VAL  33   4.901  11.198   2.398
  268   2HG2  VAL  33          2HG2      VAL  33   5.506  12.740   1.791
  269   3HG2  VAL  33          3HG2      VAL  33   6.298  11.960   3.158
  270    H    SER  34           H        SER  34   7.290   7.801   1.654
  271    HA   SER  34           HA       SER  34   8.720   7.357  -0.776
  272   1HB   SER  34          2HB       SER  34  10.295   7.656   1.619
  273   2HB   SER  34          1HB       SER  34  10.469   6.012   1.013
  274    HG   SER  34           HG       SER  34  10.629   7.334  -1.120
  275    H    PHE  35           H        PHE  35   8.592   5.127  -1.407
  276    HA   PHE  35           HA       PHE  35   6.457   3.572  -0.524
  277   1HB   PHE  35          2HB       PHE  35   7.616   3.109  -2.574
  278   2HB   PHE  35          1HB       PHE  35   9.141   2.850  -1.728
  279    HD1  PHE  35           1HD      PHE  35   5.611   1.589  -1.418
  280    HD2  PHE  35           2HD      PHE  35   9.795   0.628  -1.588
  281    HE1  PHE  35           1HE      PHE  35   5.069  -0.819  -1.171
  282    HE2  PHE  35           2HE      PHE  35   9.252  -1.779  -1.341
  283    HZ   PHE  35           HZ       PHE  35   6.889  -2.502  -1.132
  284    H    SER  36           H        SER  36   9.883   2.953   0.366
  285    HA   SER  36           HA       SER  36   9.372   0.984   2.343
  286   1HB   SER  36          2HB       SER  36  11.537   2.172   1.178
  287   2HB   SER  36          1HB       SER  36  11.612   2.871   2.793
  288    HG   SER  36           HG       SER  36  12.363   0.464   2.033
  289    H    SER  37           H        SER  37   9.334   4.519   2.544
  290    HA   SER  37           HA       SER  37   9.263   4.721   5.418
  291   1HB   SER  37          2HB       SER  37   9.650   6.439   3.438
  292   2HB   SER  37          1HB       SER  37   7.907   6.663   3.572
  293    HG   SER  37           HG       SER  37   9.954   7.243   5.389
  294    H    ILE  38           H        ILE  38   6.621   5.021   3.006
  295    HA   ILE  38           HA       ILE  38   4.490   5.075   4.916
  296    HB   ILE  38           HB       ILE  38   4.696   4.280   2.000
  297   1HG1  ILE  38          2HG1      ILE  38   5.236   6.659   2.791
  298   2HG1  ILE  38          1HG1      ILE  38   3.992   6.518   1.549
  299   1HG2  ILE  38          1HG2      ILE  38   2.380   4.336   3.876
  300   2HG2  ILE  38          2HG2      ILE  38   2.654   3.322   2.459
  301   3HG2  ILE  38          3HG2      ILE  38   2.120   4.991   2.260
  302   1HD1  ILE  38          1HD1      ILE  38   2.943   6.323   4.289
  303   2HD1  ILE  38          2HD1      ILE  38   2.367   7.288   2.930
  304   3HD1  ILE  38          3HD1      ILE  38   3.694   7.878   3.929
  305    H    SER  39           H        SER  39   5.710   2.375   2.890
  306    HA   SER  39           HA       SER  39   4.004   0.337   3.839
  307   1HB   SER  39          2HB       SER  39   5.456  -1.027   2.659
  308   2HB   SER  39          1HB       SER  39   5.958   0.537   2.021
  309    HG   SER  39           HG       SER  39   7.795  -0.457   2.707
  310    H    THR  40           H        THR  40   7.299   1.125   5.028
  311    HA   THR  40           HA       THR  40   7.504  -0.693   7.132
  312    HB   THR  40           HB       THR  40   8.388   2.176   6.785
  313    HG1  THR  40           1HG      THR  40   9.587   0.983   5.503
  314   1HG2  THR  40          1HG2      THR  40   9.214   0.241   8.967
  315   2HG2  THR  40          2HG2      THR  40   8.234   1.687   9.204
  316   3HG2  THR  40          3HG2      THR  40   9.912   1.835   8.683
  317    H    MET  41           H        MET  41   6.232   2.654   7.458
  318    HA   MET  41           HA       MET  41   5.307   2.295  10.152
  319   1HB   MET  41          2HB       MET  41   4.210   4.438   9.739
  320   2HB   MET  41          1HB       MET  41   5.800   4.448   8.977
  321   1HG   MET  41          2HG       MET  41   4.933   4.414   6.847
  322   2HG   MET  41          1HG       MET  41   3.515   3.483   7.324
  323   1HE   MET  41          1HE       MET  41   1.265   5.601   6.306
  324   2HE   MET  41          2HE       MET  41   0.879   5.290   7.995
  325   3HE   MET  41          3HE       MET  41   1.714   4.060   7.052
  326    H    LEU  42           H        LEU  42   3.923   1.462   7.057
  327    HA   LEU  42           HA       LEU  42   1.156   1.356   7.843
  328   1HB   LEU  42          2HB       LEU  42   2.757   0.956   5.563
  329   2HB   LEU  42          1HB       LEU  42   1.921  -0.577   5.824
  330    HG   LEU  42           HG       LEU  42   0.190   1.760   6.206
  331   1HD1  LEU  42          1HD1      LEU  42   0.441   1.377   3.355
  332   2HD1  LEU  42          2HD1      LEU  42   1.991   1.881   4.030
  333   3HD1  LEU  42          3HD1      LEU  42   0.554   2.871   4.282
  334   1HD2  LEU  42          1HD2      LEU  42  -1.371   0.271   5.476
  335   2HD2  LEU  42          2HD2      LEU  42  -0.095  -0.925   5.706
  336   3HD2  LEU  42          3HD2      LEU  42  -0.381  -0.236   4.108
  337    H    LEU  43           H        LEU  43   3.579  -1.273   7.482
  338    HA   LEU  43           HA       LEU  43   1.900  -3.336   8.538
  339   1HB   LEU  43          2HB       LEU  43   3.946  -3.666   7.186
  340   2HB   LEU  43          1HB       LEU  43   4.920  -3.048   8.524
  341    HG   LEU  43           HG       LEU  43   3.306  -5.001   9.695
  342   1HD1  LEU  43          1HD1      LEU  43   3.555  -5.528   6.878
  343   2HD1  LEU  43          2HD1      LEU  43   2.759  -6.506   8.113
  344   3HD1  LEU  43          3HD1      LEU  43   4.474  -6.741   7.770
  345   1HD2  LEU  43          1HD2      LEU  43   5.444  -6.241   9.889
  346   2HD2  LEU  43          2HD2      LEU  43   5.673  -4.522  10.206
  347   3HD2  LEU  43          3HD2      LEU  43   6.152  -5.203   8.652
  348    H    GLU  44           H        GLU  44   4.371  -1.280  10.123
  349    HA   GLU  44           HA       GLU  44   4.265  -2.460  12.705
  350   1HB   GLU  44          2HB       GLU  44   4.905   0.239  11.543
  351   2HB   GLU  44          1HB       GLU  44   4.843   0.061  13.297
  352   1HG   GLU  44          2HG       GLU  44   7.111  -0.363  12.698
  353   2HG   GLU  44          1HG       GLU  44   6.399  -1.949  13.003
  354    H    LEU  45           H        LEU  45   2.012  -0.488  10.982
  355    HA   LEU  45           HA       LEU  45   0.436   0.113  13.437
  356   1HB   LEU  45          2HB       LEU  45   0.941   1.277  10.813
  357   2HB   LEU  45          1HB       LEU  45  -0.786   1.182  11.154
  358    HG   LEU  45           HG       LEU  45   0.683   2.066  13.495
  359   1HD1  LEU  45          1HD1      LEU  45   2.206   3.420  12.523
  360   2HD1  LEU  45          2HD1      LEU  45   0.848   4.399  11.968
  361   3HD1  LEU  45          3HD1      LEU  45   1.520   3.149  10.922
  362   1HD2  LEU  45          1HD2      LEU  45  -1.771   2.552  12.060
  363   2HD2  LEU  45          2HD2      LEU  45  -0.996   4.092  12.433
  364   3HD2  LEU  45          3HD2      LEU  45  -1.376   2.959  13.730
  365    H    GLY  46           H        GLY  46   0.644  -2.239  11.001
  366   1HA   GLY  46          2HA       GLY  46  -0.785  -4.030  10.475
  367   2HA   GLY  46          1HA       GLY  46  -1.803  -3.527  11.826
  368    H    LEU  47           H        LEU  47  -0.926  -1.416   9.144
  369    HA   LEU  47           HA       LEU  47  -2.238  -0.544   7.370
  370   1HB   LEU  47          2HB       LEU  47  -3.144  -3.152   7.825
  371   2HB   LEU  47          1HB       LEU  47  -4.610  -2.171   7.839
  372    HG   LEU  47           HG       LEU  47  -3.164  -1.130   5.708
  373   1HD1  LEU  47          1HD1      LEU  47  -1.969  -3.561   6.232
  374   2HD1  LEU  47          2HD1      LEU  47  -1.963  -2.749   4.668
  375   3HD1  LEU  47          3HD1      LEU  47  -3.169  -3.986   5.014
  376   1HD2  LEU  47          1HD2      LEU  47  -5.440  -3.084   5.978
  377   2HD2  LEU  47          2HD2      LEU  47  -4.857  -2.619   4.380
  378   3HD2  LEU  47          3HD2      LEU  47  -5.487  -1.393   5.480
  379    H    ARG  48           H        ARG  48  -3.031  -0.512  10.632
  380    HA   ARG  48           HA       ARG  48  -5.597   0.850  10.521
  381   1HB   ARG  48          2HB       ARG  48  -3.794  -0.276  12.424
  382   2HB   ARG  48          1HB       ARG  48  -4.104   1.391  12.910
  383   1HG   ARG  48          2HG       ARG  48  -6.540   0.982  12.730
  384   2HG   ARG  48          1HG       ARG  48  -6.216  -0.694  12.288
  385   1HD   ARG  48          2HD       ARG  48  -5.210  -1.146  14.446
  386   2HD   ARG  48          1HD       ARG  48  -5.282   0.572  14.888
  387    HE   ARG  48           HE       ARG  48  -7.774  -0.970  14.278
  388   1HH1  ARG  48          1HH2      ARG  48  -6.771  -1.042  17.127
  389   2HH1  ARG  48          2HH2      ARG  48  -7.640   0.279  17.837
  390   1HH2  ARG  48          1HH1      ARG  48  -8.517   1.685  14.791
  391   2HH2  ARG  48          2HH1      ARG  48  -8.629   1.821  16.515
  392    H    VAL  49           H        VAL  49  -2.621   1.854   9.486
  393    HA   VAL  49           HA       VAL  49  -2.182   4.409  10.605
  394    HB   VAL  49           HB       VAL  49  -1.138   4.802   8.294
  395   1HG1  VAL  49          1HG1      VAL  49   0.650   3.797   9.218
  396   2HG1  VAL  49          2HG1      VAL  49  -0.065   2.203   8.965
  397   3HG1  VAL  49          3HG1      VAL  49  -0.432   3.111  10.429
  398   1HG2  VAL  49          1HG2      VAL  49  -1.787   1.902   7.813
  399   2HG2  VAL  49          2HG2      VAL  49  -1.275   3.128   6.655
  400   3HG2  VAL  49          3HG2      VAL  49  -2.918   3.152   7.295
  401    H    TYR  50           H        TYR  50  -2.763   5.100   7.365
  402    HA   TYR  50           HA       TYR  50  -4.458   7.239   7.624
  403   1HB   TYR  50          2HB       TYR  50  -5.271   6.502   5.285
  404   2HB   TYR  50          1HB       TYR  50  -3.531   6.693   5.503
  405    HD1  TYR  50           1HD      TYR  50  -6.282   4.174   5.502
  406    HD2  TYR  50           2HD      TYR  50  -2.051   4.863   5.226
  407    HE1  TYR  50           1HE      TYR  50  -5.936   1.801   4.870
  408    HE2  TYR  50           2HE      TYR  50  -1.706   2.490   4.593
  409    HH   TYR  50           HH       TYR  50  -4.444   0.213   4.439
  410    H    GLU  51           H        GLU  51  -5.377   3.843   7.856
  411    HA   GLU  51           HA       GLU  51  -8.192   4.111   7.554
  412   1HB   GLU  51          2HB       GLU  51  -6.347   2.137   7.864
  413   2HB   GLU  51          1HB       GLU  51  -7.075   2.145   9.467
  414   1HG   GLU  51          2HG       GLU  51  -9.136   2.368   7.472
  415   2HG   GLU  51          1HG       GLU  51  -8.116   0.974   7.116
  416    H    ALA  52           H        ALA  52  -6.026   4.658  10.289
  417    HA   ALA  52           HA       ALA  52  -8.109   4.797  12.310
  418   1HB   ALA  52          1HB       ALA  52  -5.250   5.810  12.154
  419   2HB   ALA  52          2HB       ALA  52  -5.776   4.263  12.817
  420   3HB   ALA  52          3HB       ALA  52  -6.209   5.766  13.634
  421    H    GLN  53           H        GLN  53  -6.460   7.153  10.230
  422    HA   GLN  53           HA       GLN  53  -7.376   9.543  11.469
  423   1HB   GLN  53          2HB       GLN  53  -6.828   8.924   8.548
  424   2HB   GLN  53          1HB       GLN  53  -6.797  10.525   9.288
  425   1HG   GLN  53          2HG       GLN  53  -5.107   8.429  10.559
  426   2HG   GLN  53          1HG       GLN  53  -4.573   9.040   8.992
  427   1HE2  GLN  53          1HE2      GLN  53  -3.009  10.616   9.402
  428   2HE2  GLN  53          2HE2      GLN  53  -3.157  11.852  10.557
  429    H    MET  54           H        MET  54  -8.700   7.971   8.520
  430    HA   MET  54           HA       MET  54 -11.066   9.566   8.389
  431   1HB   MET  54          2HB       MET  54 -11.766   7.871   6.784
  432   2HB   MET  54          1HB       MET  54 -10.032   8.142   6.595
  433   1HG   MET  54          2HG       MET  54  -9.734   6.191   8.259
  434   2HG   MET  54          1HG       MET  54 -11.428   5.825   7.931
  435   1HE   MET  54          1HE       MET  54 -12.139   6.523   5.497
  436   2HE   MET  54          2HE       MET  54 -11.544   5.587   4.128
  437   3HE   MET  54          3HE       MET  54 -10.821   7.150   4.497
  438    H    GLU  55           H        GLU  55 -10.394   6.467   9.995
  439    HA   GLU  55           HA       GLU  55 -11.797   5.123  11.369
  440   1HB   GLU  55          2HB       GLU  55 -12.367   6.382  13.335
  441   2HB   GLU  55          1HB       GLU  55 -10.911   7.120  12.674
  442   1HG   GLU  55          2HG       GLU  55 -12.141   8.934  11.725
  443   2HG   GLU  55          1HG       GLU  55 -13.682   8.119  11.989
  444    H    ARG  56           H        ARG  56 -14.236   5.786  12.620
  445    HA   ARG  56           HA       ARG  56 -16.090   5.496  10.344
  446   1HB   ARG  56          2HB       ARG  56 -15.862   4.558  12.978
  447   2HB   ARG  56          1HB       ARG  56 -17.254   5.644  13.008
  448   1HG   ARG  56          2HG       ARG  56 -17.810   4.351  10.728
  449   2HG   ARG  56          1HG       ARG  56 -16.881   3.083  11.529
  450   1HD   ARG  56          2HD       ARG  56 -18.647   4.198  13.478
  451   2HD   ARG  56          1HD       ARG  56 -19.599   3.836  12.024
  452    HE   ARG  56           HE       ARG  56 -18.441   1.859  13.749
  453   1HH1  ARG  56          1HH2      ARG  56 -19.415   2.626  10.554
  454   2HH1  ARG  56          2HH2      ARG  56 -19.135   1.034   9.934
  455   1HH2  ARG  56          1HH1      ARG  56 -17.833  -0.184  12.907
  456   2HH2  ARG  56          2HH1      ARG  56 -18.240  -0.557  11.266
  Start of MODEL    3
    1   1H    ALA   2          1H        ALA   2  -4.639 -30.703   3.406
    2   2H    ALA   2          2H        ALA   2  -5.160 -30.974   5.000
    3   3H    ALA   2          3H        ALA   2  -3.742 -31.716   4.430
    4    HA   ALA   2           HA       ALA   2  -3.640 -29.550   5.911
    5   1HB   ALA   2          1HB       ALA   2  -1.777 -30.899   5.084
    6   2HB   ALA   2          2HB       ALA   2  -1.441 -29.199   4.756
    7   3HB   ALA   2          3HB       ALA   2  -1.997 -30.254   3.458
    8    H    LYS   3           H        LYS   3  -3.022 -28.982   2.445
    9    HA   LYS   3           HA       LYS   3  -5.024 -26.892   2.184
   10   1HB   LYS   3          2HB       LYS   3  -3.291 -25.042   2.097
   11   2HB   LYS   3          1HB       LYS   3  -3.534 -25.738   3.701
   12   1HG   LYS   3          2HG       LYS   3  -1.578 -27.363   2.560
   13   2HG   LYS   3          1HG       LYS   3  -1.141 -25.738   2.033
   14   1HD   LYS   3          2HD       LYS   3  -1.414 -24.989   4.438
   15   2HD   LYS   3          1HD       LYS   3  -1.563 -26.692   4.874
   16   1HE   LYS   3          2HE       LYS   3   0.814 -25.483   3.411
   17   2HE   LYS   3          1HE       LYS   3   0.781 -25.908   5.134
   18   1HZ   LYS   3          1HZ       LYS   3   0.134 -28.174   4.490
   19   2HZ   LYS   3          2HZ       LYS   3   1.660 -27.752   3.873
   20   3HZ   LYS   3          3HZ       LYS   3   0.300 -27.756   2.856
   21    H    VAL   4           H        VAL   4  -4.061 -25.372   0.187
   22    HA   VAL   4           HA       VAL   4  -3.429 -27.359  -1.944
   23    HB   VAL   4           HB       VAL   4  -4.529 -24.535  -1.886
   24   1HG1  VAL   4          1HG1      VAL   4  -4.923 -25.026  -4.384
   25   2HG1  VAL   4          2HG1      VAL   4  -3.710 -26.294  -4.202
   26   3HG1  VAL   4          3HG1      VAL   4  -3.278 -24.611  -3.903
   27   1HG2  VAL   4          1HG2      VAL   4  -5.795 -27.088  -2.908
   28   2HG2  VAL   4          2HG2      VAL   4  -6.589 -25.555  -2.549
   29   3HG2  VAL   4          3HG2      VAL   4  -5.965 -26.553  -1.236
   30    H    GLN   5           H        GLN   5  -1.661 -25.489   0.062
   31    HA   GLN   5           HA       GLN   5   0.518 -24.585  -0.068
   32   1HB   GLN   5          2HB       GLN   5   0.548 -25.976  -2.760
   33   2HB   GLN   5          1HB       GLN   5   1.924 -25.654  -1.703
   34   1HG   GLN   5          2HG       GLN   5   0.885 -27.139   0.023
   35   2HG   GLN   5          1HG       GLN   5  -0.382 -27.539  -1.137
   36   1HE2  GLN   5          1HE2      GLN   5   1.951 -29.190   0.082
   37   2HE2  GLN   5          2HE2      GLN   5   2.693 -29.887  -1.277
   38    H    ALA   6           H        ALA   6   1.711 -22.856  -1.159
   39    HA   ALA   6           HA       ALA   6   1.795 -20.810  -2.344
   40   1HB   ALA   6          1HB       ALA   6   1.231 -21.058  -4.689
   41   2HB   ALA   6          2HB       ALA   6   0.162 -22.412  -4.333
   42   3HB   ALA   6          3HB       ALA   6   1.905 -22.590  -4.136
   43    H    TYR   7           H        TYR   7   0.386 -19.665  -0.848
   44    HA   TYR   7           HA       TYR   7  -2.136 -18.783  -2.079
   45   1HB   TYR   7          2HB       TYR   7  -2.781 -20.866  -0.968
   46   2HB   TYR   7          1HB       TYR   7  -2.033 -20.324   0.534
   47    HD1  TYR   7           1HD      TYR   7  -3.602 -19.693   2.132
   48    HD2  TYR   7           2HD      TYR   7  -4.323 -18.756  -1.998
   49    HE1  TYR   7           1HE      TYR   7  -5.702 -18.535   2.762
   50    HE2  TYR   7           2HE      TYR   7  -6.422 -17.596  -1.368
   51    HH   TYR   7           HH       TYR   7  -8.054 -17.627   0.481
   52    H    VAL   8           H        VAL   8   0.096 -17.238  -1.566
   53    HA   VAL   8           HA       VAL   8  -0.934 -15.165   0.150
   54    HB   VAL   8           HB       VAL   8  -0.366 -16.698   1.924
   55   1HG1  VAL   8          1HG1      VAL   8   1.761 -17.407   0.096
   56   2HG1  VAL   8          2HG1      VAL   8   1.173 -18.289   1.506
   57   3HG1  VAL   8          3HG1      VAL   8   2.423 -17.059   1.693
   58   1HG2  VAL   8          1HG2      VAL   8   1.122 -14.235   1.495
   59   2HG2  VAL   8          2HG2      VAL   8   2.031 -15.362   2.502
   60   3HG2  VAL   8          3HG2      VAL   8   0.410 -14.860   2.982
   61    H    SER   9           H        SER   9   0.008 -13.297  -0.588
   62    HA   SER   9           HA       SER   9   2.846 -13.310  -1.458
   63   1HB   SER   9          2HB       SER   9   0.668 -13.654  -3.222
   64   2HB   SER   9          1HB       SER   9   1.188 -11.984  -3.432
   65    HG   SER   9           HG       SER   9   2.284 -13.987  -4.541
   66    H    ASP  10           H        ASP  10   3.787 -11.282  -1.141
   67    HA   ASP  10           HA       ASP  10   2.485  -9.347   0.500
   68   1HB   ASP  10          2HB       ASP  10   5.039  -9.952  -0.433
   69   2HB   ASP  10          1HB       ASP  10   4.710  -8.366  -1.130
   70    H    GLU  11           H        GLU  11   0.476  -9.237  -1.028
   71    HA   GLU  11           HA       GLU  11   0.675  -7.800  -3.531
   72   1HB   GLU  11          2HB       GLU  11  -1.780  -7.745  -3.301
   73   2HB   GLU  11          1HB       GLU  11  -1.159  -9.338  -2.863
   74   1HG   GLU  11          2HG       GLU  11  -2.020  -9.149  -0.795
   75   2HG   GLU  11          1HG       GLU  11  -1.144  -7.638  -0.538
   76    H    ILE  12           H        ILE  12   1.074  -6.768  -0.341
   77    HA   ILE  12           HA       ILE  12  -0.267  -4.234  -0.330
   78    HB   ILE  12           HB       ILE  12   1.445  -3.777   1.475
   79   1HG1  ILE  12          2HG1      ILE  12   2.457  -6.526   1.418
   80   2HG1  ILE  12          1HG1      ILE  12   2.963  -5.589   0.012
   81   1HG2  ILE  12          1HG2      ILE  12   0.552  -5.409   2.976
   82   2HG2  ILE  12          2HG2      ILE  12   0.292  -6.568   1.672
   83   3HG2  ILE  12          3HG2      ILE  12  -0.710  -5.120   1.778
   84   1HD1  ILE  12          1HD1      ILE  12   3.487  -3.732   1.811
   85   2HD1  ILE  12          2HD1      ILE  12   4.636  -5.042   1.536
   86   3HD1  ILE  12          3HD1      ILE  12   3.540  -5.105   2.916
   87    H    VAL  13           H        VAL  13   2.501  -5.340  -2.056
   88    HA   VAL  13           HA       VAL  13   4.062  -2.970  -2.263
   89    HB   VAL  13           HB       VAL  13   3.517  -5.327  -4.083
   90   1HG1  VAL  13          1HG1      VAL  13   5.145  -2.866  -4.530
   91   2HG1  VAL  13          2HG1      VAL  13   4.316  -3.892  -5.700
   92   3HG1  VAL  13          3HG1      VAL  13   5.858  -4.406  -5.014
   93   1HG2  VAL  13          1HG2      VAL  13   5.743  -6.028  -3.310
   94   2HG2  VAL  13          2HG2      VAL  13   4.688  -5.736  -1.927
   95   3HG2  VAL  13          3HG2      VAL  13   5.903  -4.540  -2.376
   96    H    TYR  14           H        TYR  14   1.848  -4.217  -4.791
   97    HA   TYR  14           HA       TYR  14   1.693  -1.775  -6.254
   98   1HB   TYR  14          2HB       TYR  14   0.880  -4.378  -6.526
   99   2HB   TYR  14          1HB       TYR  14  -0.663  -3.563  -6.259
  100    HD1  TYR  14           1HD      TYR  14  -0.438  -0.999  -7.499
  101    HD2  TYR  14           2HD      TYR  14   1.200  -4.748  -8.807
  102    HE1  TYR  14           1HE      TYR  14  -0.405  -0.170  -9.837
  103    HE2  TYR  14           2HE      TYR  14   1.232  -3.920 -11.144
  104    HH   TYR  14           HH       TYR  14  -0.454  -1.615 -12.299
  105    H    LYS  15           H        LYS  15  -0.160  -2.972  -3.488
  106    HA   LYS  15           HA       LYS  15  -2.265  -0.981  -3.655
  107   1HB   LYS  15          2HB       LYS  15  -2.544  -3.128  -2.525
  108   2HB   LYS  15          1HB       LYS  15  -1.219  -2.751  -1.424
  109   1HG   LYS  15          2HG       LYS  15  -2.491  -1.330  -0.160
  110   2HG   LYS  15          1HG       LYS  15  -3.405  -0.748  -1.552
  111   1HD   LYS  15          2HD       LYS  15  -3.754  -3.513  -0.364
  112   2HD   LYS  15          1HD       LYS  15  -4.759  -2.130   0.071
  113   1HE   LYS  15          2HE       LYS  15  -5.891  -2.164  -1.926
  114   2HE   LYS  15          1HE       LYS  15  -4.450  -2.641  -2.845
  115   1HZ   LYS  15          1HZ       LYS  15  -5.537  -4.510  -0.863
  116   2HZ   LYS  15          2HZ       LYS  15  -4.706  -4.834  -2.308
  117   3HZ   LYS  15          3HZ       LYS  15  -6.340  -4.369  -2.351
  118    H    ILE  16           H        ILE  16   0.521  -1.339  -1.418
  119    HA   ILE  16           HA       ILE  16   0.213   1.186  -0.124
  120    HB   ILE  16           HB       ILE  16   2.648  -0.542  -0.675
  121   1HG1  ILE  16          2HG1      ILE  16   0.636  -1.554   0.535
  122   2HG1  ILE  16          1HG1      ILE  16   2.162  -1.599   1.417
  123   1HG2  ILE  16          1HG2      ILE  16   2.270   1.983   0.802
  124   2HG2  ILE  16          2HG2      ILE  16   3.751   1.249   0.189
  125   3HG2  ILE  16          3HG2      ILE  16   3.074   0.714   1.726
  126   1HD1  ILE  16          1HD1      ILE  16   0.609   0.863   1.851
  127   2HD1  ILE  16          2HD1      ILE  16   1.413  -0.180   3.023
  128   3HD1  ILE  16          3HD1      ILE  16  -0.191  -0.600   2.424
  129    H    ASN  17           H        ASN  17   2.235   0.231  -2.917
  130    HA   ASN  17           HA       ASN  17   3.635   2.578  -3.432
  131   1HB   ASN  17          2HB       ASN  17   3.589   0.327  -4.651
  132   2HB   ASN  17          1HB       ASN  17   2.194   0.945  -5.537
  133   1HD2  ASN  17          1HD2      ASN  17   5.633   0.920  -5.439
  134   2HD2  ASN  17          2HD2      ASN  17   5.899   2.115  -6.615
  135    H    LYS  18           H        LYS  18   0.247   1.866  -4.319
  136    HA   LYS  18           HA       LYS  18  -0.302   4.202  -5.830
  137   1HB   LYS  18          2HB       LYS  18  -1.818   2.220  -4.183
  138   2HB   LYS  18          1HB       LYS  18  -2.670   3.679  -4.692
  139   1HG   LYS  18          2HG       LYS  18  -2.594   3.116  -6.921
  140   2HG   LYS  18          1HG       LYS  18  -1.060   2.258  -6.759
  141   1HD   LYS  18          2HD       LYS  18  -2.303   0.366  -6.846
  142   2HD   LYS  18          1HD       LYS  18  -2.759   0.752  -5.186
  143   1HE   LYS  18          2HE       LYS  18  -4.266   1.652  -7.670
  144   2HE   LYS  18          1HE       LYS  18  -4.782   0.374  -6.552
  145   1HZ   LYS  18          1HZ       LYS  18  -4.760   1.951  -4.747
  146   2HZ   LYS  18          2HZ       LYS  18  -5.760   2.541  -5.988
  147   3HZ   LYS  18          3HZ       LYS  18  -4.202   3.182  -5.772
  148    H    ILE  19           H        ILE  19  -0.325   3.671  -2.316
  149    HA   ILE  19           HA       ILE  19  -1.467   6.237  -1.629
  150    HB   ILE  19           HB       ILE  19   0.273   4.265  -0.112
  151   1HG1  ILE  19          2HG1      ILE  19  -1.889   3.381  -1.025
  152   2HG1  ILE  19          1HG1      ILE  19  -1.843   3.402   0.738
  153   1HG2  ILE  19          1HG2      ILE  19   0.334   6.341   1.080
  154   2HG2  ILE  19          2HG2      ILE  19  -0.890   5.357   1.884
  155   3HG2  ILE  19          3HG2      ILE  19  -1.377   6.641   0.778
  156   1HD1  ILE  19          1HD1      ILE  19  -3.119   5.479   0.791
  157   2HD1  ILE  19          2HD1      ILE  19  -3.990   4.292  -0.179
  158   3HD1  ILE  19          3HD1      ILE  19  -3.081   5.581  -0.969
  159    H    VAL  20           H        VAL  20   1.899   5.011  -1.672
  160    HA   VAL  20           HA       VAL  20   3.170   7.409  -0.812
  161    HB   VAL  20           HB       VAL  20   4.230   5.380  -2.797
  162   1HG1  VAL  20          1HG1      VAL  20   5.521   7.011  -0.588
  163   2HG1  VAL  20          2HG1      VAL  20   5.697   7.293  -2.320
  164   3HG1  VAL  20          3HG1      VAL  20   6.356   5.827  -1.593
  165   1HG2  VAL  20          1HG2      VAL  20   3.766   3.797  -1.250
  166   2HG2  VAL  20          2HG2      VAL  20   3.245   5.007  -0.077
  167   3HG2  VAL  20          3HG2      VAL  20   4.954   4.588  -0.212
  168    H    GLU  21           H        GLU  21   2.482   6.233  -4.127
  169    HA   GLU  21           HA       GLU  21   3.650   8.298  -5.625
  170   1HB   GLU  21          2HB       GLU  21   2.481   6.156  -6.363
  171   2HB   GLU  21          1HB       GLU  21   0.957   7.020  -6.166
  172   1HG   GLU  21          2HG       GLU  21   2.906   8.566  -7.695
  173   2HG   GLU  21          1HG       GLU  21   2.540   7.018  -8.455
  174    H    ARG  22           H        ARG  22   0.212   8.189  -4.580
  175    HA   ARG  22           HA       ARG  22  -0.656  10.695  -5.386
  176   1HB   ARG  22          2HB       ARG  22  -1.277   8.726  -3.327
  177   2HB   ARG  22          1HB       ARG  22  -1.667  10.361  -2.791
  178   1HG   ARG  22          2HG       ARG  22  -2.458   9.834  -5.569
  179   2HG   ARG  22          1HG       ARG  22  -3.273   8.793  -4.402
  180   1HD   ARG  22          2HD       ARG  22  -3.622  11.043  -3.063
  181   2HD   ARG  22          1HD       ARG  22  -3.382  11.785  -4.659
  182    HE   ARG  22           HE       ARG  22  -5.188  10.153  -5.463
  183   1HH1  ARG  22          1HH1      ARG  22  -5.407   8.846  -2.710
  184   2HH1  ARG  22          2HH1      ARG  22  -6.846   9.595  -2.101
  185   1HH2  ARG  22          1HH2      ARG  22  -6.838  12.137  -4.458
  186   2HH2  ARG  22          2HH2      ARG  22  -7.655  11.459  -3.091
  187    H    ARG  23           H        ARG  23   1.104   9.972  -2.354
  188    HA   ARG  23           HA       ARG  23   1.188  12.544  -1.226
  189   1HB   ARG  23          2HB       ARG  23   3.285  10.349  -1.329
  190   2HB   ARG  23          1HB       ARG  23   3.291  11.683  -0.173
  191   1HG   ARG  23          2HG       ARG  23   0.976   9.754  -0.486
  192   2HG   ARG  23          1HG       ARG  23   2.258   9.552   0.708
  193   1HD   ARG  23          2HD       ARG  23   1.533  12.176   1.119
  194   2HD   ARG  23          1HD       ARG  23  -0.021  11.418   0.723
  195    HE   ARG  23           HE       ARG  23   1.252   9.626   2.455
  196   1HH1  ARG  23          1HH2      ARG  23   1.553  12.898   2.950
  197   2HH1  ARG  23          2HH2      ARG  23   0.675  12.949   4.442
  198   1HH2  ARG  23          1HH1      ARG  23  -0.461   9.684   4.194
  199   2HH2  ARG  23          2HH1      ARG  23  -0.464  11.130   5.147
  200    H    ARG  24           H        ARG  24   3.928  11.143  -3.067
  201    HA   ARG  24           HA       ARG  24   5.249  13.625  -3.523
  202   1HB   ARG  24          2HB       ARG  24   5.765  10.977  -3.887
  203   2HB   ARG  24          1HB       ARG  24   5.480  11.472  -5.555
  204   1HG   ARG  24          2HG       ARG  24   7.059  13.514  -4.720
  205   2HG   ARG  24          1HG       ARG  24   7.689  12.206  -3.718
  206   1HD   ARG  24          2HD       ARG  24   7.261  11.280  -6.440
  207   2HD   ARG  24          1HD       ARG  24   8.344  12.687  -6.407
  208    HE   ARG  24           HE       ARG  24   8.835  10.540  -4.417
  209   1HH1  ARG  24          1HH1      ARG  24   9.549   9.780  -7.290
  210   2HH1  ARG  24          2HH1      ARG  24  11.219  10.235  -7.347
  211   1HH2  ARG  24          1HH2      ARG  24  11.060  12.183  -4.482
  212   2HH2  ARG  24          2HH2      ARG  24  12.073  11.597  -5.759
  213    H    ALA  25           H        ALA  25   2.976  11.795  -5.601
  214    HA   ALA  25           HA       ALA  25   2.982  13.279  -7.939
  215   1HB   ALA  25          1HB       ALA  25   1.045  11.738  -6.341
  216   2HB   ALA  25          2HB       ALA  25   1.374  11.668  -8.072
  217   3HB   ALA  25          3HB       ALA  25   0.290  12.901  -7.429
  218    H    GLU  26           H        GLU  26   1.329  14.139  -4.896
  219    HA   GLU  26           HA       GLU  26   0.477  16.727  -5.980
  220   1HB   GLU  26          2HB       GLU  26   0.054  15.058  -3.546
  221   2HB   GLU  26          1HB       GLU  26  -0.207  16.796  -3.388
  222   1HG   GLU  26          2HG       GLU  26  -1.667  16.633  -5.475
  223   2HG   GLU  26          1HG       GLU  26  -1.583  14.882  -5.284
  224    H    GLY  27           H        GLY  27   3.120  15.411  -4.146
  225   1HA   GLY  27          2HA       GLY  27   5.086  16.470  -3.400
  226   2HA   GLY  27          1HA       GLY  27   4.506  17.959  -4.147
  227    H    ALA  28           H        ALA  28   2.712  16.093  -1.743
  228    HA   ALA  28           HA       ALA  28   2.685  18.501   0.003
  229   1HB   ALA  28          1HB       ALA  28   1.054  15.985  -0.321
  230   2HB   ALA  28          2HB       ALA  28   0.522  17.664  -0.426
  231   3HB   ALA  28          3HB       ALA  28   0.904  16.956   1.144
  232    H    LYS  29           H        LYS  29   5.118  16.994  -0.091
  233    HA   LYS  29           HA       LYS  29   5.683  16.625   2.685
  234   1HB   LYS  29          2HB       LYS  29   4.090  14.633   1.766
  235   2HB   LYS  29          1HB       LYS  29   5.669  13.952   1.379
  236   1HG   LYS  29          2HG       LYS  29   4.899  13.298   3.653
  237   2HG   LYS  29          1HG       LYS  29   6.396  14.229   3.697
  238   1HD   LYS  29          2HD       LYS  29   5.354  16.124   4.554
  239   2HD   LYS  29          1HD       LYS  29   3.780  15.683   3.892
  240   1HE   LYS  29          2HE       LYS  29   4.661  13.646   5.751
  241   2HE   LYS  29          1HE       LYS  29   4.668  15.241   6.531
  242   1HZ   LYS  29          1HZ       LYS  29   2.440  13.839   5.208
  243   2HZ   LYS  29          2HZ       LYS  29   2.452  15.538   5.263
  244   3HZ   LYS  29          3HZ       LYS  29   2.460  14.638   6.704
  245    H    SER  30           H        SER  30   6.849  17.645   0.125
  246    HA   SER  30           HA       SER  30   8.946  17.693  -0.965
  247   1HB   SER  30          2HB       SER  30   9.240  17.099   1.863
  248   2HB   SER  30          1HB       SER  30  10.561  16.391   0.937
  249    HG   SER  30           HG       SER  30   9.718  19.024   0.422
  250    H    THR  31           H        THR  31  11.029  15.966  -1.163
  251    HA   THR  31           HA       THR  31   9.808  13.623  -2.484
  252    HB   THR  31           HB       THR  31  12.184  13.332  -3.256
  253    HG1  THR  31           1HG      THR  31  13.142  14.245  -1.387
  254   1HG2  THR  31          1HG2      THR  31  10.327  15.171  -4.052
  255   2HG2  THR  31          2HG2      THR  31  11.861  14.891  -4.877
  256   3HG2  THR  31          3HG2      THR  31  11.713  16.209  -3.715
  257    H    ASP  32           H        ASP  32  10.053  13.964   0.573
  258    HA   ASP  32           HA       ASP  32  11.960  11.887   1.379
  259   1HB   ASP  32          2HB       ASP  32  10.442  14.022   2.522
  260   2HB   ASP  32          1HB       ASP  32  10.027  12.541   3.387
  261    H    VAL  33           H        VAL  33   8.626  12.027   0.406
  262    HA   VAL  33           HA       VAL  33   7.621   9.714   1.776
  263    HB   VAL  33           HB       VAL  33   6.926  11.174  -0.782
  264   1HG1  VAL  33          1HG1      VAL  33   4.662   9.813  -0.179
  265   2HG1  VAL  33          2HG1      VAL  33   5.870   8.631   0.328
  266   3HG1  VAL  33          3HG1      VAL  33   5.860   9.225  -1.332
  267   1HG2  VAL  33          1HG2      VAL  33   5.349  12.301   0.511
  268   2HG2  VAL  33          2HG2      VAL  33   6.637  12.065   1.693
  269   3HG2  VAL  33          3HG2      VAL  33   5.236  10.995   1.691
  270    H    SER  34           H        SER  34   7.395   7.547   0.983
  271    HA   SER  34           HA       SER  34   8.334   6.614  -1.555
  272   1HB   SER  34          2HB       SER  34  10.573   6.305  -1.214
  273   2HB   SER  34          1HB       SER  34  10.368   7.525   0.039
  274    HG   SER  34           HG       SER  34  11.122   5.022   0.327
  275    H    PHE  35           H        PHE  35   7.993   4.347  -1.741
  276    HA   PHE  35           HA       PHE  35   6.108   3.034  -0.210
  277   1HB   PHE  35          2HB       PHE  35   7.239   2.335  -2.372
  278   2HB   PHE  35          1HB       PHE  35   8.575   1.728  -1.394
  279    HD1  PHE  35           1HD      PHE  35   8.184  -0.109   0.261
  280    HD2  PHE  35           2HD      PHE  35   5.163   1.141  -2.525
  281    HE1  PHE  35           1HE      PHE  35   6.936  -2.213   0.670
  282    HE2  PHE  35           2HE      PHE  35   3.914  -0.962  -2.116
  283    HZ   PHE  35           HZ       PHE  35   4.802  -2.639  -0.518
  284    H    SER  36           H        SER  36   9.623   2.417   0.195
  285    HA   SER  36           HA       SER  36   9.577   0.887   2.516
  286   1HB   SER  36          2HB       SER  36  11.851   1.641   2.793
  287   2HB   SER  36          1HB       SER  36  11.525   1.632   1.062
  288    HG   SER  36           HG       SER  36  11.478   3.848   2.836
  289    H    SER  37           H        SER  37   9.195   4.405   2.241
  290    HA   SER  37           HA       SER  37   9.239   4.844   5.134
  291   1HB   SER  37          2HB       SER  37   9.975   6.653   3.829
  292   2HB   SER  37          1HB       SER  37   8.699   6.431   2.633
  293    HG   SER  37           HG       SER  37   8.377   8.230   4.083
  294    H    ILE  38           H        ILE  38   6.725   4.727   2.593
  295    HA   ILE  38           HA       ILE  38   4.533   5.257   4.427
  296    HB   ILE  38           HB       ILE  38   4.758   4.130   1.619
  297   1HG1  ILE  38          2HG1      ILE  38   5.455   6.510   2.018
  298   2HG1  ILE  38          1HG1      ILE  38   4.061   6.365   0.947
  299   1HG2  ILE  38          1HG2      ILE  38   2.425   4.484   3.425
  300   2HG2  ILE  38          2HG2      ILE  38   2.644   3.373   2.074
  301   3HG2  ILE  38          3HG2      ILE  38   2.221   5.057   1.771
  302   1HD1  ILE  38          1HD1      ILE  38   3.639   8.126   2.587
  303   2HD1  ILE  38          2HD1      ILE  38   3.988   7.012   3.909
  304   3HD1  ILE  38          3HD1      ILE  38   2.562   6.764   2.900
  305    H    SER  39           H        SER  39   6.005   2.327   3.047
  306    HA   SER  39           HA       SER  39   4.032   0.503   4.155
  307   1HB   SER  39          2HB       SER  39   5.472   0.094   2.157
  308   2HB   SER  39          1HB       SER  39   6.884   0.068   3.211
  309    HG   SER  39           HG       SER  39   6.334  -2.012   3.144
  310    H    THR  40           H        THR  40   7.392   1.351   5.053
  311    HA   THR  40           HA       THR  40   7.746  -0.280   7.294
  312    HB   THR  40           HB       THR  40   8.604   2.540   6.616
  313    HG1  THR  40           1HG      THR  40  10.631   1.242   6.471
  314   1HG2  THR  40          1HG2      THR  40   9.073   0.941   9.092
  315   2HG2  THR  40          2HG2      THR  40   8.957   2.688   8.887
  316   3HG2  THR  40          3HG2      THR  40  10.435   1.844   8.429
  317    H    MET  41           H        MET  41   6.257   2.990   7.251
  318    HA   MET  41           HA       MET  41   5.610   2.935  10.083
  319   1HB   MET  41          2HB       MET  41   4.558   5.040   9.585
  320   2HB   MET  41          1HB       MET  41   5.983   4.938   8.553
  321   1HG   MET  41          2HG       MET  41   4.380   5.588   7.004
  322   2HG   MET  41          1HG       MET  41   4.288   3.836   6.853
  323   1HE   MET  41          1HE       MET  41   1.004   5.638   6.282
  324   2HE   MET  41          2HE       MET  41   1.121   3.885   6.156
  325   3HE   MET  41          3HE       MET  41   2.467   4.888   5.623
  326    H    LEU  42           H        LEU  42   3.888   2.057   7.113
  327    HA   LEU  42           HA       LEU  42   1.269   1.837   8.217
  328   1HB   LEU  42          2HB       LEU  42   1.966   1.980   5.813
  329   2HB   LEU  42          1HB       LEU  42   2.591   0.334   5.941
  330    HG   LEU  42           HG       LEU  42  -0.125   0.666   6.955
  331   1HD1  LEU  42          1HD1      LEU  42   0.588   1.745   4.347
  332   2HD1  LEU  42          2HD1      LEU  42  -0.952   1.833   5.203
  333   3HD1  LEU  42          3HD1      LEU  42  -0.577   0.429   4.203
  334   1HD2  LEU  42          1HD2      LEU  42   1.550  -1.373   6.062
  335   2HD2  LEU  42          2HD2      LEU  42   0.347  -1.224   4.781
  336   3HD2  LEU  42          3HD2      LEU  42  -0.164  -1.537   6.438
  337    H    LEU  43           H        LEU  43   3.767  -0.665   7.565
  338    HA   LEU  43           HA       LEU  43   2.239  -2.789   8.787
  339   1HB   LEU  43          2HB       LEU  43   4.162  -2.853   7.068
  340   2HB   LEU  43          1HB       LEU  43   5.237  -2.696   8.460
  341    HG   LEU  43           HG       LEU  43   3.323  -4.652   9.160
  342   1HD1  LEU  43          1HD1      LEU  43   4.517  -5.127   6.407
  343   2HD1  LEU  43          2HD1      LEU  43   2.807  -4.854   6.749
  344   3HD1  LEU  43          3HD1      LEU  43   3.607  -6.307   7.350
  345   1HD2  LEU  43          1HD2      LEU  43   5.397  -6.153   8.941
  346   2HD2  LEU  43          2HD2      LEU  43   5.561  -4.743   9.987
  347   3HD2  LEU  43          3HD2      LEU  43   6.244  -4.719   8.361
  348    H    GLU  44           H        GLU  44   3.879  -0.166  10.167
  349    HA   GLU  44           HA       GLU  44   4.883  -1.526  12.557
  350   1HB   GLU  44          2HB       GLU  44   4.666   1.200  11.406
  351   2HB   GLU  44          1HB       GLU  44   4.607   1.142  13.167
  352   1HG   GLU  44          2HG       GLU  44   6.663  -0.620  12.528
  353   2HG   GLU  44          1HG       GLU  44   6.872   0.701  11.377
  354    H    LEU  45           H        LEU  45   2.014   0.125  11.456
  355    HA   LEU  45           HA       LEU  45   0.668  -0.236  14.085
  356   1HB   LEU  45          2HB       LEU  45  -0.754   1.497  13.317
  357   2HB   LEU  45          1HB       LEU  45   0.831   1.942  12.692
  358    HG   LEU  45           HG       LEU  45  -0.221   0.276  10.725
  359   1HD1  LEU  45          1HD1      LEU  45  -2.350   2.310  11.292
  360   2HD1  LEU  45          2HD1      LEU  45  -2.413   0.756  12.121
  361   3HD1  LEU  45          3HD1      LEU  45  -2.454   0.818  10.360
  362   1HD2  LEU  45          1HD2      LEU  45   1.107   2.432  10.551
  363   2HD2  LEU  45          2HD2      LEU  45  -0.409   3.299  10.803
  364   3HD2  LEU  45          3HD2      LEU  45  -0.204   2.277   9.381
  365    H    GLY  46           H        GLY  46   1.073  -1.883  11.174
  366   1HA   GLY  46          2HA       GLY  46  -0.011  -3.846  10.431
  367   2HA   GLY  46          1HA       GLY  46  -1.168  -3.664  11.750
  368    H    LEU  47           H        LEU  47  -0.528  -1.046   9.493
  369    HA   LEU  47           HA       LEU  47  -2.002   0.070   8.022
  370   1HB   LEU  47          2HB       LEU  47  -1.521  -2.511   7.240
  371   2HB   LEU  47          1HB       LEU  47  -3.282  -2.478   7.264
  372    HG   LEU  47           HG       LEU  47  -1.783  -0.221   5.969
  373   1HD1  LEU  47          1HD1      LEU  47  -1.387  -1.380   4.006
  374   2HD1  LEU  47          2HD1      LEU  47  -2.665  -2.552   4.315
  375   3HD1  LEU  47          3HD1      LEU  47  -1.127  -2.678   5.169
  376   1HD2  LEU  47          1HD2      LEU  47  -4.007   0.321   5.875
  377   2HD2  LEU  47          2HD2      LEU  47  -4.525  -1.357   6.039
  378   3HD2  LEU  47          3HD2      LEU  47  -3.985  -0.750   4.472
  379    H    ARG  48           H        ARG  48  -3.115  -1.022  10.836
  380    HA   ARG  48           HA       ARG  48  -5.969  -1.309  10.336
  381   1HB   ARG  48          2HB       ARG  48  -4.186  -1.846  12.378
  382   2HB   ARG  48          1HB       ARG  48  -5.092  -0.474  13.014
  383   1HG   ARG  48          2HG       ARG  48  -7.164  -1.859  12.075
  384   2HG   ARG  48          1HG       ARG  48  -6.055  -3.212  12.299
  385   1HD   ARG  48          2HD       ARG  48  -6.190  -3.090  14.576
  386   2HD   ARG  48          1HD       ARG  48  -6.147  -1.315  14.572
  387    HE   ARG  48           HE       ARG  48  -8.611  -2.058  13.416
  388   1HH1  ARG  48          1HH2      ARG  48  -8.152  -4.152  15.673
  389   2HH1  ARG  48          2HH2      ARG  48  -9.050  -3.412  16.955
  390   1HH2  ARG  48          1HH1      ARG  48  -9.256  -0.325  15.391
  391   2HH2  ARG  48          2HH1      ARG  48  -9.674  -1.247  16.797
  392    H    VAL  49           H        VAL  49  -4.412   1.148  12.397
  393    HA   VAL  49           HA       VAL  49  -6.453   3.054  12.363
  394    HB   VAL  49           HB       VAL  49  -3.465   3.575  12.300
  395   1HG1  VAL  49          1HG1      VAL  49  -4.878   5.117  14.230
  396   2HG1  VAL  49          2HG1      VAL  49  -5.770   5.235  12.712
  397   3HG1  VAL  49          3HG1      VAL  49  -4.067   5.690  12.772
  398   1HG2  VAL  49          1HG2      VAL  49  -5.210   2.183  14.243
  399   2HG2  VAL  49          2HG2      VAL  49  -4.162   3.417  14.939
  400   3HG2  VAL  49          3HG2      VAL  49  -3.462   2.081  14.026
  401    H    TYR  50           H        TYR  50  -3.942   2.494   9.923
  402    HA   TYR  50           HA       TYR  50  -4.029   4.771   8.349
  403   1HB   TYR  50          2HB       TYR  50  -2.629   2.937   7.756
  404   2HB   TYR  50          1HB       TYR  50  -3.995   1.823   7.676
  405    HD1  TYR  50           1HD      TYR  50  -2.322   4.674   5.999
  406    HD2  TYR  50           2HD      TYR  50  -5.389   1.679   5.721
  407    HE1  TYR  50           1HE      TYR  50  -2.598   5.180   3.586
  408    HE2  TYR  50           2HE      TYR  50  -5.664   2.185   3.310
  409    HH   TYR  50           HH       TYR  50  -4.030   3.221   1.453
  410    H    GLU  51           H        GLU  51  -6.348   2.032   8.118
  411    HA   GLU  51           HA       GLU  51  -8.031   3.209   6.151
  412   1HB   GLU  51          2HB       GLU  51  -7.728   0.825   7.425
  413   2HB   GLU  51          1HB       GLU  51  -9.180   1.428   8.218
  414   1HG   GLU  51          2HG       GLU  51  -9.321   1.921   5.376
  415   2HG   GLU  51          1HG       GLU  51  -9.007   0.214   5.682
  416    H    ALA  52           H        ALA  52  -7.559   4.030   9.442
  417    HA   ALA  52           HA       ALA  52 -10.266   4.968  10.015
  418   1HB   ALA  52          1HB       ALA  52  -7.980   6.080  11.513
  419   2HB   ALA  52          2HB       ALA  52  -8.002   4.318  11.436
  420   3HB   ALA  52          3HB       ALA  52  -9.382   5.188  12.105
  421    H    GLN  53           H        GLN  53  -7.151   6.685   9.507
  422    HA   GLN  53           HA       GLN  53  -8.531   9.226   9.109
  423   1HB   GLN  53          2HB       GLN  53  -6.188  10.028   8.834
  424   2HB   GLN  53          1HB       GLN  53  -6.391   9.055  10.291
  425   1HG   GLN  53          2HG       GLN  53  -5.062   7.381   9.511
  426   2HG   GLN  53          1HG       GLN  53  -5.704   7.508   7.874
  427   1HE2  GLN  53          1HE2      GLN  53  -3.109   8.512   9.986
  428   2HE2  GLN  53          2HE2      GLN  53  -2.270   9.443   8.842
  429    H    MET  54           H        MET  54  -8.628   6.759   7.132
  430    HA   MET  54           HA       MET  54  -7.369   7.391   4.693
  431   1HB   MET  54          2HB       MET  54  -9.295   5.611   5.710
  432   2HB   MET  54          1HB       MET  54 -10.085   6.415   4.354
  433   1HG   MET  54          2HG       MET  54  -7.490   5.885   3.444
  434   2HG   MET  54          1HG       MET  54  -7.962   4.430   4.323
  435   1HE   MET  54          1HE       MET  54 -10.275   6.432   0.901
  436   2HE   MET  54          2HE       MET  54  -8.967   7.112   1.866
  437   3HE   MET  54          3HE       MET  54 -10.563   6.899   2.583
  438    H    GLU  55           H        GLU  55 -10.231   8.825   6.183
  439    HA   GLU  55           HA       GLU  55 -11.052  10.273   3.776
  440   1HB   GLU  55          2HB       GLU  55 -12.247   9.473   6.085
  441   2HB   GLU  55          1HB       GLU  55 -11.904  11.158   6.479
  442   1HG   GLU  55          2HG       GLU  55 -13.430  11.946   4.990
  443   2HG   GLU  55          1HG       GLU  55 -12.999  10.746   3.772
  444    H    ARG  56           H        ARG  56 -11.524  12.839   4.703
  445    HA   ARG  56           HA       ARG  56  -9.131  14.009   5.913
  446   1HB   ARG  56          2HB       ARG  56  -9.363  13.542   3.043
  447   2HB   ARG  56          1HB       ARG  56  -9.123  15.252   3.406
  448   1HG   ARG  56          2HG       ARG  56  -7.428  13.350   4.929
  449   2HG   ARG  56          1HG       ARG  56  -7.076  13.494   3.207
  450   1HD   ARG  56          2HD       ARG  56  -7.526  16.092   4.524
  451   2HD   ARG  56          1HD       ARG  56  -6.107  15.213   5.129
  452    HE   ARG  56           HE       ARG  56  -6.116  14.969   2.302
  453   1HH1  ARG  56          1HH1      ARG  56  -4.169  16.286   4.464
  454   2HH1  ARG  56          2HH1      ARG  56  -3.870  17.791   3.660
  455   1HH2  ARG  56          1HH2      ARG  56  -6.440  17.383   1.370
  456   2HH2  ARG  56          2HH2      ARG  56  -5.154  18.410   1.906
  Start of MODEL    4
    1   1H    ALA   2          1H        ALA   2  -3.385 -22.293  -8.424
    2   2H    ALA   2          2H        ALA   2  -4.299 -21.472  -7.251
    3   3H    ALA   2          3H        ALA   2  -2.650 -21.114  -7.451
    4    HA   ALA   2           HA       ALA   2  -3.712 -19.352  -8.538
    5   1HB   ALA   2          1HB       ALA   2  -1.923 -20.309  -9.835
    6   2HB   ALA   2          2HB       ALA   2  -3.239 -19.983 -10.964
    7   3HB   ALA   2          3HB       ALA   2  -2.955 -21.627 -10.392
    8    H    LYS   3           H        LYS   3  -4.936 -22.202 -10.326
    9    HA   LYS   3           HA       LYS   3  -7.104 -22.665 -11.150
   10   1HB   LYS   3          2HB       LYS   3  -7.306 -22.486  -8.561
   11   2HB   LYS   3          1HB       LYS   3  -8.062 -20.923  -8.877
   12   1HG   LYS   3          2HG       LYS   3  -9.960 -21.864  -9.721
   13   2HG   LYS   3          1HG       LYS   3  -9.077 -23.165 -10.521
   14   1HD   LYS   3          2HD       LYS   3 -10.078 -24.407  -8.863
   15   2HD   LYS   3          1HD       LYS   3  -8.644 -23.893  -7.975
   16   1HE   LYS   3          2HE       LYS   3 -11.039 -22.086  -7.950
   17   2HE   LYS   3          1HE       LYS   3 -11.049 -23.530  -6.918
   18   1HZ   LYS   3          1HZ       LYS   3  -9.267 -22.817  -5.723
   19   2HZ   LYS   3          2HZ       LYS   3  -9.903 -21.297  -6.141
   20   3HZ   LYS   3          3HZ       LYS   3  -8.596 -21.945  -7.013
   21    H    VAL   4           H        VAL   4  -6.373 -21.064 -12.929
   22    HA   VAL   4           HA       VAL   4  -6.991 -19.322 -14.404
   23    HB   VAL   4           HB       VAL   4  -9.412 -19.141 -12.590
   24   1HG1  VAL   4          1HG1      VAL   4  -9.364 -17.418 -14.281
   25   2HG1  VAL   4          2HG1      VAL   4 -10.522 -18.642 -14.802
   26   3HG1  VAL   4          3HG1      VAL   4  -8.915 -18.582 -15.526
   27   1HG2  VAL   4          1HG2      VAL   4  -8.427 -21.343 -14.251
   28   2HG2  VAL   4          2HG2      VAL   4 -10.050 -20.822 -14.706
   29   3HG2  VAL   4          3HG2      VAL   4  -9.720 -21.336 -13.051
   30    H    GLN   5           H        GLN   5  -5.910 -18.856 -11.416
   31    HA   GLN   5           HA       GLN   5  -5.230 -16.964 -10.174
   32   1HB   GLN   5          2HB       GLN   5  -5.742 -15.582 -12.826
   33   2HB   GLN   5          1HB       GLN   5  -4.597 -15.095 -11.577
   34   1HG   GLN   5          2HG       GLN   5  -3.309 -17.159 -11.923
   35   2HG   GLN   5          1HG       GLN   5  -4.468 -17.689 -13.143
   36   1HE2  GLN   5          1HE2      GLN   5  -4.736 -16.094 -15.059
   37   2HE2  GLN   5          2HE2      GLN   5  -3.343 -15.278 -15.586
   38    H    ALA   6           H        ALA   6  -6.055 -14.824  -9.340
   39    HA   ALA   6           HA       ALA   6  -8.579 -13.708 -10.042
   40   1HB   ALA   6          1HB       ALA   6  -9.887 -15.452  -9.396
   41   2HB   ALA   6          2HB       ALA   6  -9.521 -14.938  -7.750
   42   3HB   ALA   6          3HB       ALA   6  -8.569 -16.214  -8.508
   43    H    TYR   7           H        TYR   7  -6.164 -12.622  -9.166
   44    HA   TYR   7           HA       TYR   7  -5.227 -11.177  -7.538
   45   1HB   TYR   7          2HB       TYR   7  -8.230 -10.885  -7.277
   46   2HB   TYR   7          1HB       TYR   7  -7.100  -9.821  -6.440
   47    HD1  TYR   7           1HD      TYR   7  -8.994 -10.192  -9.364
   48    HD2  TYR   7           2HD      TYR   7  -5.122  -8.905  -8.022
   49    HE1  TYR   7           1HE      TYR   7  -8.724  -8.846 -11.429
   50    HE2  TYR   7           2HE      TYR   7  -4.852  -7.560 -10.086
   51    HH   TYR   7           HH       TYR   7  -7.382  -6.789 -12.121
   52    H    VAL   8           H        VAL   8  -4.523 -13.276  -6.387
   53    HA   VAL   8           HA       VAL   8  -5.814 -13.390  -3.681
   54    HB   VAL   8           HB       VAL   8  -5.339 -15.841  -3.775
   55   1HG1  VAL   8          1HG1      VAL   8  -6.856 -15.900  -6.146
   56   2HG1  VAL   8          2HG1      VAL   8  -7.248 -14.361  -5.377
   57   3HG1  VAL   8          3HG1      VAL   8  -7.475 -15.871  -4.494
   58   1HG2  VAL   8          1HG2      VAL   8  -3.441 -15.700  -5.368
   59   2HG2  VAL   8          2HG2      VAL   8  -4.562 -15.224  -6.644
   60   3HG2  VAL   8          3HG2      VAL   8  -4.671 -16.832  -5.928
   61    H    SER   9           H        SER   9  -3.760 -11.687  -3.837
   62    HA   SER   9           HA       SER   9  -1.570 -13.096  -2.422
   63   1HB   SER   9          2HB       SER   9  -0.155 -11.522  -4.174
   64   2HB   SER   9          1HB       SER   9  -0.455 -13.241  -4.404
   65    HG   SER   9           HG       SER   9  -1.114 -12.037  -6.219
   66    H    ASP  10           H        ASP  10   0.211 -11.152  -2.031
   67    HA   ASP  10           HA       ASP  10  -1.003  -9.303  -0.246
   68   1HB   ASP  10          2HB       ASP  10   1.622  -9.918  -1.402
   69   2HB   ASP  10          1HB       ASP  10   1.432  -8.210  -1.005
   70    H    GLU  11           H        GLU  11  -2.757  -8.484  -1.762
   71    HA   GLU  11           HA       GLU  11  -2.092  -6.825  -4.035
   72   1HB   GLU  11          2HB       GLU  11  -4.440  -7.576  -2.381
   73   2HB   GLU  11          1HB       GLU  11  -4.576  -6.044  -3.245
   74   1HG   GLU  11          2HG       GLU  11  -3.895  -7.230  -5.347
   75   2HG   GLU  11          1HG       GLU  11  -3.944  -8.751  -4.455
   76    H    ILE  12           H        ILE  12  -1.813  -6.310  -0.672
   77    HA   ILE  12           HA       ILE  12  -2.500  -3.551  -0.415
   78    HB   ILE  12           HB       ILE  12  -0.534  -5.403   0.948
   79   1HG1  ILE  12          2HG1      ILE  12  -3.280  -4.293   1.583
   80   2HG1  ILE  12          1HG1      ILE  12  -2.815  -5.983   1.386
   81   1HG2  ILE  12          1HG2      ILE  12  -1.262  -2.546   1.663
   82   2HG2  ILE  12          2HG2      ILE  12   0.337  -3.140   1.215
   83   3HG2  ILE  12          3HG2      ILE  12  -0.403  -3.652   2.732
   84   1HD1  ILE  12          1HD1      ILE  12  -2.973  -5.654   3.738
   85   2HD1  ILE  12          2HD1      ILE  12  -2.117  -4.114   3.656
   86   3HD1  ILE  12          3HD1      ILE  12  -1.248  -5.625   3.385
   87    H    VAL  13           H        VAL  13   0.308  -5.133  -1.815
   88    HA   VAL  13           HA       VAL  13   2.314  -3.219  -1.735
   89    HB   VAL  13           HB       VAL  13   1.300  -4.969  -3.991
   90   1HG1  VAL  13          1HG1      VAL  13   3.800  -3.276  -3.793
   91   2HG1  VAL  13          2HG1      VAL  13   2.591  -3.272  -5.077
   92   3HG1  VAL  13          3HG1      VAL  13   3.672  -4.654  -4.886
   93   1HG2  VAL  13          1HG2      VAL  13   2.258  -6.573  -2.724
   94   2HG2  VAL  13          2HG2      VAL  13   2.850  -5.372  -1.576
   95   3HG2  VAL  13          3HG2      VAL  13   3.813  -5.786  -2.995
   96    H    TYR  14           H        TYR  14  -0.357  -3.302  -4.129
   97    HA   TYR  14           HA       TYR  14   0.337  -0.781  -5.353
   98   1HB   TYR  14          2HB       TYR  14  -1.200  -2.882  -6.003
   99   2HB   TYR  14          1HB       TYR  14  -2.456  -1.840  -5.338
  100    HD1  TYR  14           1HD      TYR  14  -3.344  -0.071  -6.615
  101    HD2  TYR  14           2HD      TYR  14   0.377  -1.872  -7.776
  102    HE1  TYR  14           1HE      TYR  14  -3.362   1.250  -8.714
  103    HE2  TYR  14           2HE      TYR  14   0.361  -0.552  -9.876
  104    HH   TYR  14           HH       TYR  14  -2.208   0.824 -11.161
  105    H    LYS  15           H        LYS  15  -1.525  -1.672  -2.526
  106    HA   LYS  15           HA       LYS  15  -3.083   0.746  -2.290
  107   1HB   LYS  15          2HB       LYS  15  -3.466  -1.498  -1.192
  108   2HB   LYS  15          1HB       LYS  15  -2.103  -1.144  -0.130
  109   1HG   LYS  15          2HG       LYS  15  -3.226   0.585   0.961
  110   2HG   LYS  15          1HG       LYS  15  -4.323   0.861  -0.393
  111   1HD   LYS  15          2HD       LYS  15  -4.418  -1.792   0.988
  112   2HD   LYS  15          1HD       LYS  15  -5.155  -0.403   1.789
  113   1HE   LYS  15          2HE       LYS  15  -6.817  -0.196   0.197
  114   2HE   LYS  15          1HE       LYS  15  -5.783  -0.811  -1.109
  115   1HZ   LYS  15          1HZ       LYS  15  -7.611  -2.333  -0.057
  116   2HZ   LYS  15          2HZ       LYS  15  -6.432  -2.580   1.141
  117   3HZ   LYS  15          3HZ       LYS  15  -6.099  -2.973  -0.478
  118    H    ILE  16           H        ILE  16  -0.131  -0.320  -0.539
  119    HA   ILE  16           HA       ILE  16   0.290   2.303   0.649
  120    HB   ILE  16           HB       ILE  16   2.174  -0.054   0.322
  121   1HG1  ILE  16          2HG1      ILE  16   0.185   0.543   2.538
  122   2HG1  ILE  16          1HG1      ILE  16  -0.030  -0.696   1.302
  123   1HG2  ILE  16          1HG2      ILE  16   2.172   1.650   2.747
  124   2HG2  ILE  16          2HG2      ILE  16   2.740   2.434   1.273
  125   3HG2  ILE  16          3HG2      ILE  16   3.530   0.966   1.852
  126   1HD1  ILE  16          1HD1      ILE  16   2.522  -0.724   2.850
  127   2HD1  ILE  16          2HD1      ILE  16   1.592  -2.072   2.195
  128   3HD1  ILE  16          3HD1      ILE  16   1.060  -1.270   3.673
  129    H    ASN  17           H        ASN  17   1.301   0.719  -2.312
  130    HA   ASN  17           HA       ASN  17   3.605   2.322  -2.911
  131   1HB   ASN  17          2HB       ASN  17   3.239   0.303  -4.113
  132   2HB   ASN  17          1HB       ASN  17   1.578   0.747  -4.508
  133   1HD2  ASN  17          1HD2      ASN  17   1.592   0.985  -6.762
  134   2HD2  ASN  17          2HD2      ASN  17   2.690   1.957  -7.616
  135    H    LYS  18           H        LYS  18   0.133   2.764  -3.561
  136    HA   LYS  18           HA       LYS  18   0.405   5.099  -5.225
  137   1HB   LYS  18          2HB       LYS  18  -1.819   4.057  -3.439
  138   2HB   LYS  18          1HB       LYS  18  -2.025   5.338  -4.633
  139   1HG   LYS  18          2HG       LYS  18  -1.721   3.890  -6.437
  140   2HG   LYS  18          1HG       LYS  18  -0.821   2.719  -5.475
  141   1HD   LYS  18          2HD       LYS  18  -2.965   1.734  -5.832
  142   2HD   LYS  18          1HD       LYS  18  -2.993   2.337  -4.174
  143   1HE   LYS  18          2HE       LYS  18  -3.888   4.546  -5.477
  144   2HE   LYS  18          1HE       LYS  18  -4.522   3.274  -6.539
  145   1HZ   LYS  18          1HZ       LYS  18  -5.003   2.190  -4.175
  146   2HZ   LYS  18          2HZ       LYS  18  -6.127   3.193  -4.962
  147   3HZ   LYS  18          3HZ       LYS  18  -5.128   3.823  -3.740
  148    H    ILE  19           H        ILE  19   0.047   4.632  -1.719
  149    HA   ILE  19           HA       ILE  19  -0.439   7.279  -0.886
  150    HB   ILE  19           HB       ILE  19   1.288   5.103   0.340
  151   1HG1  ILE  19          2HG1      ILE  19  -1.665   5.767   0.518
  152   2HG1  ILE  19          1HG1      ILE  19  -0.940   4.279  -0.091
  153   1HG2  ILE  19          1HG2      ILE  19   1.367   7.589   1.220
  154   2HG2  ILE  19          2HG2      ILE  19   1.212   6.256   2.365
  155   3HG2  ILE  19          3HG2      ILE  19  -0.211   7.188   1.897
  156   1HD1  ILE  19          1HD1      ILE  19  -1.071   3.433   1.989
  157   2HD1  ILE  19          2HD1      ILE  19  -1.611   4.984   2.631
  158   3HD1  ILE  19          3HD1      ILE  19   0.112   4.636   2.501
  159    H    VAL  20           H        VAL  20   2.705   5.697  -1.548
  160    HA   VAL  20           HA       VAL  20   4.315   7.997  -0.885
  161    HB   VAL  20           HB       VAL  20   4.987   5.772  -2.824
  162   1HG1  VAL  20          1HG1      VAL  20   6.908   6.578  -0.765
  163   2HG1  VAL  20          2HG1      VAL  20   6.457   7.899  -1.842
  164   3HG1  VAL  20          3HG1      VAL  20   7.130   6.411  -2.508
  165   1HG2  VAL  20          1HG2      VAL  20   4.351   4.350  -1.168
  166   2HG2  VAL  20          2HG2      VAL  20   4.279   5.641   0.032
  167   3HG2  VAL  20          3HG2      VAL  20   5.825   4.890  -0.364
  168    H    GLU  21           H        GLU  21   3.241   6.661  -4.035
  169    HA   GLU  21           HA       GLU  21   4.394   8.691  -5.671
  170   1HB   GLU  21          2HB       GLU  21   2.336   6.561  -5.845
  171   2HB   GLU  21          1HB       GLU  21   2.227   7.828  -7.067
  172   1HG   GLU  21          2HG       GLU  21   4.553   7.459  -7.711
  173   2HG   GLU  21          1HG       GLU  21   4.745   6.263  -6.429
  174    H    ARG  22           H        ARG  22   1.390   8.572  -3.836
  175    HA   ARG  22           HA       ARG  22  -0.220  10.516  -4.971
  176   1HB   ARG  22          2HB       ARG  22  -0.196   9.123  -2.684
  177   2HB   ARG  22          1HB       ARG  22   0.329  10.679  -2.037
  178   1HG   ARG  22          2HG       ARG  22  -1.653  11.757  -2.661
  179   2HG   ARG  22          1HG       ARG  22  -2.043  10.542  -3.879
  180   1HD   ARG  22          2HD       ARG  22  -1.843   9.495  -1.114
  181   2HD   ARG  22          1HD       ARG  22  -3.202  10.601  -1.409
  182    HE   ARG  22           HE       ARG  22  -2.890   7.954  -2.586
  183   1HH1  ARG  22          1HH2      ARG  22  -5.133  10.264  -2.023
  184   2HH1  ARG  22          2HH2      ARG  22  -5.914  10.192  -3.568
  185   1HH2  ARG  22          1HH1      ARG  22  -3.450   8.231  -5.020
  186   2HH2  ARG  22          2HH1      ARG  22  -4.961   9.039  -5.265
  187    H    ARG  23           H        ARG  23   2.373  11.240  -2.588
  188    HA   ARG  23           HA       ARG  23   2.299  14.000  -2.529
  189   1HB   ARG  23          2HB       ARG  23   4.224  11.873  -2.142
  190   2HB   ARG  23          1HB       ARG  23   5.017  13.295  -2.820
  191   1HG   ARG  23          2HG       ARG  23   5.084  13.614  -0.462
  192   2HG   ARG  23          1HG       ARG  23   3.776  14.651  -1.032
  193   1HD   ARG  23          2HD       ARG  23   2.212  12.647  -0.552
  194   2HD   ARG  23          1HD       ARG  23   3.567  11.994   0.393
  195    HE   ARG  23           HE       ARG  23   3.179  14.754   1.069
  196   1HH1  ARG  23          1HH1      ARG  23   3.426  12.188   2.824
  197   2HH1  ARG  23          2HH1      ARG  23   1.944  12.293   3.714
  198   1HH2  ARG  23          1HH2      ARG  23   0.539  14.661   1.608
  199   2HH2  ARG  23          2HH2      ARG  23   0.310  13.693   3.026
  200    H    ARG  24           H        ARG  24   3.873  12.018  -5.067
  201    HA   ARG  24           HA       ARG  24   4.739  14.288  -6.633
  202   1HB   ARG  24          2HB       ARG  24   5.830  12.144  -6.837
  203   2HB   ARG  24          1HB       ARG  24   4.300  11.344  -7.205
  204   1HG   ARG  24          2HG       ARG  24   4.144  12.844  -9.253
  205   2HG   ARG  24          1HG       ARG  24   5.813  13.315  -8.932
  206   1HD   ARG  24          2HD       ARG  24   4.843  10.471  -9.408
  207   2HD   ARG  24          1HD       ARG  24   5.781  11.457 -10.547
  208    HE   ARG  24           HE       ARG  24   6.797  10.572  -7.873
  209   1HH1  ARG  24          1HH2      ARG  24   7.807   9.302 -10.405
  210   2HH1  ARG  24          2HH2      ARG  24   9.263  10.195 -10.696
  211   1HH2  ARG  24          1HH1      ARG  24   8.423  12.776  -8.537
  212   2HH2  ARG  24          2HH1      ARG  24   9.611  12.163  -9.639
  213    H    ALA  25           H        ALA  25   2.129  11.899  -7.253
  214    HA   ALA  25           HA       ALA  25   0.910  13.118  -9.446
  215   1HB   ALA  25          1HB       ALA  25   0.202  11.315  -7.258
  216   2HB   ALA  25          2HB       ALA  25  -0.298  11.259  -8.950
  217   3HB   ALA  25          3HB       ALA  25  -1.184  12.261  -7.800
  218    H    GLU  26           H        GLU  26   1.025  14.194  -6.128
  219    HA   GLU  26           HA       GLU  26  -1.076  16.214  -6.516
  220   1HB   GLU  26          2HB       GLU  26   0.137  14.758  -4.374
  221   2HB   GLU  26          1HB       GLU  26   0.359  16.479  -4.061
  222   1HG   GLU  26          2HG       GLU  26  -2.287  16.177  -5.023
  223   2HG   GLU  26          1HG       GLU  26  -2.041  14.906  -3.824
  224    H    GLY  27           H        GLY  27   2.359  15.933  -6.805
  225   1HA   GLY  27          2HA       GLY  27   3.132  18.123  -8.061
  226   2HA   GLY  27          1HA       GLY  27   2.722  18.874  -6.516
  227    H    ALA  28           H        ALA  28   4.450  15.909  -7.515
  228    HA   ALA  28           HA       ALA  28   6.160  15.426  -5.459
  229   1HB   ALA  28          1HB       ALA  28   7.864  15.285  -7.630
  230   2HB   ALA  28          2HB       ALA  28   6.272  15.270  -8.391
  231   3HB   ALA  28          3HB       ALA  28   6.686  14.049  -7.187
  232    H    LYS  29           H        LYS  29   8.046  16.287  -4.568
  233    HA   LYS  29           HA       LYS  29   9.640  18.390  -5.686
  234   1HB   LYS  29          2HB       LYS  29   7.275  19.418  -5.209
  235   2HB   LYS  29          1HB       LYS  29   7.772  19.359  -3.520
  236   1HG   LYS  29          2HG       LYS  29   9.990  20.462  -4.654
  237   2HG   LYS  29          1HG       LYS  29   8.727  21.111  -5.703
  238   1HD   LYS  29          2HD       LYS  29   7.823  21.259  -2.985
  239   2HD   LYS  29          1HD       LYS  29   9.432  21.977  -3.083
  240   1HE   LYS  29          2HE       LYS  29   8.635  23.344  -5.046
  241   2HE   LYS  29          1HE       LYS  29   6.999  22.727  -4.739
  242   1HZ   LYS  29          1HZ       LYS  29   8.371  23.637  -2.372
  243   2HZ   LYS  29          2HZ       LYS  29   6.789  23.963  -2.902
  244   3HZ   LYS  29          3HZ       LYS  29   8.093  24.872  -3.501
  245    H    SER  30           H        SER  30   8.230  17.914  -2.440
  246    HA   SER  30           HA       SER  30  10.974  17.258  -1.434
  247   1HB   SER  30          2HB       SER  30   8.918  18.124   0.490
  248   2HB   SER  30          1HB       SER  30  10.565  18.713   0.279
  249    HG   SER  30           HG       SER  30   9.308  20.369  -0.373
  250    H    THR  31           H        THR  31   9.073  15.406  -2.604
  251    HA   THR  31           HA       THR  31   8.136  13.828  -0.244
  252    HB   THR  31           HB       THR  31   6.490  14.389  -1.978
  253    HG1  THR  31           1HG      THR  31   6.361  11.985  -2.772
  254   1HG2  THR  31          1HG2      THR  31   7.226  12.901  -4.204
  255   2HG2  THR  31          2HG2      THR  31   8.733  13.676  -3.710
  256   3HG2  THR  31          3HG2      THR  31   7.311  14.657  -4.063
  257    H    ASP  32           H        ASP  32  10.944  13.917  -0.876
  258    HA   ASP  32           HA       ASP  32  11.979  11.902  -2.523
  259   1HB   ASP  32          2HB       ASP  32  13.448  13.391  -1.430
  260   2HB   ASP  32          1HB       ASP  32  12.736  13.071   0.150
  261    H    VAL  33           H        VAL  33  10.077  11.576   0.362
  262    HA   VAL  33           HA       VAL  33  10.783   9.140   1.488
  263    HB   VAL  33           HB       VAL  33   8.113  10.387   0.794
  264   1HG1  VAL  33          1HG1      VAL  33   7.714   8.002   1.058
  265   2HG1  VAL  33          2HG1      VAL  33   7.154   8.839   2.508
  266   3HG1  VAL  33          3HG1      VAL  33   8.688   7.969   2.529
  267   1HG2  VAL  33          1HG2      VAL  33   9.916  11.327   2.478
  268   2HG2  VAL  33          2HG2      VAL  33   9.285  10.067   3.540
  269   3HG2  VAL  33          3HG2      VAL  33   8.211  11.322   2.926
  270    H    SER  34           H        SER  34   9.493   6.967   1.090
  271    HA   SER  34           HA       SER  34   8.816   6.465  -1.739
  272   1HB   SER  34          2HB       SER  34  10.639   4.820  -1.994
  273   2HB   SER  34          1HB       SER  34  11.287   6.418  -1.639
  274    HG   SER  34           HG       SER  34  11.798   5.780   0.360
  275    H    PHE  35           H        PHE  35   8.662   3.840  -1.897
  276    HA   PHE  35           HA       PHE  35   6.508   3.030  -0.223
  277   1HB   PHE  35          2HB       PHE  35   7.255   2.171  -2.504
  278   2HB   PHE  35          1HB       PHE  35   8.497   1.250  -1.655
  279    HD1  PHE  35           1HD      PHE  35   7.645  -0.205   0.377
  280    HD2  PHE  35           2HD      PHE  35   5.154   1.202  -2.826
  281    HE1  PHE  35           1HE      PHE  35   5.986  -1.974   0.892
  282    HE2  PHE  35           2HE      PHE  35   3.494  -0.568  -2.313
  283    HZ   PHE  35           HZ       PHE  35   3.911  -2.155  -0.453
  284    H    SER  36           H        SER  36   9.830   1.666  -0.225
  285    HA   SER  36           HA       SER  36   9.776   0.102   2.044
  286   1HB   SER  36          2HB       SER  36  11.797   1.905   0.766
  287   2HB   SER  36          1HB       SER  36  12.211   1.164   2.310
  288    HG   SER  36           HG       SER  36  12.642  -0.538   1.166
  289    H    SER  37           H        SER  37  10.128   3.646   1.958
  290    HA   SER  37           HA       SER  37  10.304   3.875   4.871
  291   1HB   SER  37          2HB       SER  37  10.529   5.524   2.466
  292   2HB   SER  37          1HB       SER  37   9.690   6.361   3.770
  293    HG   SER  37           HG       SER  37  11.573   6.601   4.650
  294    H    ILE  38           H        ILE  38   7.806   4.411   2.376
  295    HA   ILE  38           HA       ILE  38   5.823   5.402   4.262
  296    HB   ILE  38           HB       ILE  38   5.778   4.359   1.421
  297   1HG1  ILE  38          2HG1      ILE  38   6.973   6.496   1.877
  298   2HG1  ILE  38          1HG1      ILE  38   5.543   6.737   0.871
  299   1HG2  ILE  38          1HG2      ILE  38   3.536   4.249   1.569
  300   2HG2  ILE  38          2HG2      ILE  38   3.514   5.971   1.950
  301   3HG2  ILE  38          3HG2      ILE  38   3.590   4.780   3.250
  302   1HD1  ILE  38          1HD1      ILE  38   5.960   7.433   3.764
  303   2HD1  ILE  38          2HD1      ILE  38   4.330   7.123   3.166
  304   3HD1  ILE  38          3HD1      ILE  38   5.292   8.426   2.468
  305    H    SER  39           H        SER  39   6.786   2.234   3.096
  306    HA   SER  39           HA       SER  39   4.345   0.853   3.854
  307   1HB   SER  39          2HB       SER  39   6.155   0.184   2.175
  308   2HB   SER  39          1HB       SER  39   7.146  -0.262   3.560
  309    HG   SER  39           HG       SER  39   5.711  -1.826   4.087
  310    H    THR  40           H        THR  40   7.636   0.636   5.261
  311    HA   THR  40           HA       THR  40   7.022  -0.724   7.621
  312    HB   THR  40           HB       THR  40   8.996   1.527   7.125
  313    HG1  THR  40           1HG      THR  40  10.371  -0.389   6.857
  314   1HG2  THR  40          1HG2      THR  40   9.411  -0.692   9.098
  315   2HG2  THR  40          2HG2      THR  40   8.432   0.699   9.566
  316   3HG2  THR  40          3HG2      THR  40  10.110   0.927   9.074
  317    H    MET  41           H        MET  41   6.184   2.559   6.794
  318    HA   MET  41           HA       MET  41   5.926   3.594   9.472
  319   1HB   MET  41          2HB       MET  41   5.378   5.487   8.325
  320   2HB   MET  41          1HB       MET  41   5.857   4.560   6.907
  321   1HG   MET  41          2HG       MET  41   3.558   3.927   6.469
  322   2HG   MET  41          1HG       MET  41   3.025   4.637   7.990
  323   1HE   MET  41          1HE       MET  41   1.463   6.895   5.282
  324   2HE   MET  41          2HE       MET  41   1.306   5.421   6.235
  325   3HE   MET  41          3HE       MET  41   2.116   5.367   4.672
  326    H    LEU  42           H        LEU  42   3.493   2.223   7.213
  327    HA   LEU  42           HA       LEU  42   1.311   2.400   9.084
  328   1HB   LEU  42          2HB       LEU  42   0.780   2.270   6.793
  329   2HB   LEU  42          1HB       LEU  42   1.927   0.961   6.509
  330    HG   LEU  42           HG       LEU  42   0.503  -0.513   7.940
  331   1HD1  LEU  42          1HD1      LEU  42  -0.853   0.737   9.307
  332   2HD1  LEU  42          2HD1      LEU  42  -1.972   0.571   7.954
  333   3HD1  LEU  42          3HD1      LEU  42  -1.011   2.040   8.129
  334   1HD2  LEU  42          1HD2      LEU  42   0.103  -0.928   5.691
  335   2HD2  LEU  42          2HD2      LEU  42  -0.424   0.725   5.376
  336   3HD2  LEU  42          3HD2      LEU  42  -1.502  -0.402   6.198
  337    H    LEU  43           H        LEU  43   3.613  -0.183   8.217
  338    HA   LEU  43           HA       LEU  43   2.535  -2.383   9.538
  339   1HB   LEU  43          2HB       LEU  43   4.641  -2.289   8.209
  340   2HB   LEU  43          1HB       LEU  43   5.429  -1.469   9.560
  341    HG   LEU  43           HG       LEU  43   4.276  -3.632  10.801
  342   1HD1  LEU  43          1HD1      LEU  43   3.837  -4.361   8.302
  343   2HD1  LEU  43          2HD1      LEU  43   4.406  -5.546   9.478
  344   3HD1  LEU  43          3HD1      LEU  43   5.542  -4.812   8.345
  345   1HD2  LEU  43          1HD2      LEU  43   6.750  -2.579  10.593
  346   2HD2  LEU  43          2HD2      LEU  43   6.989  -4.035   9.626
  347   3HD2  LEU  43          3HD2      LEU  43   6.461  -4.166  11.304
  348    H    GLU  44           H        GLU  44   3.802   0.546  10.972
  349    HA   GLU  44           HA       GLU  44   4.318  -0.450  13.614
  350   1HB   GLU  44          2HB       GLU  44   5.236   1.639  13.138
  351   2HB   GLU  44          1HB       GLU  44   3.847   2.144  12.186
  352   1HG   GLU  44          2HG       GLU  44   2.856   3.097  13.962
  353   2HG   GLU  44          1HG       GLU  44   3.151   1.681  14.965
  354    H    LEU  45           H        LEU  45   1.507   0.644  11.846
  355    HA   LEU  45           HA       LEU  45  -0.266   0.531  14.207
  356   1HB   LEU  45          2HB       LEU  45  -0.384   1.369  11.329
  357   2HB   LEU  45          1HB       LEU  45  -1.897   1.034  12.171
  358    HG   LEU  45           HG       LEU  45   0.188   2.831  13.399
  359   1HD1  LEU  45          1HD1      LEU  45  -0.195   3.892  11.297
  360   2HD1  LEU  45          2HD1      LEU  45  -1.252   4.719  12.442
  361   3HD1  LEU  45          3HD1      LEU  45  -1.918   3.513  11.339
  362   1HD2  LEU  45          1HD2      LEU  45  -1.800   1.877  14.687
  363   2HD2  LEU  45          2HD2      LEU  45  -2.830   2.848  13.635
  364   3HD2  LEU  45          3HD2      LEU  45  -1.661   3.637  14.694
  365    H    GLY  46           H        GLY  46   0.889  -1.573  11.738
  366   1HA   GLY  46          2HA       GLY  46   0.423  -3.949  11.785
  367   2HA   GLY  46          1HA       GLY  46  -1.124  -3.603  12.554
  368    H    LEU  47           H        LEU  47  -0.793  -1.376  10.119
  369    HA   LEU  47           HA       LEU  47  -1.525  -1.269   7.872
  370   1HB   LEU  47          2HB       LEU  47  -1.022  -3.111   6.650
  371   2HB   LEU  47          1HB       LEU  47  -0.470  -3.799   8.173
  372    HG   LEU  47           HG       LEU  47  -2.995  -4.489   8.455
  373   1HD1  LEU  47          1HD1      LEU  47  -4.345  -4.119   6.696
  374   2HD1  LEU  47          2HD1      LEU  47  -3.233  -4.977   5.628
  375   3HD1  LEU  47          3HD1      LEU  47  -3.032  -3.247   5.906
  376   1HD2  LEU  47          1HD2      LEU  47  -1.690  -6.360   8.301
  377   2HD2  LEU  47          2HD2      LEU  47  -0.751  -5.711   6.955
  378   3HD2  LEU  47          3HD2      LEU  47  -2.333  -6.434   6.659
  379    H    ARG  48           H        ARG  48  -3.349  -2.849  10.380
  380    HA   ARG  48           HA       ARG  48  -5.856  -3.034   8.930
  381   1HB   ARG  48          2HB       ARG  48  -6.716  -3.646  11.094
  382   2HB   ARG  48          1HB       ARG  48  -5.088  -4.317  10.989
  383   1HG   ARG  48          2HG       ARG  48  -4.239  -2.266  12.169
  384   2HG   ARG  48          1HG       ARG  48  -5.915  -1.770  12.407
  385   1HD   ARG  48          2HD       ARG  48  -6.313  -4.011  13.544
  386   2HD   ARG  48          1HD       ARG  48  -4.554  -4.245  13.512
  387    HE   ARG  48           HE       ARG  48  -5.772  -1.808  14.752
  388   1HH1  ARG  48          1HH2      ARG  48  -2.782  -2.947  14.295
  389   2HH1  ARG  48          2HH2      ARG  48  -2.367  -3.199  15.958
  390   1HH2  ARG  48          1HH1      ARG  48  -5.614  -2.802  17.104
  391   2HH2  ARG  48          2HH1      ARG  48  -3.970  -3.119  17.548
  392    H    VAL  49           H        VAL  49  -4.484  -0.670  11.240
  393    HA   VAL  49           HA       VAL  49  -6.690   1.041  11.548
  394    HB   VAL  49           HB       VAL  49  -3.720   1.621  11.310
  395   1HG1  VAL  49          1HG1      VAL  49  -4.134   3.786  11.795
  396   2HG1  VAL  49          2HG1      VAL  49  -5.284   3.349  13.061
  397   3HG1  VAL  49          3HG1      VAL  49  -5.818   3.461  11.384
  398   1HG2  VAL  49          1HG2      VAL  49  -3.563   1.098  13.565
  399   2HG2  VAL  49          2HG2      VAL  49  -4.828  -0.029  13.079
  400   3HG2  VAL  49          3HG2      VAL  49  -5.255   1.483  13.879
  401    H    TYR  50           H        TYR  50  -3.978   1.882   9.372
  402    HA   TYR  50           HA       TYR  50  -5.167   3.850   7.844
  403   1HB   TYR  50          2HB       TYR  50  -2.860   3.171   7.575
  404   2HB   TYR  50          1HB       TYR  50  -3.346   1.567   7.025
  405    HD1  TYR  50           1HD      TYR  50  -4.724   4.924   6.121
  406    HD2  TYR  50           2HD      TYR  50  -2.628   1.420   4.789
  407    HE1  TYR  50           1HE      TYR  50  -4.827   5.751   3.786
  408    HE2  TYR  50           2HE      TYR  50  -2.731   2.247   2.453
  409    HH   TYR  50           HH       TYR  50  -4.719   4.870   1.519
  410    H    GLU  51           H        GLU  51  -5.214   0.377   6.918
  411    HA   GLU  51           HA       GLU  51  -7.030   0.634   4.760
  412   1HB   GLU  51          2HB       GLU  51  -5.454  -1.266   5.891
  413   2HB   GLU  51          1HB       GLU  51  -7.038  -1.820   6.423
  414   1HG   GLU  51          2HG       GLU  51  -7.155  -1.017   3.655
  415   2HG   GLU  51          1HG       GLU  51  -5.862  -2.193   3.886
  416    H    ALA  52           H        ALA  52  -7.560   0.498   8.226
  417    HA   ALA  52           HA       ALA  52 -10.391  -0.206   8.061
  418   1HB   ALA  52          1HB       ALA  52  -9.414  -0.805  10.082
  419   2HB   ALA  52          2HB       ALA  52 -10.097   0.757  10.533
  420   3HB   ALA  52          3HB       ALA  52  -8.387   0.628  10.124
  421    H    GLN  53           H        GLN  53  -8.539   2.807   8.553
  422    HA   GLN  53           HA       GLN  53 -10.744   4.550   8.998
  423   1HB   GLN  53          2HB       GLN  53  -7.927   4.798   7.972
  424   2HB   GLN  53          1HB       GLN  53  -8.979   6.213   7.996
  425   1HG   GLN  53          2HG       GLN  53  -9.461   5.381  10.476
  426   2HG   GLN  53          1HG       GLN  53  -7.876   4.631  10.283
  427   1HE2  GLN  53          1HE2      GLN  53  -7.906   6.599  12.162
  428   2HE2  GLN  53          2HE2      GLN  53  -7.209   8.033  11.579
  429    H    MET  54           H        MET  54  -9.523   3.083   6.068
  430    HA   MET  54           HA       MET  54 -11.127   4.935   4.369
  431   1HB   MET  54          2HB       MET  54  -9.864   3.822   2.548
  432   2HB   MET  54          1HB       MET  54  -8.776   4.433   3.793
  433   1HG   MET  54          2HG       MET  54  -8.260   2.317   4.579
  434   2HG   MET  54          1HG       MET  54  -9.801   1.635   4.059
  435   1HE   MET  54          1HE       MET  54  -9.742   0.930   0.584
  436   2HE   MET  54          2HE       MET  54  -9.635   2.688   0.585
  437   3HE   MET  54          3HE       MET  54 -10.573   1.869   1.832
  438    H    GLU  55           H        GLU  55 -12.140   2.612   6.181
  439    HA   GLU  55           HA       GLU  55 -14.074   1.570   4.208
  440   1HB   GLU  55          2HB       GLU  55 -11.836   0.195   4.310
  441   2HB   GLU  55          1HB       GLU  55 -12.496  -0.418   5.826
  442   1HG   GLU  55          2HG       GLU  55 -14.519  -0.433   3.748
  443   2HG   GLU  55          1HG       GLU  55 -13.094  -1.344   3.242
  444    H    ARG  56           H        ARG  56 -15.667   0.054   5.421
  445    HA   ARG  56           HA       ARG  56 -16.123   1.177   8.160
  446   1HB   ARG  56          2HB       ARG  56 -18.487   0.536   7.670
  447   2HB   ARG  56          1HB       ARG  56 -17.830   1.634   6.456
  448   1HG   ARG  56          2HG       ARG  56 -18.005   0.088   4.815
  449   2HG   ARG  56          1HG       ARG  56 -17.314  -1.179   5.830
  450   1HD   ARG  56          2HD       ARG  56 -19.483  -1.526   6.930
  451   2HD   ARG  56          1HD       ARG  56 -20.191  -0.207   5.977
  452    HE   ARG  56           HE       ARG  56 -20.387  -1.767   4.225
  453   1HH1  ARG  56          1HH1      ARG  56 -17.389  -1.785   3.841
  454   2HH1  ARG  56          2HH1      ARG  56 -17.030  -3.473   3.982
  455   1HH2  ARG  56          1HH2      ARG  56 -20.069  -4.269   5.447
  456   2HH2  ARG  56          2HH2      ARG  56 -18.547  -4.880   4.892
  Start of MODEL    5
    1   1H    ALA   2          1H        ALA   2   1.739 -24.277  -8.018
    2   2H    ALA   2          2H        ALA   2   0.956 -25.584  -7.265
    3   3H    ALA   2          3H        ALA   2   0.085 -24.177  -7.650
    4    HA   ALA   2           HA       ALA   2   1.254 -26.116  -9.582
    5   1HB   ALA   2          1HB       ALA   2  -0.758 -27.111  -9.329
    6   2HB   ALA   2          2HB       ALA   2  -1.562 -25.606  -9.774
    7   3HB   ALA   2          3HB       ALA   2  -1.172 -25.931  -8.085
    8    H    LYS   3           H        LYS   3   0.536 -22.853  -8.951
    9    HA   LYS   3           HA       LYS   3   0.440 -22.277 -11.894
   10   1HB   LYS   3          2HB       LYS   3  -1.245 -21.336  -9.594
   11   2HB   LYS   3          1HB       LYS   3  -0.988 -20.252 -10.963
   12   1HG   LYS   3          2HG       LYS   3  -1.750 -23.078 -11.558
   13   2HG   LYS   3          1HG       LYS   3  -3.004 -22.004 -10.935
   14   1HD   LYS   3          2HD       LYS   3  -3.204 -21.583 -13.205
   15   2HD   LYS   3          1HD       LYS   3  -2.024 -20.347 -12.762
   16   1HE   LYS   3          2HE       LYS   3  -0.194 -21.660 -13.580
   17   2HE   LYS   3          1HE       LYS   3  -1.212 -23.108 -13.724
   18   1HZ   LYS   3          1HZ       LYS   3  -1.392 -20.595 -15.287
   19   2HZ   LYS   3          2HZ       LYS   3  -2.653 -21.732 -15.242
   20   3HZ   LYS   3          3HZ       LYS   3  -1.136 -22.166 -15.871
   21    H    VAL   4           H        VAL   4   1.639 -20.428 -12.531
   22    HA   VAL   4           HA       VAL   4   3.535 -19.389 -10.471
   23    HB   VAL   4           HB       VAL   4   4.891 -18.817 -12.459
   24   1HG1  VAL   4          1HG1      VAL   4   4.853 -21.161 -11.452
   25   2HG1  VAL   4          2HG1      VAL   4   5.418 -21.061 -13.120
   26   3HG1  VAL   4          3HG1      VAL   4   3.781 -21.616 -12.775
   27   1HG2  VAL   4          1HG2      VAL   4   2.733 -20.126 -14.124
   28   2HG2  VAL   4          2HG2      VAL   4   4.116 -19.182 -14.678
   29   3HG2  VAL   4          3HG2      VAL   4   2.771 -18.382 -13.862
   30    H    GLN   5           H        GLN   5   0.637 -18.507 -11.763
   31    HA   GLN   5           HA       GLN   5   1.049 -15.787 -12.597
   32   1HB   GLN   5          2HB       GLN   5  -1.394 -15.669 -12.288
   33   2HB   GLN   5          1HB       GLN   5  -0.948 -17.194 -13.054
   34   1HG   GLN   5          2HG       GLN   5  -1.431 -18.444 -11.168
   35   2HG   GLN   5          1HG       GLN   5  -1.081 -17.111 -10.068
   36   1HE2  GLN   5          1HE2      GLN   5  -3.165 -16.646 -12.889
   37   2HE2  GLN   5          2HE2      GLN   5  -4.608 -16.459 -12.014
   38    H    ALA   6           H        ALA   6  -0.684 -14.288 -10.997
   39    HA   ALA   6           HA       ALA   6  -0.701 -12.990  -9.020
   40   1HB   ALA   6          1HB       ALA   6   0.333 -14.718  -7.103
   41   2HB   ALA   6          2HB       ALA   6  -0.304 -15.811  -8.332
   42   3HB   ALA   6          3HB       ALA   6  -1.362 -14.617  -7.580
   43    H    TYR   7           H        TYR   7   1.548 -12.637 -10.668
   44    HA   TYR   7           HA       TYR   7   4.073 -12.938  -9.333
   45   1HB   TYR   7          2HB       TYR   7   3.130 -12.169 -11.799
   46   2HB   TYR   7          1HB       TYR   7   3.707 -10.637 -11.143
   47    HD1  TYR   7           1HD      TYR   7   4.907 -14.177 -10.800
   48    HD2  TYR   7           2HD      TYR   7   5.824 -10.153 -11.993
   49    HE1  TYR   7           1HE      TYR   7   7.246 -14.851 -11.276
   50    HE2  TYR   7           2HE      TYR   7   8.162 -10.827 -12.468
   51    HH   TYR   7           HH       TYR   7   9.149 -14.172 -12.460
   52    H    VAL   8           H        VAL   8   5.338 -10.639  -9.034
   53    HA   VAL   8           HA       VAL   8   5.564  -8.660  -7.753
   54    HB   VAL   8           HB       VAL   8   2.552  -8.635  -7.545
   55   1HG1  VAL   8          1HG1      VAL   8   3.832  -6.873  -6.400
   56   2HG1  VAL   8          2HG1      VAL   8   2.922  -6.200  -7.754
   57   3HG1  VAL   8          3HG1      VAL   8   4.657  -6.481  -7.909
   58   1HG2  VAL   8          1HG2      VAL   8   4.143  -8.728  -9.976
   59   2HG2  VAL   8          2HG2      VAL   8   3.284  -7.194  -9.847
   60   3HG2  VAL   8          3HG2      VAL   8   2.390  -8.714  -9.798
   61    H    SER   9           H        SER   9   4.445 -11.559  -6.684
   62    HA   SER   9           HA       SER   9   3.991 -12.467  -4.530
   63   1HB   SER   9          2HB       SER   9   6.427 -11.401  -4.712
   64   2HB   SER   9          1HB       SER   9   5.785 -10.311  -3.486
   65    HG   SER   9           HG       SER   9   6.414 -11.929  -2.251
   66    H    ASP  10           H        ASP  10   4.201 -11.000  -2.060
   67    HA   ASP  10           HA       ASP  10   1.729 -10.343  -1.242
   68   1HB   ASP  10          2HB       ASP  10   2.883  -8.515   0.149
   69   2HB   ASP  10          1HB       ASP  10   3.591 -10.130   0.234
   70    H    GLU  11           H        GLU  11   0.447  -9.545  -2.993
   71    HA   GLU  11           HA       GLU  11   0.834  -7.337  -4.646
   72   1HB   GLU  11          2HB       GLU  11  -1.087  -8.782  -4.827
   73   2HB   GLU  11          1HB       GLU  11  -1.627  -8.359  -3.202
   74   1HG   GLU  11          2HG       GLU  11  -2.901  -7.167  -4.999
   75   2HG   GLU  11          1HG       GLU  11  -2.072  -6.069  -3.893
   76    H    ILE  12           H        ILE  12   0.350  -7.334  -1.190
   77    HA   ILE  12           HA       ILE  12  -0.739  -4.804  -0.672
   78    HB   ILE  12           HB       ILE  12   1.413  -6.468   0.647
   79   1HG1  ILE  12          2HG1      ILE  12  -0.948  -7.296   0.578
   80   2HG1  ILE  12          1HG1      ILE  12  -0.381  -6.989   2.220
   81   1HG2  ILE  12          1HG2      ILE  12   0.133  -3.909   1.655
   82   2HG2  ILE  12          2HG2      ILE  12   1.842  -4.155   1.298
   83   3HG2  ILE  12          3HG2      ILE  12   1.093  -5.005   2.649
   84   1HD1  ILE  12          1HD1      ILE  12  -1.412  -4.535   1.425
   85   2HD1  ILE  12          2HD1      ILE  12  -2.223  -5.703   2.467
   86   3HD1  ILE  12          3HD1      ILE  12  -2.542  -5.698   0.733
   87    H    VAL  13           H        VAL  13   2.345  -5.596  -2.079
   88    HA   VAL  13           HA       VAL  13   3.895  -3.311  -1.448
   89    HB   VAL  13           HB       VAL  13   3.669  -5.096  -3.885
   90   1HG1  VAL  13          1HG1      VAL  13   4.637  -2.795  -4.393
   91   2HG1  VAL  13          2HG1      VAL  13   5.709  -4.156  -4.727
   92   3HG1  VAL  13          3HG1      VAL  13   5.939  -3.187  -3.271
   93   1HG2  VAL  13          1HG2      VAL  13   5.865  -5.933  -2.913
   94   2HG2  VAL  13          2HG2      VAL  13   4.443  -6.256  -1.923
   95   3HG2  VAL  13          3HG2      VAL  13   5.531  -4.936  -1.498
   96    H    TYR  14           H        TYR  14   2.135  -3.782  -4.540
   97    HA   TYR  14           HA       TYR  14   2.247  -1.094  -5.408
   98   1HB   TYR  14          2HB       TYR  14   1.531  -3.254  -6.605
   99   2HB   TYR  14          1HB       TYR  14  -0.054  -3.004  -5.872
  100    HD1  TYR  14           1HD      TYR  14   2.529  -0.845  -7.546
  101    HD2  TYR  14           2HD      TYR  14  -1.601  -1.991  -7.278
  102    HE1  TYR  14           1HE      TYR  14   1.963   0.787  -9.324
  103    HE2  TYR  14           2HE      TYR  14  -2.169  -0.360  -9.058
  104    HH   TYR  14           HH       TYR  14  -1.104   1.840  -9.941
  105    H    LYS  15           H        LYS  15   0.256  -2.574  -2.960
  106    HA   LYS  15           HA       LYS  15  -1.908  -0.671  -2.932
  107   1HB   LYS  15          2HB       LYS  15  -1.565  -3.036  -1.851
  108   2HB   LYS  15          1HB       LYS  15  -0.853  -2.128  -0.516
  109   1HG   LYS  15          2HG       LYS  15  -3.073  -0.662  -0.849
  110   2HG   LYS  15          1HG       LYS  15  -3.679  -2.202  -1.463
  111   1HD   LYS  15          2HD       LYS  15  -2.829  -3.294   0.639
  112   2HD   LYS  15          1HD       LYS  15  -2.446  -1.687   1.257
  113   1HE   LYS  15          2HE       LYS  15  -5.215  -2.161   0.206
  114   2HE   LYS  15          1HE       LYS  15  -4.796  -2.796   1.810
  115   1HZ   LYS  15          1HZ       LYS  15  -4.327  -0.007   0.895
  116   2HZ   LYS  15          2HZ       LYS  15  -3.960  -0.628   2.432
  117   3HZ   LYS  15          3HZ       LYS  15  -5.578  -0.492   1.933
  118    H    ILE  16           H        ILE  16   1.169  -0.864  -1.121
  119    HA   ILE  16           HA       ILE  16   0.674   1.569   0.396
  120    HB   ILE  16           HB       ILE  16   3.270   0.117  -0.199
  121   1HG1  ILE  16          2HG1      ILE  16   1.082  -0.444   1.821
  122   2HG1  ILE  16          1HG1      ILE  16   1.702  -1.535   0.582
  123   1HG2  ILE  16          1HG2      ILE  16   2.780   2.456   1.206
  124   2HG2  ILE  16          2HG2      ILE  16   4.190   1.416   1.410
  125   3HG2  ILE  16          3HG2      ILE  16   2.794   1.226   2.471
  126   1HD1  ILE  16          1HD1      ILE  16   3.023  -0.637   3.132
  127   2HD1  ILE  16          2HD1      ILE  16   3.997  -1.202   1.774
  128   3HD1  ILE  16          3HD1      ILE  16   2.809  -2.275   2.515
  129    H    ASN  17           H        ASN  17   1.650   0.953  -2.823
  130    HA   ASN  17           HA       ASN  17   3.451   3.188  -3.215
  131   1HB   ASN  17          2HB       ASN  17   2.535   0.950  -4.606
  132   2HB   ASN  17          1HB       ASN  17   1.894   2.308  -5.530
  133   1HD2  ASN  17          1HD2      ASN  17   4.093   0.523  -6.385
  134   2HD2  ASN  17          2HD2      ASN  17   5.463   1.507  -6.576
  135    H    LYS  18           H        LYS  18  -0.029   2.697  -3.918
  136    HA   LYS  18           HA       LYS  18  -0.685   5.137  -5.097
  137   1HB   LYS  18          2HB       LYS  18  -2.105   3.381  -3.080
  138   2HB   LYS  18          1HB       LYS  18  -2.902   4.754  -3.852
  139   1HG   LYS  18          2HG       LYS  18  -3.270   3.543  -5.710
  140   2HG   LYS  18          1HG       LYS  18  -1.546   3.199  -5.858
  141   1HD   LYS  18          2HD       LYS  18  -1.949   1.063  -5.284
  142   2HD   LYS  18          1HD       LYS  18  -2.513   1.619  -3.707
  143   1HE   LYS  18          2HE       LYS  18  -4.456   0.582  -4.436
  144   2HE   LYS  18          1HE       LYS  18  -4.719   2.179  -5.165
  145   1HZ   LYS  18          1HZ       LYS  18  -3.580   1.419  -7.159
  146   2HZ   LYS  18          2HZ       LYS  18  -4.919   0.426  -6.828
  147   3HZ   LYS  18          3HZ       LYS  18  -3.348  -0.115  -6.471
  148    H    ILE  19           H        ILE  19   0.107   4.497  -1.724
  149    HA   ILE  19           HA       ILE  19  -0.816   7.069  -0.718
  150    HB   ILE  19           HB       ILE  19   1.183   5.090   0.420
  151   1HG1  ILE  19          2HG1      ILE  19  -1.082   4.141  -0.325
  152   2HG1  ILE  19          1HG1      ILE  19  -0.655   3.896   1.369
  153   1HG2  ILE  19          1HG2      ILE  19   1.284   6.913   1.848
  154   2HG2  ILE  19          2HG2      ILE  19  -0.073   6.037   2.558
  155   3HG2  ILE  19          3HG2      ILE  19  -0.369   7.414   1.496
  156   1HD1  ILE  19          1HD1      ILE  19  -2.310   5.272   2.118
  157   2HD1  ILE  19          2HD1      ILE  19  -3.030   4.954   0.539
  158   3HD1  ILE  19          3HD1      ILE  19  -2.085   6.422   0.799
  159    H    VAL  20           H        VAL  20   2.387   5.697  -1.543
  160    HA   VAL  20           HA       VAL  20   3.857   8.113  -0.931
  161    HB   VAL  20           HB       VAL  20   4.634   5.922  -2.868
  162   1HG1  VAL  20          1HG1      VAL  20   6.838   6.356  -1.514
  163   2HG1  VAL  20          2HG1      VAL  20   6.052   7.871  -1.070
  164   3HG1  VAL  20          3HG1      VAL  20   6.358   7.500  -2.768
  165   1HG2  VAL  20          1HG2      VAL  20   4.227   4.433  -1.214
  166   2HG2  VAL  20          2HG2      VAL  20   3.921   5.712  -0.038
  167   3HG2  VAL  20          3HG2      VAL  20   5.572   5.182  -0.356
  168    H    GLU  21           H        GLU  21   2.855   6.628  -4.038
  169    HA   GLU  21           HA       GLU  21   3.798   8.445  -5.891
  170   1HB   GLU  21          2HB       GLU  21   1.490   6.650  -5.578
  171   2HB   GLU  21          1HB       GLU  21   1.209   7.953  -6.736
  172   1HG   GLU  21          2HG       GLU  21   3.863   6.721  -6.989
  173   2HG   GLU  21          1HG       GLU  21   2.536   5.599  -7.297
  174    H    ARG  22           H        ARG  22   0.841   8.836  -3.914
  175    HA   ARG  22           HA       ARG  22  -0.261  11.169  -4.899
  176   1HB   ARG  22          2HB       ARG  22  -0.326   9.643  -2.549
  177   2HB   ARG  22          1HB       ARG  22   0.048  11.278  -2.002
  178   1HG   ARG  22          2HG       ARG  22  -2.108  11.845  -2.281
  179   2HG   ARG  22          1HG       ARG  22  -1.957  11.505  -4.005
  180   1HD   ARG  22          2HD       ARG  22  -2.826   9.347  -3.795
  181   2HD   ARG  22          1HD       ARG  22  -2.344   9.213  -2.092
  182    HE   ARG  22           HE       ARG  22  -4.097  11.133  -1.761
  183   1HH1  ARG  22          1HH2      ARG  22  -4.993  10.984  -4.643
  184   2HH1  ARG  22          2HH2      ARG  22  -6.383   9.957  -4.524
  185   1HH2  ARG  22          1HH1      ARG  22  -5.571   8.781  -1.365
  186   2HH2  ARG  22          2HH1      ARG  22  -6.711   8.710  -2.669
  187    H    ARG  23           H        ARG  23   2.380  11.090  -2.465
  188    HA   ARG  23           HA       ARG  23   2.918  13.804  -2.199
  189   1HB   ARG  23          2HB       ARG  23   4.143  11.333  -1.648
  190   2HB   ARG  23          1HB       ARG  23   5.359  12.258  -2.530
  191   1HG   ARG  23          2HG       ARG  23   5.791  13.106  -0.446
  192   2HG   ARG  23          1HG       ARG  23   4.459  14.184  -0.866
  193   1HD   ARG  23          2HD       ARG  23   2.935  13.052   0.496
  194   2HD   ARG  23          1HD       ARG  23   3.853  11.534   0.429
  195    HE   ARG  23           HE       ARG  23   5.654  12.887   1.736
  196   1HH1  ARG  23          1HH2      ARG  23   3.509  15.183   1.755
  197   2HH1  ARG  23          2HH2      ARG  23   2.994  15.077   3.404
  198   1HH2  ARG  23          1HH1      ARG  23   4.456  11.977   3.939
  199   2HH2  ARG  23          2HH1      ARG  23   3.529  13.261   4.642
  200    H    ARG  24           H        ARG  24   4.189  11.637  -4.753
  201    HA   ARG  24           HA       ARG  24   5.592  13.743  -6.166
  202   1HB   ARG  24          2HB       ARG  24   5.433  10.962  -6.164
  203   2HB   ARG  24          1HB       ARG  24   4.734  11.410  -7.720
  204   1HG   ARG  24          2HG       ARG  24   6.842  13.044  -7.782
  205   2HG   ARG  24          1HG       ARG  24   7.511  11.823  -6.700
  206   1HD   ARG  24          2HD       ARG  24   6.183  11.068  -9.315
  207   2HD   ARG  24          1HD       ARG  24   7.919  11.427  -9.204
  208    HE   ARG  24           HE       ARG  24   7.519   9.670  -7.120
  209   1HH1  ARG  24          1HH1      ARG  24   5.391   9.121  -9.514
  210   2HH1  ARG  24          2HH1      ARG  24   6.088   7.650 -10.108
  211   1HH2  ARG  24          1HH2      ARG  24   9.022   7.996  -8.293
  212   2HH2  ARG  24          2HH2      ARG  24   8.144   7.014  -9.418
  213    H    ALA  25           H        ALA  25   2.586  11.935  -6.969
  214    HA   ALA  25           HA       ALA  25   1.750  13.279  -9.244
  215   1HB   ALA  25          1HB       ALA  25   0.537  11.878  -6.968
  216   2HB   ALA  25          2HB       ALA  25   0.147  11.762  -8.684
  217   3HB   ALA  25          3HB       ALA  25  -0.557  13.047  -7.705
  218    H    GLU  26           H        GLU  26   1.803  14.462  -5.934
  219    HA   GLU  26           HA       GLU  26   0.314  16.899  -6.549
  220   1HB   GLU  26          2HB       GLU  26   1.129  15.371  -4.283
  221   2HB   GLU  26          1HB       GLU  26   1.778  17.000  -4.086
  222   1HG   GLU  26          2HG       GLU  26  -0.873  17.267  -5.083
  223   2HG   GLU  26          1HG       GLU  26  -0.930  16.111  -3.752
  224    H    GLY  27           H        GLY  27   3.684  15.872  -6.301
  225   1HA   GLY  27          2HA       GLY  27   5.208  17.316  -7.748
  226   2HA   GLY  27          1HA       GLY  27   4.511  18.690  -6.889
  227    H    ALA  28           H        ALA  28   5.516  15.545  -5.554
  228    HA   ALA  28           HA       ALA  28   7.137  16.979  -3.528
  229   1HB   ALA  28          1HB       ALA  28   7.140  14.781  -2.444
  230   2HB   ALA  28          2HB       ALA  28   6.482  14.037  -3.903
  231   3HB   ALA  28          3HB       ALA  28   5.503  15.170  -2.971
  232    H    LYS  29           H        LYS  29   9.307  15.756  -2.986
  233    HA   LYS  29           HA       LYS  29  10.694  14.378  -5.120
  234   1HB   LYS  29          2HB       LYS  29  10.418  16.658  -6.084
  235   2HB   LYS  29          1HB       LYS  29  11.292  17.324  -4.704
  236   1HG   LYS  29          2HG       LYS  29  13.273  16.817  -5.642
  237   2HG   LYS  29          1HG       LYS  29  12.784  15.136  -5.864
  238   1HD   LYS  29          2HD       LYS  29  11.315  16.355  -7.813
  239   2HD   LYS  29          1HD       LYS  29  12.752  17.378  -7.791
  240   1HE   LYS  29          2HE       LYS  29  13.626  14.658  -7.618
  241   2HE   LYS  29          1HE       LYS  29  12.481  14.789  -8.968
  242   1HZ   LYS  29          1HZ       LYS  29  14.647  16.757  -8.483
  243   2HZ   LYS  29          2HZ       LYS  29  13.671  16.606  -9.866
  244   3HZ   LYS  29          3HZ       LYS  29  14.835  15.422  -9.512
  245    H    SER  30           H        SER  30  10.936  16.443  -2.239
  246    HA   SER  30           HA       SER  30  13.531  16.071  -1.362
  247   1HB   SER  30          2HB       SER  30  11.532  17.227  -0.261
  248   2HB   SER  30          1HB       SER  30  11.089  15.646   0.379
  249    HG   SER  30           HG       SER  30  12.946  17.379   1.250
  250    H    THR  31           H        THR  31  14.577  14.428  -0.041
  251    HA   THR  31           HA       THR  31  13.790  11.684  -0.776
  252    HB   THR  31           HB       THR  31  16.043  12.223   1.079
  253    HG1  THR  31           1HG      THR  31  17.230  13.112  -0.733
  254   1HG2  THR  31          1HG2      THR  31  15.791  10.046   0.040
  255   2HG2  THR  31          2HG2      THR  31  17.213  10.832  -0.649
  256   3HG2  THR  31          3HG2      THR  31  15.706  10.779  -1.563
  257    H    ASP  32           H        ASP  32  11.947  13.009   1.026
  258    HA   ASP  32           HA       ASP  32  12.493  11.711   3.659
  259   1HB   ASP  32          2HB       ASP  32  11.551  14.207   2.889
  260   2HB   ASP  32          1HB       ASP  32  10.078  13.349   3.349
  261    H    VAL  33           H        VAL  33  10.278  11.690   0.910
  262    HA   VAL  33           HA       VAL  33   8.636   9.572   2.244
  263    HB   VAL  33           HB       VAL  33   7.601  11.689   1.334
  264   1HG1  VAL  33          1HG1      VAL  33   8.445  10.465  -1.312
  265   2HG1  VAL  33          2HG1      VAL  33   9.106  11.941  -0.608
  266   3HG1  VAL  33          3HG1      VAL  33   7.419  11.886  -1.120
  267   1HG2  VAL  33          1HG2      VAL  33   5.812  10.317   1.263
  268   2HG2  VAL  33          2HG2      VAL  33   6.834   8.936   0.868
  269   3HG2  VAL  33          3HG2      VAL  33   6.211   9.968  -0.419
  270    H    SER  34           H        SER  34   8.578   7.509   1.359
  271    HA   SER  34           HA       SER  34   9.496   6.967  -1.369
  272   1HB   SER  34          2HB       SER  34  11.119   5.988   0.998
  273   2HB   SER  34          1HB       SER  34  11.489   5.734  -0.706
  274    HG   SER  34           HG       SER  34  12.237   7.736   0.807
  275    H    PHE  35           H        PHE  35   8.822   4.892  -2.034
  276    HA   PHE  35           HA       PHE  35   6.657   3.602  -0.904
  277   1HB   PHE  35          2HB       PHE  35   7.750   3.166  -3.115
  278   2HB   PHE  35          1HB       PHE  35   9.019   2.276  -2.275
  279    HD1  PHE  35           1HD      PHE  35   5.573   2.212  -3.467
  280    HD2  PHE  35           2HD      PHE  35   8.470   0.184  -1.027
  281    HE1  PHE  35           1HE      PHE  35   4.150   0.181  -3.466
  282    HE2  PHE  35           2HE      PHE  35   7.047  -1.848  -1.026
  283    HZ   PHE  35           HZ       PHE  35   4.887  -1.849  -2.245
  284    H    SER  36           H        SER  36  10.094   2.916  -0.194
  285    HA   SER  36           HA       SER  36   9.602   0.776   1.665
  286   1HB   SER  36          2HB       SER  36  11.844   2.669   1.004
  287   2HB   SER  36          1HB       SER  36  11.992   1.607   2.401
  288    HG   SER  36           HG       SER  36  12.723   0.354   0.815
  289    H    SER  37           H        SER  37   9.780   4.296   2.013
  290    HA   SER  37           HA       SER  37   9.790   4.255   4.931
  291   1HB   SER  37          2HB       SER  37  10.378   6.041   2.917
  292   2HB   SER  37          1HB       SER  37   8.844   6.661   3.518
  293    HG   SER  37           HG       SER  37   9.739   7.070   5.418
  294    H    ILE  38           H        ILE  38   7.325   4.903   2.415
  295    HA   ILE  38           HA       ILE  38   5.181   5.423   4.282
  296    HB   ILE  38           HB       ILE  38   5.286   4.567   1.374
  297   1HG1  ILE  38          2HG1      ILE  38   6.334   6.768   2.016
  298   2HG1  ILE  38          1HG1      ILE  38   4.969   6.929   0.912
  299   1HG2  ILE  38          1HG2      ILE  38   3.073   4.502   3.084
  300   2HG2  ILE  38          2HG2      ILE  38   3.031   4.518   1.320
  301   3HG2  ILE  38          3HG2      ILE  38   2.914   6.031   2.218
  302   1HD1  ILE  38          1HD1      ILE  38   3.821   8.157   2.409
  303   2HD1  ILE  38          2HD1      ILE  38   5.271   8.180   3.415
  304   3HD1  ILE  38          3HD1      ILE  38   4.049   6.931   3.657
  305    H    SER  39           H        SER  39   6.608   2.503   3.004
  306    HA   SER  39           HA       SER  39   4.333   0.761   3.486
  307   1HB   SER  39          2HB       SER  39   5.843  -0.078   1.937
  308   2HB   SER  39          1HB       SER  39   7.240   0.540   2.812
  309    HG   SER  39           HG       SER  39   5.563  -1.577   3.695
  310    H    THR  40           H        THR  40   7.469   1.134   5.189
  311    HA   THR  40           HA       THR  40   7.036  -0.565   7.361
  312    HB   THR  40           HB       THR  40   8.372   2.158   7.307
  313    HG1  THR  40           1HG      THR  40   9.238  -0.455   6.650
  314   1HG2  THR  40          1HG2      THR  40   8.466  -0.173   9.206
  315   2HG2  THR  40          2HG2      THR  40   8.322   1.545   9.571
  316   3HG2  THR  40          3HG2      THR  40   9.865   0.887   9.026
  317    H    MET  41           H        MET  41   5.775   2.728   6.900
  318    HA   MET  41           HA       MET  41   4.851   3.160   9.570
  319   1HB   MET  41          2HB       MET  41   3.679   4.983   8.593
  320   2HB   MET  41          1HB       MET  41   5.093   4.758   7.566
  321   1HG   MET  41          2HG       MET  41   3.593   4.718   5.864
  322   2HG   MET  41          1HG       MET  41   3.272   3.071   6.392
  323   1HE   MET  41          1HE       MET  41   1.501   4.660   4.722
  324   2HE   MET  41          2HE       MET  41   1.505   6.275   5.426
  325   3HE   MET  41          3HE       MET  41   0.023   5.322   5.433
  326    H    LEU  42           H        LEU  42   3.485   1.321   6.893
  327    HA   LEU  42           HA       LEU  42   0.805   1.084   7.941
  328   1HB   LEU  42          2HB       LEU  42   2.503  -0.029   5.812
  329   2HB   LEU  42          1HB       LEU  42   1.288  -1.160   6.408
  330    HG   LEU  42           HG       LEU  42   0.703   1.680   5.521
  331   1HD1  LEU  42          1HD1      LEU  42   0.860   0.823   3.434
  332   2HD1  LEU  42          2HD1      LEU  42  -0.591  -0.100   3.820
  333   3HD1  LEU  42          3HD1      LEU  42   1.000  -0.826   4.042
  334   1HD2  LEU  42          1HD2      LEU  42  -1.449  -0.323   5.634
  335   2HD2  LEU  42          2HD2      LEU  42  -1.423   1.332   6.243
  336   3HD2  LEU  42          3HD2      LEU  42  -0.733   0.026   7.207
  337    H    LEU  43           H        LEU  43   3.443  -1.343   7.829
  338    HA   LEU  43           HA       LEU  43   2.286  -3.271   9.518
  339   1HB   LEU  43          2HB       LEU  43   4.318  -3.597   8.192
  340   2HB   LEU  43          1HB       LEU  43   5.176  -2.411   9.179
  341    HG   LEU  43           HG       LEU  43   4.114  -4.190  11.042
  342   1HD1  LEU  43          1HD1      LEU  43   5.396  -6.287   9.860
  343   2HD1  LEU  43          2HD1      LEU  43   4.656  -5.525   8.453
  344   3HD1  LEU  43          3HD1      LEU  43   3.649  -6.050   9.803
  345   1HD2  LEU  43          1HD2      LEU  43   6.260  -3.982  11.704
  346   2HD2  LEU  43          2HD2      LEU  43   6.630  -3.188  10.172
  347   3HD2  LEU  43          3HD2      LEU  43   6.802  -4.937  10.324
  348    H    GLU  44           H        GLU  44   4.214  -0.397  10.396
  349    HA   GLU  44           HA       GLU  44   4.424  -0.906  13.196
  350   1HB   GLU  44          2HB       GLU  44   4.271   1.609  11.506
  351   2HB   GLU  44          1HB       GLU  44   4.626   1.646  13.233
  352   1HG   GLU  44          2HG       GLU  44   6.273  -0.347  11.953
  353   2HG   GLU  44          1HG       GLU  44   6.452   1.197  11.118
  354    H    LEU  45           H        LEU  45   1.806   0.100  11.171
  355    HA   LEU  45           HA       LEU  45   0.114   0.880  13.495
  356   1HB   LEU  45          2HB       LEU  45   0.301   1.409  10.594
  357   2HB   LEU  45          1HB       LEU  45  -1.347   1.222  11.195
  358    HG   LEU  45           HG       LEU  45   0.171   2.832  13.040
  359   1HD1  LEU  45          1HD1      LEU  45   0.125   4.760  11.125
  360   2HD1  LEU  45          2HD1      LEU  45   0.574   3.360  10.151
  361   3HD1  LEU  45          3HD1      LEU  45   1.568   3.828  11.529
  362   1HD2  LEU  45          1HD2      LEU  45  -2.386   2.766  11.666
  363   2HD2  LEU  45          2HD2      LEU  45  -1.735   4.404  11.698
  364   3HD2  LEU  45          3HD2      LEU  45  -1.972   3.521  13.207
  365    H    GLY  46           H        GLY  46   0.882  -1.846  11.648
  366   1HA   GLY  46          2HA       GLY  46  -0.080  -3.994  11.667
  367   2HA   GLY  46          1HA       GLY  46  -1.313  -3.382  12.771
  368    H    LEU  47           H        LEU  47  -1.091  -1.371  10.094
  369    HA   LEU  47           HA       LEU  47  -2.342  -1.145   8.105
  370   1HB   LEU  47          2HB       LEU  47  -3.218  -4.004   8.589
  371   2HB   LEU  47          1HB       LEU  47  -3.152  -3.139   7.057
  372    HG   LEU  47           HG       LEU  47  -0.666  -3.554   8.714
  373   1HD1  LEU  47          1HD1      LEU  47  -2.185  -5.505   7.094
  374   2HD1  LEU  47          2HD1      LEU  47  -0.979  -5.783   8.349
  375   3HD1  LEU  47          3HD1      LEU  47  -0.468  -5.395   6.706
  376   1HD2  LEU  47          1HD2      LEU  47   0.258  -3.450   6.289
  377   2HD2  LEU  47          2HD2      LEU  47  -0.314  -1.949   7.018
  378   3HD2  LEU  47          3HD2      LEU  47  -1.332  -2.814   5.867
  379    H    ARG  48           H        ARG  48  -3.871  -2.400  11.028
  380    HA   ARG  48           HA       ARG  48  -6.600  -1.915  10.180
  381   1HB   ARG  48          2HB       ARG  48  -5.805  -3.487  11.977
  382   2HB   ARG  48          1HB       ARG  48  -5.393  -2.080  12.958
  383   1HG   ARG  48          2HG       ARG  48  -7.655  -3.036  13.489
  384   2HG   ARG  48          1HG       ARG  48  -7.706  -1.346  12.981
  385   1HD   ARG  48          2HD       ARG  48  -8.855  -1.837  11.066
  386   2HD   ARG  48          1HD       ARG  48  -7.914  -3.312  10.771
  387    HE   ARG  48           HE       ARG  48  -9.824  -3.335  13.045
  388   1HH1  ARG  48          1HH1      ARG  48  -8.266  -5.336  10.972
  389   2HH1  ARG  48          2HH1      ARG  48  -9.661  -6.198  10.415
  390   1HH2  ARG  48          1HH2      ARG  48 -11.923  -3.999  11.852
  391   2HH2  ARG  48          2HH2      ARG  48 -11.731  -5.440  10.911
  392    H    VAL  49           H        VAL  49  -4.798  -0.282  12.809
  393    HA   VAL  49           HA       VAL  49  -6.331   1.969  13.180
  394    HB   VAL  49           HB       VAL  49  -3.308   1.793  12.967
  395   1HG1  VAL  49          1HG1      VAL  49  -5.188   3.787  14.226
  396   2HG1  VAL  49          2HG1      VAL  49  -3.824   4.093  13.150
  397   3HG1  VAL  49          3HG1      VAL  49  -3.538   3.587  14.816
  398   1HG2  VAL  49          1HG2      VAL  49  -5.141   0.459  14.668
  399   2HG2  VAL  49          2HG2      VAL  49  -4.392   1.726  15.640
  400   3HG2  VAL  49          3HG2      VAL  49  -3.386   0.526  14.828
  401    H    TYR  50           H        TYR  50  -4.305   1.268  10.394
  402    HA   TYR  50           HA       TYR  50  -4.148   3.904   9.279
  403   1HB   TYR  50          2HB       TYR  50  -2.709   2.182   8.478
  404   2HB   TYR  50          1HB       TYR  50  -4.058   1.085   8.191
  405    HD1  TYR  50           1HD      TYR  50  -3.299   4.646   7.258
  406    HD2  TYR  50           2HD      TYR  50  -4.445   0.725   5.929
  407    HE1  TYR  50           1HE      TYR  50  -3.493   5.489   4.933
  408    HE2  TYR  50           2HE      TYR  50  -4.640   1.568   3.606
  409    HH   TYR  50           HH       TYR  50  -3.543   3.588   2.288
  410    H    GLU  51           H        GLU  51  -6.425   1.214   8.578
  411    HA   GLU  51           HA       GLU  51  -8.058   2.602   6.728
  412   1HB   GLU  51          2HB       GLU  51  -7.814   0.100   7.747
  413   2HB   GLU  51          1HB       GLU  51  -9.264   0.635   8.591
  414   1HG   GLU  51          2HG       GLU  51  -9.432   1.456   5.852
  415   2HG   GLU  51          1HG       GLU  51  -9.047  -0.263   5.906
  416    H    ALA  52           H        ALA  52  -7.675   3.059  10.107
  417    HA   ALA  52           HA       ALA  52 -10.361   3.955  10.751
  418   1HB   ALA  52          1HB       ALA  52  -8.096   3.244  12.109
  419   2HB   ALA  52          2HB       ALA  52  -9.444   4.113  12.842
  420   3HB   ALA  52          3HB       ALA  52  -8.035   4.999  12.259
  421    H    GLN  53           H        GLN  53  -7.287   5.743  10.261
  422    HA   GLN  53           HA       GLN  53  -8.742   8.275  10.007
  423   1HB   GLN  53          2HB       GLN  53  -5.863   7.374  10.020
  424   2HB   GLN  53          1HB       GLN  53  -6.295   9.044   9.650
  425   1HG   GLN  53          2HG       GLN  53  -7.775   8.700  11.877
  426   2HG   GLN  53          1HG       GLN  53  -6.464   7.571  12.227
  427   1HE2  GLN  53          1HE2      GLN  53  -4.175   8.685  11.470
  428   2HE2  GLN  53          2HE2      GLN  53  -3.957  10.252  12.086
  429    H    MET  54           H        MET  54  -9.196   6.203   7.931
  430    HA   MET  54           HA       MET  54  -7.725   6.669   5.543
  431   1HB   MET  54          2HB       MET  54  -9.613   5.580   4.493
  432   2HB   MET  54          1HB       MET  54  -9.413   4.857   6.090
  433   1HG   MET  54          2HG       MET  54 -11.182   6.262   6.999
  434   2HG   MET  54          1HG       MET  54 -11.332   7.119   5.465
  435   1HE   MET  54          1HE       MET  54 -12.730   4.883   2.987
  436   2HE   MET  54          2HE       MET  54 -11.123   4.252   3.334
  437   3HE   MET  54          3HE       MET  54 -11.406   5.992   3.376
  438    H    GLU  55           H        GLU  55 -10.215   8.565   7.118
  439    HA   GLU  55           HA       GLU  55 -10.384  10.371   4.735
  440   1HB   GLU  55          2HB       GLU  55 -12.158   9.573   7.003
  441   2HB   GLU  55          1HB       GLU  55 -12.345  11.206   6.368
  442   1HG   GLU  55          2HG       GLU  55 -13.454  10.423   4.576
  443   2HG   GLU  55          1HG       GLU  55 -12.107   9.359   4.174
  444    H    ARG  56           H        ARG  56 -11.175  12.701   6.014
  445    HA   ARG  56           HA       ARG  56  -9.470  13.402   8.259
  446   1HB   ARG  56          2HB       ARG  56  -8.149  13.123   5.891
  447   2HB   ARG  56          1HB       ARG  56  -8.599  14.827   5.807
  448   1HG   ARG  56          2HG       ARG  56  -7.182  15.412   7.487
  449   2HG   ARG  56          1HG       ARG  56  -7.558  13.970   8.433
  450   1HD   ARG  56          2HD       ARG  56  -5.504  13.210   7.814
  451   2HD   ARG  56          1HD       ARG  56  -6.196  12.977   6.197
  452    HE   ARG  56           HE       ARG  56  -5.479  15.738   6.577
  453   1HH1  ARG  56          1HH1      ARG  56  -4.939  14.030   4.126
  454   2HH1  ARG  56          2HH1      ARG  56  -3.209  13.966   4.128
  455   1HH2  ARG  56          1HH2      ARG  56  -2.908  15.044   7.409
  456   2HH2  ARG  56          2HH2      ARG  56  -2.058  14.540   5.987
  Start of MODEL    6
    1   1H    ALA   2          1H        ALA   2  -1.505 -20.225 -13.610
    2   2H    ALA   2          2H        ALA   2  -3.137 -19.767 -13.499
    3   3H    ALA   2          3H        ALA   2  -2.609 -21.221 -12.797
    4    HA   ALA   2           HA       ALA   2  -2.958 -19.050 -11.351
    5   1HB   ALA   2          1HB       ALA   2  -1.394 -20.157  -9.797
    6   2HB   ALA   2          2HB       ALA   2  -0.675 -21.042 -11.143
    7   3HB   ALA   2          3HB       ALA   2  -2.345 -21.359 -10.671
    8    H    LYS   3           H        LYS   3  -2.295 -17.042 -12.331
    9    HA   LYS   3           HA       LYS   3   0.442 -16.537 -13.156
   10   1HB   LYS   3          2HB       LYS   3  -2.147 -15.161 -12.927
   11   2HB   LYS   3          1HB       LYS   3  -0.766 -14.099 -12.646
   12   1HG   LYS   3          2HG       LYS   3  -1.145 -14.031 -14.998
   13   2HG   LYS   3          1HG       LYS   3   0.244 -15.097 -14.779
   14   1HD   LYS   3          2HD       LYS   3  -2.440 -16.378 -14.705
   15   2HD   LYS   3          1HD       LYS   3  -1.891 -15.790 -16.273
   16   1HE   LYS   3          2HE       LYS   3   0.325 -17.025 -15.762
   17   2HE   LYS   3          1HE       LYS   3  -0.593 -17.864 -14.495
   18   1HZ   LYS   3          1HZ       LYS   3  -1.498 -17.623 -17.315
   19   2HZ   LYS   3          2HZ       LYS   3  -2.207 -18.558 -16.085
   20   3HZ   LYS   3          3HZ       LYS   3  -0.681 -18.979 -16.703
   21    H    VAL   4           H        VAL   4   1.973 -16.786 -11.517
   22    HA   VAL   4           HA       VAL   4   3.108 -16.358  -9.486
   23    HB   VAL   4           HB       VAL   4   1.507 -13.848 -10.028
   24   1HG1  VAL   4          1HG1      VAL   4   3.351 -14.538  -7.769
   25   2HG1  VAL   4          2HG1      VAL   4   1.899 -13.536  -7.761
   26   3HG1  VAL   4          3HG1      VAL   4   3.403 -12.905  -8.432
   27   1HG2  VAL   4          1HG2      VAL   4   3.155 -13.531 -11.533
   28   2HG2  VAL   4          2HG2      VAL   4   3.971 -15.002 -11.003
   29   3HG2  VAL   4          3HG2      VAL   4   4.306 -13.468 -10.199
   30    H    GLN   5           H        GLN   5   1.987 -17.993  -8.226
   31    HA   GLN   5           HA       GLN   5  -0.529 -17.933  -7.057
   32   1HB   GLN   5          2HB       GLN   5   2.157 -19.001  -6.387
   33   2HB   GLN   5          1HB       GLN   5   1.005 -18.956  -5.053
   34   1HG   GLN   5          2HG       GLN   5   0.272 -20.097  -7.752
   35   2HG   GLN   5          1HG       GLN   5   1.010 -21.085  -6.491
   36   1HE2  GLN   5          1HE2      GLN   5  -0.822 -22.351  -5.900
   37   2HE2  GLN   5          2HE2      GLN   5  -2.250 -21.685  -5.271
   38    H    ALA   6           H        ALA   6  -1.011 -17.447  -4.657
   39    HA   ALA   6           HA       ALA   6   0.442 -15.570  -3.107
   40   1HB   ALA   6          1HB       ALA   6   0.260 -13.730  -4.416
   41   2HB   ALA   6          2HB       ALA   6  -1.460 -13.731  -4.029
   42   3HB   ALA   6          3HB       ALA   6  -0.885 -14.536  -5.488
   43    H    TYR   7           H        TYR   7  -0.513 -15.851  -1.132
   44    HA   TYR   7           HA       TYR   7  -3.420 -15.585  -0.808
   45   1HB   TYR   7          2HB       TYR   7  -3.684 -17.893   0.049
   46   2HB   TYR   7          1HB       TYR   7  -3.122 -17.904  -1.623
   47    HD1  TYR   7           1HD      TYR   7  -0.529 -17.962  -1.972
   48    HD2  TYR   7           2HD      TYR   7  -2.494 -19.088   1.676
   49    HE1  TYR   7           1HE      TYR   7   1.474 -19.257  -1.294
   50    HE2  TYR   7           2HE      TYR   7  -0.491 -20.383   2.355
   51    HH   TYR   7           HH       TYR   7   2.396 -20.005   1.271
   52    H    VAL   8           H        VAL   8  -1.926 -13.867   0.426
   53    HA   VAL   8           HA       VAL   8  -2.040 -14.581   3.259
   54    HB   VAL   8           HB       VAL   8   0.087 -15.615   2.380
   55   1HG1  VAL   8          1HG1      VAL   8   0.496 -13.775   0.706
   56   2HG1  VAL   8          2HG1      VAL   8   1.903 -14.174   1.691
   57   3HG1  VAL   8          3HG1      VAL   8   0.956 -12.730   2.049
   58   1HG2  VAL   8          1HG2      VAL   8  -0.371 -14.306   4.737
   59   2HG2  VAL   8          2HG2      VAL   8   1.061 -13.457   4.156
   60   3HG2  VAL   8          3HG2      VAL   8   1.105 -15.205   4.382
   61    H    SER   9           H        SER   9  -0.709 -12.295   0.852
   62    HA   SER   9           HA       SER   9  -2.168 -10.036   1.724
   63   1HB   SER   9          2HB       SER   9   0.102  -9.097   2.913
   64   2HB   SER   9          1HB       SER   9  -1.219  -9.855   3.799
   65    HG   SER   9           HG       SER   9   1.314 -10.748   3.300
   66    H    ASP  10           H        ASP  10  -1.222 -11.012  -0.748
   67    HA   ASP  10           HA       ASP  10   1.163  -9.729  -1.685
   68   1HB   ASP  10          2HB       ASP  10  -0.214 -11.665  -2.657
   69   2HB   ASP  10          1HB       ASP  10  -1.298 -10.431  -3.297
   70    H    GLU  11           H        GLU  11  -2.266  -8.755  -1.728
   71    HA   GLU  11           HA       GLU  11  -2.146  -6.445  -3.310
   72   1HB   GLU  11          2HB       GLU  11  -4.112  -5.762  -1.992
   73   2HB   GLU  11          1HB       GLU  11  -4.163  -7.497  -2.309
   74   1HG   GLU  11          2HG       GLU  11  -3.705  -8.054  -0.113
   75   2HG   GLU  11          1HG       GLU  11  -2.801  -6.570   0.186
   76    H    ILE  12           H        ILE  12  -0.751  -6.987  -0.167
   77    HA   ILE  12           HA       ILE  12  -0.609  -4.412   0.943
   78    HB   ILE  12           HB       ILE  12   1.276  -6.773   0.859
   79   1HG1  ILE  12          2HG1      ILE  12  -0.959  -6.886   2.046
   80   2HG1  ILE  12          1HG1      ILE  12   0.435  -7.167   3.090
   81   1HG2  ILE  12          1HG2      ILE  12   1.557  -4.178   2.400
   82   2HG2  ILE  12          2HG2      ILE  12   2.706  -4.865   1.252
   83   3HG2  ILE  12          3HG2      ILE  12   2.433  -5.654   2.805
   84   1HD1  ILE  12          1HD1      ILE  12  -0.178  -4.336   2.927
   85   2HD1  ILE  12          2HD1      ILE  12  -0.058  -5.369   4.353
   86   3HD1  ILE  12          3HD1      ILE  12  -1.582  -5.254   3.472
   87    H    VAL  13           H        VAL  13   1.889  -5.903  -1.163
   88    HA   VAL  13           HA       VAL  13   3.629  -3.791  -1.529
   89    HB   VAL  13           HB       VAL  13   2.489  -5.700  -3.597
   90   1HG1  VAL  13          1HG1      VAL  13   4.886  -3.871  -3.597
   91   2HG1  VAL  13          2HG1      VAL  13   3.670  -4.090  -4.854
   92   3HG1  VAL  13          3HG1      VAL  13   4.874  -5.345  -4.564
   93   1HG2  VAL  13          1HG2      VAL  13   5.152  -6.199  -2.474
   94   2HG2  VAL  13          2HG2      VAL  13   3.789  -7.303  -2.658
   95   3HG2  VAL  13          3HG2      VAL  13   3.877  -6.237  -1.256
   96    H    TYR  14           H        TYR  14   0.724  -4.340  -3.571
   97    HA   TYR  14           HA       TYR  14   0.935  -1.822  -4.959
   98   1HB   TYR  14          2HB       TYR  14  -0.253  -3.805  -5.802
   99   2HB   TYR  14          1HB       TYR  14  -1.395  -3.703  -4.461
  100    HD1  TYR  14           1HD      TYR  14  -3.419  -2.627  -4.852
  101    HD2  TYR  14           2HD      TYR  14   0.034  -1.493  -7.140
  102    HE1  TYR  14           1HE      TYR  14  -4.804  -1.028  -6.148
  103    HE2  TYR  14           2HE      TYR  14  -1.351   0.107  -8.435
  104    HH   TYR  14           HH       TYR  14  -4.301   0.064  -8.850
  105    H    LYS  15           H        LYS  15  -0.440  -2.757  -1.884
  106    HA   LYS  15           HA       LYS  15  -2.300  -0.595  -1.543
  107   1HB   LYS  15          2HB       LYS  15  -1.703  -2.877  -0.250
  108   2HB   LYS  15          1HB       LYS  15  -0.808  -1.749   0.768
  109   1HG   LYS  15          2HG       LYS  15  -2.738  -1.219   1.792
  110   2HG   LYS  15          1HG       LYS  15  -3.304  -0.528   0.270
  111   1HD   LYS  15          2HD       LYS  15  -4.477  -2.446  -0.325
  112   2HD   LYS  15          1HD       LYS  15  -3.459  -3.497   0.661
  113   1HE   LYS  15          2HE       LYS  15  -5.626  -3.298   1.761
  114   2HE   LYS  15          1HE       LYS  15  -4.449  -2.370   2.713
  115   1HZ   LYS  15          1HZ       LYS  15  -6.674  -1.266   1.924
  116   2HZ   LYS  15          2HZ       LYS  15  -5.813  -1.048   0.476
  117   3HZ   LYS  15          3HZ       LYS  15  -5.226  -0.384   1.925
  118    H    ILE  16           H        ILE  16   1.055  -1.005  -0.342
  119    HA   ILE  16           HA       ILE  16   1.287   1.599   0.820
  120    HB   ILE  16           HB       ILE  16   3.390  -0.237  -0.378
  121   1HG1  ILE  16          2HG1      ILE  16   2.872  -0.194   2.539
  122   2HG1  ILE  16          1HG1      ILE  16   1.590  -0.906   1.560
  123   1HG2  ILE  16          1HG2      ILE  16   3.580   2.336   0.818
  124   2HG2  ILE  16          2HG2      ILE  16   4.899   1.253   0.374
  125   3HG2  ILE  16          3HG2      ILE  16   4.197   1.172   1.990
  126   1HD1  ILE  16          1HD1      ILE  16   4.255  -1.766   0.714
  127   2HD1  ILE  16          2HD1      ILE  16   2.828  -2.735   1.084
  128   3HD1  ILE  16          3HD1      ILE  16   3.898  -2.206   2.384
  129    H    ASN  17           H        ASN  17   1.342   0.548  -2.480
  130    HA   ASN  17           HA       ASN  17   2.978   2.670  -3.577
  131   1HB   ASN  17          2HB       ASN  17   1.434   0.374  -4.419
  132   2HB   ASN  17          1HB       ASN  17   1.112   1.742  -5.485
  133   1HD2  ASN  17          1HD2      ASN  17   2.622  -0.588  -6.325
  134   2HD2  ASN  17          2HD2      ASN  17   4.211  -0.083  -6.642
  135    H    LYS  18           H        LYS  18  -0.568   2.193  -3.366
  136    HA   LYS  18           HA       LYS  18  -1.308   4.668  -4.586
  137   1HB   LYS  18          2HB       LYS  18  -3.478   4.124  -3.731
  138   2HB   LYS  18          1HB       LYS  18  -2.688   2.581  -4.053
  139   1HG   LYS  18          2HG       LYS  18  -1.888   3.063  -1.480
  140   2HG   LYS  18          1HG       LYS  18  -3.498   3.782  -1.482
  141   1HD   LYS  18          2HD       LYS  18  -2.999   1.027  -2.610
  142   2HD   LYS  18          1HD       LYS  18  -3.341   1.278  -0.897
  143   1HE   LYS  18          2HE       LYS  18  -5.527   1.989  -1.299
  144   2HE   LYS  18          1HE       LYS  18  -5.156   2.525  -2.949
  145   1HZ   LYS  18          1HZ       LYS  18  -4.519   0.004  -3.205
  146   2HZ   LYS  18          2HZ       LYS  18  -6.125   0.525  -3.404
  147   3HZ   LYS  18          3HZ       LYS  18  -5.635  -0.185  -1.942
  148    H    ILE  19           H        ILE  19  -0.227   3.897  -1.345
  149    HA   ILE  19           HA       ILE  19  -1.167   6.390  -0.142
  150    HB   ILE  19           HB       ILE  19   0.745   4.185   0.681
  151   1HG1  ILE  19          2HG1      ILE  19  -1.938   4.842   1.885
  152   2HG1  ILE  19          1HG1      ILE  19  -1.834   3.869   0.416
  153   1HG2  ILE  19          1HG2      ILE  19  -0.382   6.398   2.420
  154   2HG2  ILE  19          2HG2      ILE  19   1.250   6.418   1.753
  155   3HG2  ILE  19          3HG2      ILE  19   0.779   5.156   2.892
  156   1HD1  ILE  19          1HD1      ILE  19  -0.282   2.317   1.594
  157   2HD1  ILE  19          2HD1      ILE  19  -1.866   2.394   2.364
  158   3HD1  ILE  19          3HD1      ILE  19  -0.499   3.258   3.069
  159    H    VAL  20           H        VAL  20   2.056   5.098  -1.057
  160    HA   VAL  20           HA       VAL  20   3.491   7.520  -0.454
  161    HB   VAL  20           HB       VAL  20   4.174   5.355  -2.462
  162   1HG1  VAL  20          1HG1      VAL  20   5.801   7.238  -0.738
  163   2HG1  VAL  20          2HG1      VAL  20   5.748   7.177  -2.499
  164   3HG1  VAL  20          3HG1      VAL  20   6.498   5.862  -1.594
  165   1HG2  VAL  20          1HG2      VAL  20   3.505   4.999   0.243
  166   2HG2  VAL  20          2HG2      VAL  20   5.267   4.994   0.204
  167   3HG2  VAL  20          3HG2      VAL  20   4.361   3.853  -0.789
  168    H    GLU  21           H        GLU  21   2.252   6.173  -3.532
  169    HA   GLU  21           HA       GLU  21   3.133   7.981  -5.414
  170   1HB   GLU  21          2HB       GLU  21   1.566   6.035  -5.705
  171   2HB   GLU  21          1HB       GLU  21   0.263   7.049  -5.084
  172   1HG   GLU  21          2HG       GLU  21   1.592   8.548  -7.101
  173   2HG   GLU  21          1HG       GLU  21   1.311   6.933  -7.754
  174    H    ARG  22           H        ARG  22   0.494   8.536  -3.077
  175    HA   ARG  22           HA       ARG  22  -0.576  10.954  -3.913
  176   1HB   ARG  22          2HB       ARG  22  -0.004   9.598  -1.342
  177   2HB   ARG  22          1HB       ARG  22  -0.318  11.328  -1.214
  178   1HG   ARG  22          2HG       ARG  22  -2.500  11.125  -1.895
  179   2HG   ARG  22          1HG       ARG  22  -2.147   9.770  -2.969
  180   1HD   ARG  22          2HD       ARG  22  -3.257   8.614  -1.293
  181   2HD   ARG  22          1HD       ARG  22  -1.624   8.580  -0.598
  182    HE   ARG  22           HE       ARG  22  -2.476  10.944   0.361
  183   1HH1  ARG  22          1HH1      ARG  22  -2.707   8.284   1.909
  184   2HH1  ARG  22          2HH1      ARG  22  -4.345   8.385   2.462
  185   1HH2  ARG  22          1HH2      ARG  22  -5.207  10.934   0.275
  186   2HH2  ARG  22          2HH2      ARG  22  -5.762   9.885   1.538
  187    H    ARG  23           H        ARG  23   2.519  10.480  -2.197
  188    HA   ARG  23           HA       ARG  23   3.301  13.097  -1.670
  189   1HB   ARG  23          2HB       ARG  23   4.687  11.257  -1.048
  190   2HB   ARG  23          1HB       ARG  23   4.790  10.678  -2.711
  191   1HG   ARG  23          2HG       ARG  23   5.723  13.441  -2.397
  192   2HG   ARG  23          1HG       ARG  23   6.670  12.280  -1.467
  193   1HD   ARG  23          2HD       ARG  23   7.285  11.052  -3.396
  194   2HD   ARG  23          1HD       ARG  23   5.984  11.768  -4.369
  195    HE   ARG  23           HE       ARG  23   7.254  13.995  -3.955
  196   1HH1  ARG  23          1HH2      ARG  23   9.126  11.472  -2.865
  197   2HH1  ARG  23          2HH2      ARG  23  10.491  11.792  -3.881
  198   1HH2  ARG  23          1HH1      ARG  23   8.843  14.171  -5.793
  199   2HH2  ARG  23          2HH1      ARG  23  10.331  13.322  -5.538
  200    H    ARG  24           H        ARG  24   3.813  11.355  -4.765
  201    HA   ARG  24           HA       ARG  24   4.834  13.677  -6.158
  202   1HB   ARG  24          2HB       ARG  24   4.996  11.083  -6.591
  203   2HB   ARG  24          1HB       ARG  24   3.488  11.325  -7.473
  204   1HG   ARG  24          2HG       ARG  24   4.582  12.231  -9.220
  205   2HG   ARG  24          1HG       ARG  24   5.402  13.385  -8.167
  206   1HD   ARG  24          2HD       ARG  24   7.041  11.922  -9.325
  207   2HD   ARG  24          1HD       ARG  24   7.069  11.625  -7.574
  208    HE   ARG  24           HE       ARG  24   5.454   9.707  -8.062
  209   1HH1  ARG  24          1HH1      ARG  24   5.068  10.216 -10.965
  210   2HH1  ARG  24          2HH1      ARG  24   6.195   9.119 -11.693
  211   1HH2  ARG  24          1HH2      ARG  24   7.998   8.617  -8.773
  212   2HH2  ARG  24          2HH2      ARG  24   7.852   8.213 -10.453
  213    H    ALA  25           H        ALA  25   1.657  12.007  -6.244
  214    HA   ALA  25           HA       ALA  25   0.260  13.569  -8.060
  215   1HB   ALA  25          1HB       ALA  25  -0.321  12.069  -5.573
  216   2HB   ALA  25          2HB       ALA  25  -1.101  11.965  -7.152
  217   3HB   ALA  25          3HB       ALA  25  -1.555  13.244  -6.027
  218    H    GLU  26           H        GLU  26   1.237  14.423  -4.773
  219    HA   GLU  26           HA       GLU  26  -0.205  16.962  -4.778
  220   1HB   GLU  26          2HB       GLU  26   1.592  15.389  -2.981
  221   2HB   GLU  26          1HB       GLU  26   1.433  17.118  -2.671
  222   1HG   GLU  26          2HG       GLU  26  -1.068  16.816  -2.696
  223   2HG   GLU  26          1HG       GLU  26  -0.801  15.075  -2.785
  224    H    GLY  27           H        GLY  27   3.029  15.795  -5.533
  225   1HA   GLY  27          2HA       GLY  27   4.541  17.028  -6.964
  226   2HA   GLY  27          1HA       GLY  27   3.719  18.519  -6.499
  227    H    ALA  28           H        ALA  28   4.472  16.276  -3.977
  228    HA   ALA  28           HA       ALA  28   5.879  18.053  -2.341
  229   1HB   ALA  28          1HB       ALA  28   6.753  15.206  -2.395
  230   2HB   ALA  28          2HB       ALA  28   5.024  15.495  -2.197
  231   3HB   ALA  28          3HB       ALA  28   6.170  16.172  -1.040
  232    H    LYS  29           H        LYS  29   8.320  17.703  -1.734
  233    HA   LYS  29           HA       LYS  29  10.007  17.208  -4.145
  234   1HB   LYS  29          2HB       LYS  29  11.160  19.428  -3.524
  235   2HB   LYS  29          1HB       LYS  29   9.573  19.545  -4.284
  236   1HG   LYS  29          2HG       LYS  29   8.500  20.067  -2.253
  237   2HG   LYS  29          1HG       LYS  29   9.835  19.443  -1.284
  238   1HD   LYS  29          2HD       LYS  29  11.201  21.335  -2.538
  239   2HD   LYS  29          1HD       LYS  29   9.603  22.056  -2.730
  240   1HE   LYS  29          2HE       LYS  29   9.242  21.987  -0.302
  241   2HE   LYS  29          1HE       LYS  29  10.813  21.191  -0.077
  242   1HZ   LYS  29          1HZ       LYS  29  11.206  23.491   0.199
  243   2HZ   LYS  29          2HZ       LYS  29  10.286  23.897  -1.171
  244   3HZ   LYS  29          3HZ       LYS  29  11.781  23.112  -1.352
  245    H    SER  30           H        SER  30   9.450  16.395  -1.069
  246    HA   SER  30           HA       SER  30  12.337  16.360  -0.271
  247   1HB   SER  30          2HB       SER  30   9.865  15.920   1.426
  248   2HB   SER  30          1HB       SER  30  11.500  16.260   1.990
  249    HG   SER  30           HG       SER  30  10.899  18.269   1.893
  250    H    THR  31           H        THR  31  13.326  14.373  -0.096
  251    HA   THR  31           HA       THR  31  12.022  11.987  -1.072
  252    HB   THR  31           HB       THR  31  14.504  11.860   0.576
  253    HG1  THR  31           1HG      THR  31  15.631  12.897  -1.149
  254   1HG2  THR  31          1HG2      THR  31  15.224  10.397  -1.146
  255   2HG2  THR  31          2HG2      THR  31  14.039  11.032  -2.289
  256   3HG2  THR  31          3HG2      THR  31  13.510  10.033  -0.935
  257    H    ASP  32           H        ASP  32  11.748  13.526   1.892
  258    HA   ASP  32           HA       ASP  32  11.929  11.605   3.904
  259   1HB   ASP  32          2HB       ASP  32  11.098  14.125   3.753
  260   2HB   ASP  32          1HB       ASP  32   9.506  13.364   3.706
  261    H    VAL  33           H        VAL  33   9.502  11.890   1.357
  262    HA   VAL  33           HA       VAL  33   7.939   9.633   2.518
  263    HB   VAL  33           HB       VAL  33   7.517  11.667   0.318
  264   1HG1  VAL  33          1HG1      VAL  33   5.107  10.362   0.642
  265   2HG1  VAL  33          2HG1      VAL  33   6.268   9.036   0.713
  266   3HG1  VAL  33          3HG1      VAL  33   6.229  10.098  -0.694
  267   1HG2  VAL  33          1HG2      VAL  33   6.073  12.692   1.793
  268   2HG2  VAL  33          2HG2      VAL  33   7.153  11.937   2.967
  269   3HG2  VAL  33          3HG2      VAL  33   5.616  11.172   2.563
  270    H    SER  34           H        SER  34   7.841   7.630   1.488
  271    HA   SER  34           HA       SER  34   8.630   7.158  -1.245
  272   1HB   SER  34          2HB       SER  34  10.784   7.807   0.018
  273   2HB   SER  34          1HB       SER  34  10.634   6.252   0.830
  274    HG   SER  34           HG       SER  34  10.992   5.228  -1.035
  275    H    PHE  35           H        PHE  35   8.521   4.845  -1.764
  276    HA   PHE  35           HA       PHE  35   6.514   3.359  -0.512
  277   1HB   PHE  35          2HB       PHE  35   7.751   3.026  -2.735
  278   2HB   PHE  35          1HB       PHE  35   8.980   2.171  -1.802
  279    HD1  PHE  35           1HD      PHE  35   8.264   0.180  -0.374
  280    HD2  PHE  35           2HD      PHE  35   5.731   1.953  -3.356
  281    HE1  PHE  35           1HE      PHE  35   6.869  -1.869  -0.406
  282    HE2  PHE  35           2HE      PHE  35   4.336  -0.096  -3.390
  283    HZ   PHE  35           HZ       PHE  35   4.905  -2.008  -1.914
  284    H    SER  36           H        SER  36  10.016   2.651  -0.150
  285    HA   SER  36           HA       SER  36   9.832   0.810   1.967
  286   1HB   SER  36          2HB       SER  36  11.954   0.995   1.070
  287   2HB   SER  36          1HB       SER  36  11.836   2.745   0.897
  288    HG   SER  36           HG       SER  36  12.513   1.186   3.131
  289    H    SER  37           H        SER  37   9.741   4.351   2.067
  290    HA   SER  37           HA       SER  37   9.977   4.572   4.950
  291   1HB   SER  37          2HB       SER  37  10.009   6.790   4.421
  292   2HB   SER  37          1HB       SER  37  10.097   6.225   2.755
  293    HG   SER  37           HG       SER  37   8.241   7.702   3.768
  294    H    ILE  38           H        ILE  38   7.171   4.965   2.740
  295    HA   ILE  38           HA       ILE  38   5.180   5.196   4.760
  296    HB   ILE  38           HB       ILE  38   5.209   4.197   1.904
  297   1HG1  ILE  38          2HG1      ILE  38   5.708   6.631   2.526
  298   2HG1  ILE  38          1HG1      ILE  38   4.389   6.385   1.381
  299   1HG2  ILE  38          1HG2      ILE  38   2.992   4.296   3.900
  300   2HG2  ILE  38          2HG2      ILE  38   3.233   3.194   2.543
  301   3HG2  ILE  38          3HG2      ILE  38   2.630   4.826   2.258
  302   1HD1  ILE  38          1HD1      ILE  38   2.922   7.347   2.787
  303   2HD1  ILE  38          2HD1      ILE  38   4.269   7.744   3.854
  304   3HD1  ILE  38          3HD1      ILE  38   3.379   6.238   4.081
  305    H    SER  39           H        SER  39   6.335   2.301   2.994
  306    HA   SER  39           HA       SER  39   4.654   0.327   4.005
  307   1HB   SER  39          2HB       SER  39   6.423  -1.159   3.433
  308   2HB   SER  39          1HB       SER  39   6.669   0.243   2.395
  309    HG   SER  39           HG       SER  39   8.497  -0.700   3.766
  310    H    THR  40           H        THR  40   7.549   1.691   5.600
  311    HA   THR  40           HA       THR  40   7.692   0.094   7.892
  312    HB   THR  40           HB       THR  40   8.055   3.083   7.518
  313    HG1  THR  40           1HG      THR  40  10.082   1.158   7.724
  314   1HG2  THR  40          1HG2      THR  40   8.729   1.237   9.799
  315   2HG2  THR  40          2HG2      THR  40   7.960   2.823   9.856
  316   3HG2  THR  40          3HG2      THR  40   9.684   2.690   9.499
  317    H    MET  41           H        MET  41   6.101   3.305   7.955
  318    HA   MET  41           HA       MET  41   4.672   2.961  10.348
  319   1HB   MET  41          2HB       MET  41   3.314   4.808   9.506
  320   2HB   MET  41          1HB       MET  41   4.984   5.051   8.996
  321   1HG   MET  41          2HG       MET  41   4.525   4.546   6.775
  322   2HG   MET  41          1HG       MET  41   3.134   3.544   7.182
  323   1HE   MET  41          1HE       MET  41   0.665   5.439   5.742
  324   2HE   MET  41          2HE       MET  41   0.397   4.864   7.385
  325   3HE   MET  41          3HE       MET  41   1.424   3.939   6.292
  326    H    LEU  42           H        LEU  42   4.039   1.618   7.191
  327    HA   LEU  42           HA       LEU  42   1.242   1.025   7.531
  328   1HB   LEU  42          2HB       LEU  42   3.344   0.700   5.628
  329   2HB   LEU  42          1HB       LEU  42   2.584  -0.876   5.860
  330    HG   LEU  42           HG       LEU  42   0.413   0.823   5.773
  331   1HD1  LEU  42          1HD1      LEU  42   2.679   2.087   4.427
  332   2HD1  LEU  42          2HD1      LEU  42   1.100   2.760   4.831
  333   3HD1  LEU  42          3HD1      LEU  42   1.310   1.835   3.344
  334   1HD2  LEU  42          1HD2      LEU  42   0.648  -0.008   3.171
  335   2HD2  LEU  42          2HD2      LEU  42   0.059  -1.023   4.487
  336   3HD2  LEU  42          3HD2      LEU  42   1.749  -1.115   3.991
  337    H    LEU  43           H        LEU  43   3.967  -1.316   7.515
  338    HA   LEU  43           HA       LEU  43   2.418  -3.362   8.830
  339   1HB   LEU  43          2HB       LEU  43   4.282  -3.877   7.368
  340   2HB   LEU  43          1HB       LEU  43   5.389  -2.958   8.392
  341    HG   LEU  43           HG       LEU  43   4.109  -4.746  10.132
  342   1HD1  LEU  43          1HD1      LEU  43   3.355  -6.355   8.685
  343   2HD1  LEU  43          2HD1      LEU  43   5.041  -6.870   8.732
  344   3HD1  LEU  43          3HD1      LEU  43   4.463  -5.867   7.401
  345   1HD2  LEU  43          1HD2      LEU  43   6.428  -4.050  10.327
  346   2HD2  LEU  43          2HD2      LEU  43   6.831  -4.812   8.789
  347   3HD2  LEU  43          3HD2      LEU  43   6.394  -5.807  10.177
  348    H    GLU  44           H        GLU  44   4.495  -0.773  10.041
  349    HA   GLU  44           HA       GLU  44   4.929  -1.870  12.673
  350   1HB   GLU  44          2HB       GLU  44   5.127   0.748  11.255
  351   2HB   GLU  44          1HB       GLU  44   5.034   0.817  13.015
  352   1HG   GLU  44          2HG       GLU  44   6.906  -0.863  13.108
  353   2HG   GLU  44          1HG       GLU  44   7.064  -0.706  11.359
  354    H    LEU  45           H        LEU  45   2.438   0.090  11.160
  355    HA   LEU  45           HA       LEU  45   0.842   0.104  13.672
  356   1HB   LEU  45          2HB       LEU  45   0.319   2.188  12.952
  357   2HB   LEU  45          1HB       LEU  45   1.474   1.958  11.649
  358    HG   LEU  45           HG       LEU  45  -0.545   0.751  10.457
  359   1HD1  LEU  45          1HD1      LEU  45  -1.831   1.199  12.761
  360   2HD1  LEU  45          2HD1      LEU  45  -2.671   1.225  11.211
  361   3HD1  LEU  45          3HD1      LEU  45  -2.177   2.737  11.970
  362   1HD2  LEU  45          1HD2      LEU  45  -0.192   3.730  10.838
  363   2HD2  LEU  45          2HD2      LEU  45  -1.313   3.055   9.656
  364   3HD2  LEU  45          3HD2      LEU  45   0.416   2.729   9.520
  365    H    GLY  46           H        GLY  46   1.313  -1.992  11.238
  366   1HA   GLY  46          2HA       GLY  46   0.004  -3.682  10.270
  367   2HA   GLY  46          1HA       GLY  46  -1.153  -3.383  11.570
  368    H    LEU  47           H        LEU  47  -0.200  -0.782   9.489
  369    HA   LEU  47           HA       LEU  47  -1.643   0.676   8.272
  370   1HB   LEU  47          2HB       LEU  47  -2.042  -0.360   6.132
  371   2HB   LEU  47          1HB       LEU  47  -0.556  -1.053   6.776
  372    HG   LEU  47           HG       LEU  47  -3.048  -2.483   7.510
  373   1HD1  LEU  47          1HD1      LEU  47  -2.382  -1.841   4.739
  374   2HD1  LEU  47          2HD1      LEU  47  -3.837  -2.587   5.397
  375   3HD1  LEU  47          3HD1      LEU  47  -2.426  -3.580   5.034
  376   1HD2  LEU  47          1HD2      LEU  47  -1.543  -4.135   7.853
  377   2HD2  LEU  47          2HD2      LEU  47  -0.286  -2.941   7.527
  378   3HD2  LEU  47          3HD2      LEU  47  -0.893  -3.960   6.223
  379    H    ARG  48           H        ARG  48  -3.048  -0.536  10.570
  380    HA   ARG  48           HA       ARG  48  -5.651  -1.481   9.683
  381   1HB   ARG  48          2HB       ARG  48  -4.383  -1.854  11.897
  382   2HB   ARG  48          1HB       ARG  48  -4.942  -0.242  12.349
  383   1HG   ARG  48          2HG       ARG  48  -7.277  -0.941  11.999
  384   2HG   ARG  48          1HG       ARG  48  -6.731  -2.549  11.523
  385   1HD   ARG  48          2HD       ARG  48  -5.700  -2.854  13.766
  386   2HD   ARG  48          1HD       ARG  48  -6.315  -1.260  14.246
  387    HE   ARG  48           HE       ARG  48  -8.140  -3.455  13.331
  388   1HH1  ARG  48          1HH2      ARG  48  -9.098  -0.593  13.793
  389   2HH1  ARG  48          2HH2      ARG  48  -9.764  -0.719  15.388
  390   1HH2  ARG  48          1HH1      ARG  48  -8.206  -3.737  16.086
  391   2HH2  ARG  48          2HH1      ARG  48  -9.259  -2.499  16.684
  392    H    VAL  49           H        VAL  49  -4.228   1.647   9.965
  393    HA   VAL  49           HA       VAL  49  -6.380   3.302  10.693
  394    HB   VAL  49           HB       VAL  49  -5.174   4.916   9.057
  395   1HG1  VAL  49          1HG1      VAL  49  -3.969   5.428  10.889
  396   2HG1  VAL  49          2HG1      VAL  49  -3.021   3.949  10.745
  397   3HG1  VAL  49          3HG1      VAL  49  -4.556   3.933  11.614
  398   1HG2  VAL  49          1HG2      VAL  49  -3.235   4.180   7.969
  399   2HG2  VAL  49          2HG2      VAL  49  -4.305   2.793   7.770
  400   3HG2  VAL  49          3HG2      VAL  49  -3.062   2.774   9.021
  401    H    TYR  50           H        TYR  50  -5.726   4.010   7.404
  402    HA   TYR  50           HA       TYR  50  -8.316   4.261   6.501
  403   1HB   TYR  50          2HB       TYR  50  -7.201   3.541   4.229
  404   2HB   TYR  50          1HB       TYR  50  -6.617   4.980   5.063
  405    HD1  TYR  50           1HD      TYR  50  -6.004   1.297   4.753
  406    HD2  TYR  50           2HD      TYR  50  -4.361   5.153   5.696
  407    HE1  TYR  50           1HE      TYR  50  -3.742   0.295   4.912
  408    HE2  TYR  50           2HE      TYR  50  -2.099   4.150   5.854
  409    HH   TYR  50           HH       TYR  50  -1.280   1.549   6.410
  410    H    GLU  51           H        GLU  51  -6.505   1.207   6.777
  411    HA   GLU  51           HA       GLU  51  -8.284  -0.435   5.284
  412   1HB   GLU  51          2HB       GLU  51  -5.880  -0.639   6.494
  413   2HB   GLU  51          1HB       GLU  51  -6.875  -1.501   7.665
  414   1HG   GLU  51          2HG       GLU  51  -7.597  -2.271   4.981
  415   2HG   GLU  51          1HG       GLU  51  -5.864  -2.486   5.227
  416    H    ALA  52           H        ALA  52  -8.733   1.157   8.281
  417    HA   ALA  52           HA       ALA  52 -10.346  -0.719   9.714
  418   1HB   ALA  52          1HB       ALA  52 -10.836   2.249   9.716
  419   2HB   ALA  52          2HB       ALA  52  -9.288   1.630  10.289
  420   3HB   ALA  52          3HB       ALA  52 -10.785   1.134  11.081
  421    H    GLN  53           H        GLN  53 -11.328   1.974   7.562
  422    HA   GLN  53           HA       GLN  53 -14.091   0.999   7.490
  423   1HB   GLN  53          2HB       GLN  53 -12.657   3.255   6.058
  424   2HB   GLN  53          1HB       GLN  53 -14.407   3.042   6.134
  425   1HG   GLN  53          2HG       GLN  53 -14.188   3.109   8.667
  426   2HG   GLN  53          1HG       GLN  53 -12.520   3.626   8.427
  427   1HE2  GLN  53          1HE2      GLN  53 -15.868   4.657   8.266
  428   2HE2  GLN  53          2HE2      GLN  53 -15.552   6.270   7.842
  429    H    MET  54           H        MET  54 -11.215   0.406   5.760
  430    HA   MET  54           HA       MET  54 -12.614  -0.250   3.221
  431   1HB   MET  54          2HB       MET  54  -9.737  -0.094   4.152
  432   2HB   MET  54          1HB       MET  54 -10.175  -0.709   2.557
  433   1HG   MET  54          2HG       MET  54 -11.408   1.877   3.340
  434   2HG   MET  54          1HG       MET  54  -9.672   1.905   3.030
  435   1HE   MET  54          1HE       MET  54 -12.479   2.835   0.028
  436   2HE   MET  54          2HE       MET  54 -11.392   3.689   1.120
  437   3HE   MET  54          3HE       MET  54 -12.720   2.738   1.778
  438    H    GLU  55           H        GLU  55 -12.902  -1.832   5.817
  439    HA   GLU  55           HA       GLU  55 -11.479  -4.286   5.711
  440   1HB   GLU  55          2HB       GLU  55 -14.153  -3.352   6.726
  441   2HB   GLU  55          1HB       GLU  55 -13.729  -5.061   6.834
  442   1HG   GLU  55          2HG       GLU  55 -11.888  -2.884   7.837
  443   2HG   GLU  55          1HG       GLU  55 -13.123  -3.614   8.862
  444    H    ARG  56           H        ARG  56 -13.044  -6.406   5.337
  445    HA   ARG  56           HA       ARG  56 -13.308  -6.697   2.505
  446   1HB   ARG  56          2HB       ARG  56 -14.261  -8.217   4.936
  447   2HB   ARG  56          1HB       ARG  56 -14.599  -8.794   3.305
  448   1HG   ARG  56          2HG       ARG  56 -11.817  -8.011   3.567
  449   2HG   ARG  56          1HG       ARG  56 -12.248  -9.222   4.775
  450   1HD   ARG  56          2HD       ARG  56 -13.121  -9.610   1.918
  451   2HD   ARG  56          1HD       ARG  56 -11.471 -10.046   2.409
  452    HE   ARG  56           HE       ARG  56 -13.897 -11.107   3.816
  453   1HH1  ARG  56          1HH2      ARG  56 -10.899 -11.349   4.701
  454   2HH1  ARG  56          2HH2      ARG  56 -10.597 -12.995   4.253
  455   1HH2  ARG  56          1HH1      ARG  56 -13.441 -13.259   2.287
  456   2HH2  ARG  56          2HH1      ARG  56 -12.036 -14.075   2.886
  Start of MODEL    7
    1   1H    ALA   2          1H        ALA   2  18.737 -14.457 -17.412
    2   2H    ALA   2          2H        ALA   2  19.142 -13.038 -16.571
    3   3H    ALA   2          3H        ALA   2  17.517 -13.385 -16.924
    4    HA   ALA   2           HA       ALA   2  18.035 -15.554 -15.545
    5   1HB   ALA   2          1HB       ALA   2  20.062 -13.438 -14.774
    6   2HB   ALA   2          2HB       ALA   2  20.381 -15.090 -15.301
    7   3HB   ALA   2          3HB       ALA   2  19.656 -14.793 -13.721
    8    H    LYS   3           H        LYS   3  15.813 -15.000 -15.132
    9    HA   LYS   3           HA       LYS   3  15.450 -12.962 -12.961
   10   1HB   LYS   3          2HB       LYS   3  14.152 -13.307 -15.625
   11   2HB   LYS   3          1HB       LYS   3  13.116 -12.802 -14.290
   12   1HG   LYS   3          2HG       LYS   3  14.248 -10.796 -13.987
   13   2HG   LYS   3          1HG       LYS   3  15.744 -11.417 -14.686
   14   1HD   LYS   3          2HD       LYS   3  13.740 -11.570 -16.703
   15   2HD   LYS   3          1HD       LYS   3  13.651  -9.959 -15.990
   16   1HE   LYS   3          2HE       LYS   3  16.353 -11.092 -16.667
   17   2HE   LYS   3          1HE       LYS   3  15.350 -10.399 -17.960
   18   1HZ   LYS   3          1HZ       LYS   3  15.955  -9.054 -15.378
   19   2HZ   LYS   3          2HZ       LYS   3  15.080  -8.398 -16.678
   20   3HZ   LYS   3          3HZ       LYS   3  16.740  -8.716 -16.844
   21    H    VAL   4           H        VAL   4  13.370 -13.368 -11.737
   22    HA   VAL   4           HA       VAL   4  12.854 -16.311 -11.524
   23    HB   VAL   4           HB       VAL   4  12.693 -13.996  -9.574
   24   1HG1  VAL   4          1HG1      VAL   4  11.146 -16.358  -9.576
   25   2HG1  VAL   4          2HG1      VAL   4  11.345 -15.217  -8.246
   26   3HG1  VAL   4          3HG1      VAL   4  12.415 -16.612  -8.378
   27   1HG2  VAL   4          1HG2      VAL   4  14.798 -15.685 -10.367
   28   2HG2  VAL   4          2HG2      VAL   4  14.260 -16.320  -8.812
   29   3HG2  VAL   4          3HG2      VAL   4  14.767 -14.637  -8.949
   30    H    GLN   5           H        GLN   5  10.728 -17.033 -11.713
   31    HA   GLN   5           HA       GLN   5   8.756 -15.691 -13.129
   32   1HB   GLN   5          2HB       GLN   5   8.709 -17.805 -10.979
   33   2HB   GLN   5          1HB       GLN   5   7.212 -17.279 -11.749
   34   1HG   GLN   5          2HG       GLN   5   7.791 -18.166 -13.803
   35   2HG   GLN   5          1HG       GLN   5   9.520 -17.967 -13.517
   36   1HE2  GLN   5          1HE2      GLN   5   7.021 -19.633 -11.522
   37   2HE2  GLN   5          2HE2      GLN   5   7.813 -21.134 -11.520
   38    H    ALA   6           H        ALA   6   6.559 -14.948 -12.223
   39    HA   ALA   6           HA       ALA   6   6.909 -13.388  -9.685
   40   1HB   ALA   6          1HB       ALA   6   6.228 -12.578 -12.468
   41   2HB   ALA   6          2HB       ALA   6   7.083 -11.678 -11.216
   42   3HB   ALA   6          3HB       ALA   6   5.323 -11.785 -11.179
   43    H    TYR   7           H        TYR   7   5.525 -14.641  -8.392
   44    HA   TYR   7           HA       TYR   7   2.802 -15.259  -9.463
   45   1HB   TYR   7          2HB       TYR   7   4.751 -16.482  -7.617
   46   2HB   TYR   7          1HB       TYR   7   3.084 -16.544  -7.045
   47    HD1  TYR   7           1HD      TYR   7   1.447 -16.867  -9.359
   48    HD2  TYR   7           2HD      TYR   7   5.341 -18.515  -8.598
   49    HE1  TYR   7           1HE      TYR   7   0.972 -18.719 -10.937
   50    HE2  TYR   7           2HE      TYR   7   4.864 -20.368 -10.178
   51    HH   TYR   7           HH       TYR   7   2.596 -21.512 -11.037
   52    H    VAL   8           H        VAL   8   1.347 -15.444  -7.163
   53    HA   VAL   8           HA       VAL   8   0.782 -12.693  -6.493
   54    HB   VAL   8           HB       VAL   8  -0.940 -14.394  -6.545
   55   1HG1  VAL   8          1HG1      VAL   8   1.081 -15.975  -5.324
   56   2HG1  VAL   8          2HG1      VAL   8  -0.520 -16.493  -5.854
   57   3HG1  VAL   8          3HG1      VAL   8  -0.280 -15.925  -4.202
   58   1HG2  VAL   8          1HG2      VAL   8  -0.842 -14.149  -3.613
   59   2HG2  VAL   8          2HG2      VAL   8  -2.058 -13.566  -4.748
   60   3HG2  VAL   8          3HG2      VAL   8  -0.597 -12.623  -4.461
   61    H    SER   9           H        SER   9   2.778 -11.867  -5.571
   62    HA   SER   9           HA       SER   9   3.863 -13.139  -3.139
   63   1HB   SER   9          2HB       SER   9   5.665 -11.693  -3.515
   64   2HB   SER   9          1HB       SER   9   5.041 -11.907  -5.148
   65    HG   SER   9           HG       SER   9   5.274  -9.725  -4.786
   66    H    ASP  10           H        ASP  10   4.583 -10.771  -1.761
   67    HA   ASP  10           HA       ASP  10   2.402 -10.331  -0.027
   68   1HB   ASP  10          2HB       ASP  10   4.847  -8.682  -0.725
   69   2HB   ASP  10          1HB       ASP  10   3.806  -8.333   0.656
   70    H    GLU  11           H        GLU  11   0.608  -9.953  -1.591
   71    HA   GLU  11           HA       GLU  11   0.255  -8.002  -3.493
   72   1HB   GLU  11          2HB       GLU  11  -1.327  -9.650  -1.955
   73   2HB   GLU  11          1HB       GLU  11  -1.882  -8.051  -1.462
   74   1HG   GLU  11          2HG       GLU  11  -2.743  -7.559  -3.528
   75   2HG   GLU  11          1HG       GLU  11  -1.489  -8.463  -4.379
   76    H    ILE  12           H        ILE  12   0.539  -7.470  -0.006
   77    HA   ILE  12           HA       ILE  12  -0.382  -4.824   0.237
   78    HB   ILE  12           HB       ILE  12   1.846  -6.415   1.515
   79   1HG1  ILE  12          2HG1      ILE  12  -0.944  -5.537   2.294
   80   2HG1  ILE  12          1HG1      ILE  12  -0.335  -7.182   2.119
   81   1HG2  ILE  12          1HG2      ILE  12   1.969  -4.623   3.239
   82   2HG2  ILE  12          2HG2      ILE  12   0.908  -3.622   2.248
   83   3HG2  ILE  12          3HG2      ILE  12   2.512  -4.059   1.659
   84   1HD1  ILE  12          1HD1      ILE  12  -0.090  -7.068   4.383
   85   2HD1  ILE  12          2HD1      ILE  12  -0.070  -5.305   4.390
   86   3HD1  ILE  12          3HD1      ILE  12   1.393  -6.201   3.986
   87    H    VAL  13           H        VAL  13   2.593  -6.031  -1.221
   88    HA   VAL  13           HA       VAL  13   4.271  -3.824  -1.273
   89    HB   VAL  13           HB       VAL  13   4.852  -5.928  -2.297
   90   1HG1  VAL  13          1HG1      VAL  13   3.585  -7.034  -3.864
   91   2HG1  VAL  13          2HG1      VAL  13   3.051  -5.543  -4.638
   92   3HG1  VAL  13          3HG1      VAL  13   2.294  -6.076  -3.137
   93   1HG2  VAL  13          1HG2      VAL  13   5.745  -3.751  -3.300
   94   2HG2  VAL  13          2HG2      VAL  13   4.571  -3.980  -4.596
   95   3HG2  VAL  13          3HG2      VAL  13   5.843  -5.174  -4.336
   96    H    TYR  14           H        TYR  14   1.558  -4.410  -3.554
   97    HA   TYR  14           HA       TYR  14   1.860  -1.846  -4.875
   98   1HB   TYR  14          2HB       TYR  14   0.664  -4.192  -5.452
   99   2HB   TYR  14          1HB       TYR  14  -0.738  -3.311  -4.841
  100    HD1  TYR  14           1HD      TYR  14  -0.588  -0.655  -5.666
  101    HD2  TYR  14           2HD      TYR  14   0.858  -4.110  -7.769
  102    HE1  TYR  14           1HE      TYR  14  -0.747   0.583  -7.809
  103    HE2  TYR  14           2HE      TYR  14   0.699  -2.872  -9.913
  104    HH   TYR  14           HH       TYR  14  -1.019  -0.463 -10.521
  105    H    LYS  15           H        LYS  15  -0.028  -3.046  -2.142
  106    HA   LYS  15           HA       LYS  15  -1.913  -0.957  -1.855
  107   1HB   LYS  15          2HB       LYS  15  -1.563  -3.207  -0.613
  108   2HB   LYS  15          1HB       LYS  15  -0.470  -2.299   0.435
  109   1HG   LYS  15          2HG       LYS  15  -2.226  -0.798   1.103
  110   2HG   LYS  15          1HG       LYS  15  -3.319  -1.438  -0.125
  111   1HD   LYS  15          2HD       LYS  15  -3.596  -3.487   1.022
  112   2HD   LYS  15          1HD       LYS  15  -2.165  -3.221   2.019
  113   1HE   LYS  15          2HE       LYS  15  -3.282  -1.844   3.491
  114   2HE   LYS  15          1HE       LYS  15  -4.348  -1.193   2.230
  115   1HZ   LYS  15          1HZ       LYS  15  -4.549  -3.735   3.694
  116   2HZ   LYS  15          2HZ       LYS  15  -5.153  -3.646   2.109
  117   3HZ   LYS  15          3HZ       LYS  15  -5.767  -2.619   3.314
  118    H    ILE  16           H        ILE  16   1.375  -1.210  -0.442
  119    HA   ILE  16           HA       ILE  16   1.436   1.227   0.971
  120    HB   ILE  16           HB       ILE  16   3.610  -0.195  -0.603
  121   1HG1  ILE  16          2HG1      ILE  16   2.436  -1.627   1.042
  122   2HG1  ILE  16          1HG1      ILE  16   4.089  -1.288   1.557
  123   1HG2  ILE  16          1HG2      ILE  16   4.325   1.229   1.864
  124   2HG2  ILE  16          2HG2      ILE  16   3.751   2.296   0.583
  125   3HG2  ILE  16          3HG2      ILE  16   5.126   1.231   0.294
  126   1HD1  ILE  16          1HD1      ILE  16   1.519  -0.385   2.735
  127   2HD1  ILE  16          2HD1      ILE  16   2.817   0.809   2.701
  128   3HD1  ILE  16          3HD1      ILE  16   3.058  -0.733   3.523
  129    H    ASN  17           H        ASN  17   2.328   0.622  -2.445
  130    HA   ASN  17           HA       ASN  17   3.236   3.118  -3.252
  131   1HB   ASN  17          2HB       ASN  17   1.436   1.061  -4.541
  132   2HB   ASN  17          1HB       ASN  17   1.995   2.476  -5.433
  133   1HD2  ASN  17          1HD2      ASN  17   2.871   0.047  -6.405
  134   2HD2  ASN  17          2HD2      ASN  17   4.507  -0.200  -6.023
  135    H    LYS  18           H        LYS  18  -0.212   2.119  -3.238
  136    HA   LYS  18           HA       LYS  18  -1.474   4.434  -4.066
  137   1HB   LYS  18          2HB       LYS  18  -2.066   2.390  -1.933
  138   2HB   LYS  18          1HB       LYS  18  -3.202   3.705  -2.240
  139   1HG   LYS  18          2HG       LYS  18  -3.947   2.725  -4.129
  140   2HG   LYS  18          1HG       LYS  18  -2.302   2.491  -4.725
  141   1HD   LYS  18          2HD       LYS  18  -2.531   0.289  -4.317
  142   2HD   LYS  18          1HD       LYS  18  -2.614   0.666  -2.595
  143   1HE   LYS  18          2HE       LYS  18  -4.801   0.082  -2.549
  144   2HE   LYS  18          1HE       LYS  18  -5.163   1.244  -3.842
  145   1HZ   LYS  18          1HZ       LYS  18  -4.871  -0.304  -5.455
  146   2HZ   LYS  18          2HZ       LYS  18  -5.348  -1.361  -4.214
  147   3HZ   LYS  18          3HZ       LYS  18  -3.701  -1.169  -4.585
  148    H    ILE  19           H        ILE  19  -0.171   3.815  -0.798
  149    HA   ILE  19           HA       ILE  19  -1.029   6.406   0.238
  150    HB   ILE  19           HB       ILE  19   1.022   4.432   1.289
  151   1HG1  ILE  19          2HG1      ILE  19  -1.189   3.381   0.712
  152   2HG1  ILE  19          1HG1      ILE  19  -0.822   3.336   2.436
  153   1HG2  ILE  19          1HG2      ILE  19  -0.657   5.729   3.247
  154   2HG2  ILE  19          2HG2      ILE  19   0.121   6.942   2.230
  155   3HG2  ILE  19          3HG2      ILE  19   1.100   5.764   3.103
  156   1HD1  ILE  19          1HD1      ILE  19  -2.467   4.847   2.967
  157   2HD1  ILE  19          2HD1      ILE  19  -3.187   4.210   1.488
  158   3HD1  ILE  19          3HD1      ILE  19  -2.292   5.729   1.449
  159    H    VAL  20           H        VAL  20   1.923   5.078  -1.187
  160    HA   VAL  20           HA       VAL  20   3.656   7.284  -0.474
  161    HB   VAL  20           HB       VAL  20   3.881   5.398  -2.833
  162   1HG1  VAL  20          1HG1      VAL  20   6.137   5.870  -2.784
  163   2HG1  VAL  20          2HG1      VAL  20   6.143   6.172  -1.047
  164   3HG1  VAL  20          3HG1      VAL  20   5.524   7.398  -2.153
  165   1HG2  VAL  20          1HG2      VAL  20   5.263   4.305  -0.653
  166   2HG2  VAL  20          2HG2      VAL  20   3.768   3.691  -1.359
  167   3HG2  VAL  20          3HG2      VAL  20   3.706   4.801   0.008
  168    H    GLU  21           H        GLU  21   1.920   6.432  -3.490
  169    HA   GLU  21           HA       GLU  21   2.714   8.591  -5.106
  170   1HB   GLU  21          2HB       GLU  21   0.909   6.469  -5.159
  171   2HB   GLU  21          1HB       GLU  21  -0.119   7.891  -5.330
  172   1HG   GLU  21          2HG       GLU  21   0.468   7.481  -7.550
  173   2HG   GLU  21          1HG       GLU  21   1.706   8.645  -7.072
  174    H    ARG  22           H        ARG  22  -0.215   8.446  -3.028
  175    HA   ARG  22           HA       ARG  22  -1.244  10.998  -3.401
  176   1HB   ARG  22          2HB       ARG  22  -1.388   8.873  -1.509
  177   2HB   ARG  22          1HB       ARG  22  -1.241  10.375  -0.595
  178   1HG   ARG  22          2HG       ARG  22  -3.540  10.304  -0.917
  179   2HG   ARG  22          1HG       ARG  22  -3.046  11.231  -2.334
  180   1HD   ARG  22          2HD       ARG  22  -4.518   9.528  -3.168
  181   2HD   ARG  22          1HD       ARG  22  -2.882   8.955  -3.551
  182    HE   ARG  22           HE       ARG  22  -3.187   7.233  -1.964
  183   1HH1  ARG  22          1HH2      ARG  22  -6.175   8.403  -2.325
  184   2HH1  ARG  22          2HH2      ARG  22  -6.698   8.234  -0.685
  185   1HH2  ARG  22          1HH1      ARG  22  -3.516   7.625   0.549
  186   2HH2  ARG  22          2HH1      ARG  22  -5.194   7.795   0.944
  187    H    ARG  23           H        ARG  23   1.308  10.117  -1.039
  188    HA   ARG  23           HA       ARG  23   1.818  12.598   0.123
  189   1HB   ARG  23          2HB       ARG  23   3.588  10.307  -0.747
  190   2HB   ARG  23          1HB       ARG  23   4.239  11.680   0.149
  191   1HG   ARG  23          2HG       ARG  23   1.760  10.422   1.222
  192   2HG   ARG  23          1HG       ARG  23   3.260   9.510   1.389
  193   1HD   ARG  23          2HD       ARG  23   3.482  10.780   3.299
  194   2HD   ARG  23          1HD       ARG  23   4.102  11.994   2.161
  195    HE   ARG  23           HE       ARG  23   2.101  13.203   2.475
  196   1HH1  ARG  23          1HH1      ARG  23   1.822  11.433   5.015
  197   2HH1  ARG  23          2HH1      ARG  23   0.167  10.949   4.865
  198   1HH2  ARG  23          1HH2      ARG  23  -0.094  11.918   1.546
  199   2HH2  ARG  23          2HH2      ARG  23  -0.920  11.224   2.901
  200    H    ARG  24           H        ARG  24   3.916  11.405  -2.519
  201    HA   ARG  24           HA       ARG  24   4.913  13.977  -3.235
  202   1HB   ARG  24          2HB       ARG  24   5.042  11.217  -4.097
  203   2HB   ARG  24          1HB       ARG  24   4.946  12.281  -5.501
  204   1HG   ARG  24          2HG       ARG  24   6.967  13.286  -5.051
  205   2HG   ARG  24          1HG       ARG  24   6.792  13.094  -3.306
  206   1HD   ARG  24          2HD       ARG  24   7.149  10.602  -3.636
  207   2HD   ARG  24          1HD       ARG  24   7.587  10.966  -5.317
  208    HE   ARG  24           HE       ARG  24   9.185  11.631  -2.952
  209   1HH1  ARG  24          1HH2      ARG  24   9.385  11.100  -6.188
  210   2HH1  ARG  24          2HH2      ARG  24  10.457  12.412  -6.551
  211   1HH2  ARG  24          1HH1      ARG  24  10.157  13.875  -3.423
  212   2HH2  ARG  24          2HH1      ARG  24  10.896  13.981  -4.986
  213    H    ALA  25           H        ALA  25   2.262  12.040  -4.658
  214    HA   ALA  25           HA       ALA  25   1.499  13.581  -6.829
  215   1HB   ALA  25          1HB       ALA  25   0.264  11.629  -6.345
  216   2HB   ALA  25          2HB       ALA  25  -0.890  12.914  -5.987
  217   3HB   ALA  25          3HB       ALA  25  -0.021  12.117  -4.675
  218    H    GLU  26           H        GLU  26   0.858  14.266  -3.396
  219    HA   GLU  26           HA       GLU  26  -0.523  16.774  -4.065
  220   1HB   GLU  26          2HB       GLU  26   0.182  15.414  -1.449
  221   2HB   GLU  26          1HB       GLU  26  -0.879  16.815  -1.608
  222   1HG   GLU  26          2HG       GLU  26  -1.977  15.082  -3.431
  223   2HG   GLU  26          1HG       GLU  26  -1.423  13.973  -2.176
  224    H    GLY  27           H        GLY  27   2.646  15.671  -3.169
  225   1HA   GLY  27          2HA       GLY  27   4.651  16.894  -3.001
  226   2HA   GLY  27          1HA       GLY  27   3.747  18.343  -3.445
  227    H    ALA  28           H        ALA  28   3.141  16.160  -0.705
  228    HA   ALA  28           HA       ALA  28   3.443  18.523   1.107
  229   1HB   ALA  28          1HB       ALA  28   2.146  15.896   1.800
  230   2HB   ALA  28          2HB       ALA  28   1.295  17.054   0.778
  231   3HB   ALA  28          3HB       ALA  28   1.774  17.507   2.414
  232    H    LYS  29           H        LYS  29   5.818  17.235   0.286
  233    HA   LYS  29           HA       LYS  29   7.176  16.722   2.703
  234   1HB   LYS  29          2HB       LYS  29   5.463  14.579   1.775
  235   2HB   LYS  29          1HB       LYS  29   7.143  14.040   1.809
  236   1HG   LYS  29          2HG       LYS  29   6.966  15.425   4.168
  237   2HG   LYS  29          1HG       LYS  29   5.349  14.735   4.042
  238   1HD   LYS  29          2HD       LYS  29   6.556  12.517   3.473
  239   2HD   LYS  29          1HD       LYS  29   7.998  13.299   4.122
  240   1HE   LYS  29          2HE       LYS  29   6.794  11.986   5.871
  241   2HE   LYS  29          1HE       LYS  29   6.810  13.719   6.258
  242   1HZ   LYS  29          1HZ       LYS  29   4.631  13.967   5.711
  243   2HZ   LYS  29          2HZ       LYS  29   4.570  12.342   6.203
  244   3HZ   LYS  29          3HZ       LYS  29   4.654  12.730   4.551
  245    H    SER  30           H        SER  30   9.329  16.885   2.165
  246    HA   SER  30           HA       SER  30  10.273  17.162  -0.491
  247   1HB   SER  30          2HB       SER  30  11.331  16.883   2.241
  248   2HB   SER  30          1HB       SER  30  12.452  16.342   0.995
  249    HG   SER  30           HG       SER  30  11.569  18.498   0.002
  250    H    THR  31           H        THR  31  12.523  15.450  -0.647
  251    HA   THR  31           HA       THR  31  11.332  13.069  -1.801
  252    HB   THR  31           HB       THR  31  13.728  12.513  -2.206
  253    HG1  THR  31           1HG      THR  31  15.263  14.018  -1.409
  254   1HG2  THR  31          1HG2      THR  31  13.282  15.468  -2.647
  255   2HG2  THR  31          2HG2      THR  31  12.409  14.239  -3.562
  256   3HG2  THR  31          3HG2      THR  31  14.168  14.336  -3.670
  257    H    ASP  32           H        ASP  32  10.450  12.989   0.803
  258    HA   ASP  32           HA       ASP  32  12.259  11.121   2.266
  259   1HB   ASP  32          2HB       ASP  32  11.058  13.331   3.128
  260   2HB   ASP  32          1HB       ASP  32   9.692  12.236   3.343
  261    H    VAL  33           H        VAL  33   9.117  11.380   0.702
  262    HA   VAL  33           HA       VAL  33   8.000   8.919   1.734
  263    HB   VAL  33           HB       VAL  33   7.452  10.563  -0.760
  264   1HG1  VAL  33          1HG1      VAL  33   5.646   8.581   0.655
  265   2HG1  VAL  33          2HG1      VAL  33   6.565   8.201  -0.802
  266   3HG1  VAL  33          3HG1      VAL  33   5.311   9.442  -0.848
  267   1HG2  VAL  33          1HG2      VAL  33   6.096  11.897   0.534
  268   2HG2  VAL  33          2HG2      VAL  33   7.235  11.413   1.790
  269   3HG2  VAL  33          3HG2      VAL  33   5.685  10.585   1.640
  270    H    SER  34           H        SER  34   7.685   6.940   0.475
  271    HA   SER  34           HA       SER  34   8.836   6.321  -2.030
  272   1HB   SER  34          2HB       SER  34  10.699   6.600   0.231
  273   2HB   SER  34          1HB       SER  34  10.868   5.072  -0.630
  274    HG   SER  34           HG       SER  34  11.916   6.214  -2.044
  275    H    PHE  35           H        PHE  35   8.468   4.108  -2.522
  276    HA   PHE  35           HA       PHE  35   6.555   2.622  -1.181
  277   1HB   PHE  35          2HB       PHE  35   7.340   2.024  -3.376
  278   2HB   PHE  35          1HB       PHE  35   8.981   1.767  -2.782
  279    HD1  PHE  35           1HD      PHE  35   9.639  -0.432  -2.408
  280    HD2  PHE  35           2HD      PHE  35   5.491   0.610  -2.007
  281    HE1  PHE  35           1HE      PHE  35   9.093  -2.800  -1.908
  282    HE2  PHE  35           2HE      PHE  35   4.946  -1.758  -1.506
  283    HZ   PHE  35           HZ       PHE  35   6.746  -3.462  -1.457
  284    H    SER  36           H        SER  36  10.095   2.196  -0.791
  285    HA   SER  36           HA       SER  36   9.914   0.288   1.343
  286   1HB   SER  36          2HB       SER  36  11.898   0.625  -0.051
  287   2HB   SER  36          1HB       SER  36  12.053   2.281   0.528
  288    HG   SER  36           HG       SER  36  12.138   1.209   2.692
  289    H    SER  37           H        SER  37   9.814   3.808   1.274
  290    HA   SER  37           HA       SER  37  10.241   4.123   4.153
  291   1HB   SER  37          2HB       SER  37  10.905   5.843   2.560
  292   2HB   SER  37          1HB       SER  37   9.263   5.945   1.933
  293    HG   SER  37           HG       SER  37   8.949   7.362   3.443
  294    H    ILE  38           H        ILE  38   7.410   4.605   1.984
  295    HA   ILE  38           HA       ILE  38   5.531   5.020   4.126
  296    HB   ILE  38           HB       ILE  38   5.301   4.164   1.227
  297   1HG1  ILE  38          2HG1      ILE  38   6.207   6.454   1.807
  298   2HG1  ILE  38          1HG1      ILE  38   4.727   6.482   0.846
  299   1HG2  ILE  38          1HG2      ILE  38   3.318   4.022   3.276
  300   2HG2  ILE  38          2HG2      ILE  38   3.108   3.764   1.546
  301   3HG2  ILE  38          3HG2      ILE  38   2.906   5.378   2.228
  302   1HD1  ILE  38          1HD1      ILE  38   3.416   6.747   2.960
  303   2HD1  ILE  38          2HD1      ILE  38   4.517   8.092   2.662
  304   3HD1  ILE  38          3HD1      ILE  38   4.935   6.856   3.848
  305    H    SER  39           H        SER  39   6.962   2.153   2.784
  306    HA   SER  39           HA       SER  39   4.900   0.251   3.391
  307   1HB   SER  39          2HB       SER  39   7.827   0.289   2.834
  308   2HB   SER  39          1HB       SER  39   7.181  -1.173   3.573
  309    HG   SER  39           HG       SER  39   7.141  -0.666   1.083
  310    H    THR  40           H        THR  40   7.979   0.695   5.171
  311    HA   THR  40           HA       THR  40   7.319  -0.707   7.499
  312    HB   THR  40           HB       THR  40   8.935   1.840   7.165
  313    HG1  THR  40           1HG      THR  40  10.003   0.485   5.955
  314   1HG2  THR  40          1HG2      THR  40   9.550   1.652   9.323
  315   2HG2  THR  40          2HG2      THR  40   9.875  -0.072   9.140
  316   3HG2  THR  40          3HG2      THR  40   8.243   0.483   9.514
  317    H    MET  41           H        MET  41   6.542   2.672   6.678
  318    HA   MET  41           HA       MET  41   5.526   3.459   9.212
  319   1HB   MET  41          2HB       MET  41   5.124   5.386   8.066
  320   2HB   MET  41          1HB       MET  41   5.963   4.583   6.748
  321   1HG   MET  41          2HG       MET  41   3.958   5.362   5.768
  322   2HG   MET  41          1HG       MET  41   3.633   3.663   6.089
  323   1HE   MET  41          1HE       MET  41   1.620   6.493   5.819
  324   2HE   MET  41          2HE       MET  41   0.297   5.680   6.652
  325   3HE   MET  41          3HE       MET  41   1.285   4.785   5.501
  326    H    LEU  42           H        LEU  42   3.927   1.849   6.478
  327    HA   LEU  42           HA       LEU  42   1.270   1.874   7.605
  328   1HB   LEU  42          2HB       LEU  42   2.496   1.217   5.220
  329   2HB   LEU  42          1HB       LEU  42   2.010  -0.361   5.838
  330    HG   LEU  42           HG       LEU  42  -0.045   1.735   6.126
  331   1HD1  LEU  42          1HD1      LEU  42  -0.347   2.306   3.949
  332   2HD1  LEU  42          2HD1      LEU  42   0.033   0.682   3.378
  333   3HD1  LEU  42          3HD1      LEU  42   1.334   1.815   3.743
  334   1HD2  LEU  42          1HD2      LEU  42   0.137  -1.133   5.191
  335   2HD2  LEU  42          2HD2      LEU  42  -1.352  -0.204   5.012
  336   3HD2  LEU  42          3HD2      LEU  42  -0.682  -0.497   6.617
  337    H    LEU  43           H        LEU  43   4.036  -0.306   7.902
  338    HA   LEU  43           HA       LEU  43   2.597  -2.503   9.103
  339   1HB   LEU  43          2HB       LEU  43   4.802  -2.628   7.962
  340   2HB   LEU  43          1HB       LEU  43   5.514  -1.695   9.281
  341    HG   LEU  43           HG       LEU  43   4.184  -3.678  10.640
  342   1HD1  LEU  43          1HD1      LEU  43   4.337  -5.724   9.536
  343   2HD1  LEU  43          2HD1      LEU  43   5.583  -5.150   8.430
  344   3HD1  LEU  43          3HD1      LEU  43   3.907  -4.653   8.203
  345   1HD2  LEU  43          1HD2      LEU  43   6.566  -4.758  10.652
  346   2HD2  LEU  43          2HD2      LEU  43   6.375  -3.128  11.297
  347   3HD2  LEU  43          3HD2      LEU  43   7.022  -3.363   9.674
  348    H    GLU  44           H        GLU  44   4.550   0.169  10.507
  349    HA   GLU  44           HA       GLU  44   4.392  -0.600  13.220
  350   1HB   GLU  44          2HB       GLU  44   5.156   1.573  13.613
  351   2HB   GLU  44          1HB       GLU  44   5.552   1.396  11.906
  352   1HG   GLU  44          2HG       GLU  44   3.283   2.431  11.397
  353   2HG   GLU  44          1HG       GLU  44   3.166   2.818  13.111
  354    H    LEU  45           H        LEU  45   2.052   0.952  11.123
  355    HA   LEU  45           HA       LEU  45   0.112   1.465  13.268
  356   1HB   LEU  45          2HB       LEU  45   0.638   2.179  10.522
  357   2HB   LEU  45          1HB       LEU  45  -1.028   1.617  10.673
  358    HG   LEU  45           HG       LEU  45   0.090   3.556  12.681
  359   1HD1  LEU  45          1HD1      LEU  45  -0.409   4.042   9.829
  360   2HD1  LEU  45          2HD1      LEU  45   0.428   5.050  11.011
  361   3HD1  LEU  45          3HD1      LEU  45  -1.331   5.110  10.887
  362   1HD2  LEU  45          1HD2      LEU  45  -2.570   4.126  12.015
  363   2HD2  LEU  45          2HD2      LEU  45  -2.018   3.246  13.440
  364   3HD2  LEU  45          3HD2      LEU  45  -2.478   2.364  11.985
  365    H    GLY  46           H        GLY  46   1.050  -1.226  11.404
  366   1HA   GLY  46          2HA       GLY  46   0.121  -3.370  11.210
  367   2HA   GLY  46          1HA       GLY  46  -1.025  -2.905  12.467
  368    H    LEU  47           H        LEU  47  -0.576  -1.327   9.312
  369    HA   LEU  47           HA       LEU  47  -2.245  -0.788   7.706
  370   1HB   LEU  47          2HB       LEU  47  -2.632  -3.747   8.250
  371   2HB   LEU  47          1HB       LEU  47  -3.230  -2.906   6.819
  372    HG   LEU  47           HG       LEU  47  -0.447  -2.274   7.205
  373   1HD1  LEU  47          1HD1      LEU  47   0.379  -4.632   6.704
  374   2HD1  LEU  47          2HD1      LEU  47  -1.204  -5.203   7.228
  375   3HD1  LEU  47          3HD1      LEU  47  -0.157  -4.352   8.361
  376   1HD2  LEU  47          1HD2      LEU  47  -1.795  -2.170   5.093
  377   2HD2  LEU  47          2HD2      LEU  47  -1.837  -3.934   5.078
  378   3HD2  LEU  47          3HD2      LEU  47  -0.299  -3.086   4.911
  379    H    ARG  48           H        ARG  48  -3.127  -0.204  10.400
  380    HA   ARG  48           HA       ARG  48  -5.762  -1.340  10.874
  381   1HB   ARG  48          2HB       ARG  48  -3.850   0.510  12.089
  382   2HB   ARG  48          1HB       ARG  48  -5.525   1.006  12.337
  383   1HG   ARG  48          2HG       ARG  48  -5.231  -1.857  12.703
  384   2HG   ARG  48          1HG       ARG  48  -4.138  -0.970  13.767
  385   1HD   ARG  48          2HD       ARG  48  -6.012   0.375  14.620
  386   2HD   ARG  48          1HD       ARG  48  -7.126  -0.459  13.517
  387    HE   ARG  48           HE       ARG  48  -6.135  -1.543  15.997
  388   1HH1  ARG  48          1HH1      ARG  48  -8.627  -2.478  14.634
  389   2HH1  ARG  48          2HH1      ARG  48  -8.184  -4.067  14.108
  390   1HH2  ARG  48          1HH2      ARG  48  -4.778  -3.533  14.489
  391   2HH2  ARG  48          2HH2      ARG  48  -6.006  -4.665  14.027
  392    H    VAL  49           H        VAL  49  -5.118   2.146  10.629
  393    HA   VAL  49           HA       VAL  49  -7.593   3.102  10.000
  394    HB   VAL  49           HB       VAL  49  -4.882   3.826   8.869
  395   1HG1  VAL  49          1HG1      VAL  49  -6.485   4.788   7.360
  396   2HG1  VAL  49          2HG1      VAL  49  -5.975   6.077   8.452
  397   3HG1  VAL  49          3HG1      VAL  49  -7.530   5.280   8.692
  398   1HG2  VAL  49          1HG2      VAL  49  -4.791   5.392  10.654
  399   2HG2  VAL  49          2HG2      VAL  49  -5.430   3.921  11.387
  400   3HG2  VAL  49          3HG2      VAL  49  -6.518   5.247  10.976
  401    H    TYR  50           H        TYR  50  -5.490   3.075   7.203
  402    HA   TYR  50           HA       TYR  50  -7.214   3.011   5.125
  403   1HB   TYR  50          2HB       TYR  50  -5.381   0.957   4.433
  404   2HB   TYR  50          1HB       TYR  50  -5.264   2.668   4.052
  405    HD1  TYR  50           1HD      TYR  50  -4.832   0.571   7.160
  406    HD2  TYR  50           2HD      TYR  50  -3.208   3.574   4.555
  407    HE1  TYR  50           1HE      TYR  50  -2.852   0.793   8.640
  408    HE2  TYR  50           2HE      TYR  50  -1.229   3.793   6.033
  409    HH   TYR  50           HH       TYR  50  -0.238   3.101   7.886
  410    H    GLU  51           H        GLU  51  -6.734   0.224   7.261
  411    HA   GLU  51           HA       GLU  51  -8.047  -1.702   5.604
  412   1HB   GLU  51          2HB       GLU  51  -6.733  -1.414   8.102
  413   2HB   GLU  51          1HB       GLU  51  -8.261  -2.206   8.402
  414   1HG   GLU  51          2HG       GLU  51  -6.934  -3.233   6.017
  415   2HG   GLU  51          1HG       GLU  51  -5.947  -3.426   7.465
  416    H    ALA  52           H        ALA  52  -9.184   0.630   8.021
  417    HA   ALA  52           HA       ALA  52 -11.757  -0.336   8.587
  418   1HB   ALA  52          1HB       ALA  52 -11.043   2.550   7.998
  419   2HB   ALA  52          2HB       ALA  52 -10.506   1.714   9.455
  420   3HB   ALA  52          3HB       ALA  52 -12.228   1.952   9.159
  421    H    GLN  53           H        GLN  53 -10.561   1.212   5.650
  422    HA   GLN  53           HA       GLN  53 -13.001   1.918   4.403
  423   1HB   GLN  53          2HB       GLN  53 -10.466   0.785   3.175
  424   2HB   GLN  53          1HB       GLN  53 -11.654   1.798   2.355
  425   1HG   GLN  53          2HG       GLN  53 -10.581   2.907   4.883
  426   2HG   GLN  53          1HG       GLN  53  -9.421   2.780   3.560
  427   1HE2  GLN  53          1HE2      GLN  53 -11.628   4.894   4.878
  428   2HE2  GLN  53          2HE2      GLN  53 -12.012   5.798   3.493
  429    H    MET  54           H        MET  54 -11.501  -1.228   4.862
  430    HA   MET  54           HA       MET  54 -12.332  -3.397   4.422
  431   1HB   MET  54          2HB       MET  54 -14.917  -1.948   3.794
  432   2HB   MET  54          1HB       MET  54 -14.721  -3.574   4.448
  433   1HG   MET  54          2HG       MET  54 -13.341  -1.901   6.232
  434   2HG   MET  54          1HG       MET  54 -14.836  -1.043   5.859
  435   1HE   MET  54          1HE       MET  54 -13.763  -2.020   8.439
  436   2HE   MET  54          2HE       MET  54 -14.820  -3.139   9.298
  437   3HE   MET  54          3HE       MET  54 -15.448  -1.584   8.759
  438    H    GLU  55           H        GLU  55 -10.976  -2.138   2.293
  439    HA   GLU  55           HA       GLU  55 -12.643  -2.628  -0.123
  440   1HB   GLU  55          2HB       GLU  55 -10.511  -0.876   0.688
  441   2HB   GLU  55          1HB       GLU  55 -10.019  -1.774  -0.746
  442   1HG   GLU  55          2HG       GLU  55 -11.159   0.277  -1.434
  443   2HG   GLU  55          1HG       GLU  55 -12.157  -1.115  -1.852
  444    H    ARG  56           H        ARG  56 -11.509  -4.712   1.663
  445    HA   ARG  56           HA       ARG  56  -9.855  -6.183  -0.364
  446   1HB   ARG  56          2HB       ARG  56  -9.007  -5.303   2.042
  447   2HB   ARG  56          1HB       ARG  56  -9.694  -6.850   2.535
  448   1HG   ARG  56          2HG       ARG  56  -8.232  -7.321   0.146
  449   2HG   ARG  56          1HG       ARG  56  -7.201  -6.350   1.199
  450   1HD   ARG  56          2HD       ARG  56  -8.691  -8.724   2.318
  451   2HD   ARG  56          1HD       ARG  56  -7.132  -8.940   1.496
  452    HE   ARG  56           HE       ARG  56  -7.513  -7.672   4.089
  453   1HH1  ARG  56          1HH2      ARG  56  -6.301  -5.442   2.628
  454   2HH1  ARG  56          2HH2      ARG  56  -4.603  -5.778   2.720
  455   1HH2  ARG  56          1HH1      ARG  56  -5.040  -9.105   3.594
  456   2HH2  ARG  56          2HH1      ARG  56  -3.890  -7.851   3.267
  Start of MODEL    8
    1   1H    ALA   2          1H        ALA   2   5.178 -11.049 -24.410
    2   2H    ALA   2          2H        ALA   2   5.625 -10.728 -22.802
    3   3H    ALA   2          3H        ALA   2   5.620  -9.478 -23.952
    4    HA   ALA   2           HA       ALA   2   3.207  -9.655 -24.168
    5   1HB   ALA   2          1HB       ALA   2   3.895 -12.138 -22.862
    6   2HB   ALA   2          2HB       ALA   2   2.368 -11.680 -23.618
    7   3HB   ALA   2          3HB       ALA   2   2.663 -11.296 -21.922
    8    H    LYS   3           H        LYS   3   5.072 -10.010 -21.138
    9    HA   LYS   3           HA       LYS   3   4.966  -8.740 -19.136
   10   1HB   LYS   3          2HB       LYS   3   5.022  -6.957 -21.529
   11   2HB   LYS   3          1HB       LYS   3   4.754  -6.192 -19.963
   12   1HG   LYS   3          2HG       LYS   3   7.021  -6.214 -19.809
   13   2HG   LYS   3          1HG       LYS   3   6.801  -7.909 -19.372
   14   1HD   LYS   3          2HD       LYS   3   7.990  -8.484 -21.192
   15   2HD   LYS   3          1HD       LYS   3   6.704  -7.811 -22.195
   16   1HE   LYS   3          2HE       LYS   3   8.474  -6.493 -22.922
   17   2HE   LYS   3          1HE       LYS   3   7.950  -5.514 -21.538
   18   1HZ   LYS   3          1HZ       LYS   3  10.249  -7.300 -21.780
   19   2HZ   LYS   3          2HZ       LYS   3   9.450  -7.273 -20.280
   20   3HZ   LYS   3          3HZ       LYS   3  10.099  -5.841 -20.928
   21    H    VAL   4           H        VAL   4   2.720  -9.779 -18.779
   22    HA   VAL   4           HA       VAL   4   0.609  -7.643 -18.831
   23    HB   VAL   4           HB       VAL   4   0.453 -10.649 -19.215
   24   1HG1  VAL   4          1HG1      VAL   4  -1.442  -9.145 -17.932
   25   2HG1  VAL   4          2HG1      VAL   4  -1.797 -10.594 -18.873
   26   3HG1  VAL   4          3HG1      VAL   4  -1.966  -9.001 -19.610
   27   1HG2  VAL   4          1HG2      VAL   4   0.383  -8.257 -20.974
   28   2HG2  VAL   4          2HG2      VAL   4  -0.810  -9.507 -21.329
   29   3HG2  VAL   4          3HG2      VAL   4   0.910  -9.900 -21.332
   30    H    GLN   5           H        GLN   5   1.475 -10.719 -17.198
   31    HA   GLN   5           HA       GLN   5   1.461  -9.601 -14.551
   32   1HB   GLN   5          2HB       GLN   5  -0.767 -10.634 -13.885
   33   2HB   GLN   5          1HB       GLN   5  -0.889  -9.243 -14.964
   34   1HG   GLN   5          2HG       GLN   5  -1.883 -10.487 -16.554
   35   2HG   GLN   5          1HG       GLN   5  -0.582 -11.678 -16.497
   36   1HE2  GLN   5          1HE2      GLN   5  -2.606 -13.170 -16.816
   37   2HE2  GLN   5          2HE2      GLN   5  -3.375 -13.708 -15.401
   38    H    ALA   6           H        ALA   6   0.621 -11.759 -13.043
   39    HA   ALA   6           HA       ALA   6   1.445 -14.321 -14.120
   40   1HB   ALA   6          1HB       ALA   6   3.603 -13.131 -14.084
   41   2HB   ALA   6          2HB       ALA   6   3.601 -14.428 -12.890
   42   3HB   ALA   6          3HB       ALA   6   3.376 -12.757 -12.375
   43    H    TYR   7           H        TYR   7  -0.515 -14.913 -12.974
   44    HA   TYR   7           HA       TYR   7  -1.710 -15.729 -11.105
   45   1HB   TYR   7          2HB       TYR   7   0.686 -16.783 -11.023
   46   2HB   TYR   7          1HB       TYR   7   0.936 -15.688  -9.663
   47    HD1  TYR   7           1HD      TYR   7  -1.395 -18.311 -10.958
   48    HD2  TYR   7           2HD      TYR   7   0.132 -16.237  -7.519
   49    HE1  TYR   7           1HE      TYR   7  -2.625 -19.870  -9.472
   50    HE2  TYR   7           2HE      TYR   7  -1.097 -17.796  -6.034
   51    HH   TYR   7           HH       TYR   7  -2.099 -19.931  -6.036
   52    H    VAL   8           H        VAL   8  -2.452 -15.073  -8.934
   53    HA   VAL   8           HA       VAL   8  -1.714 -12.236  -8.291
   54    HB   VAL   8           HB       VAL   8  -4.284 -13.826  -8.095
   55   1HG1  VAL   8          1HG1      VAL   8  -5.299 -11.848  -7.073
   56   2HG1  VAL   8          2HG1      VAL   8  -3.749 -11.007  -7.111
   57   3HG1  VAL   8          3HG1      VAL   8  -3.964 -12.412  -6.068
   58   1HG2  VAL   8          1HG2      VAL   8  -3.771 -12.880 -10.300
   59   2HG2  VAL   8          2HG2      VAL   8  -3.487 -11.298  -9.574
   60   3HG2  VAL   8          3HG2      VAL   8  -5.108 -11.993  -9.567
   61    H    SER   9           H        SER   9  -1.006 -11.837  -6.214
   62    HA   SER   9           HA       SER   9  -1.410 -13.964  -4.143
   63   1HB   SER   9          2HB       SER   9   1.170 -12.521  -4.145
   64   2HB   SER   9          1HB       SER   9   0.845 -14.234  -3.898
   65    HG   SER   9           HG       SER   9   1.204 -14.559  -5.942
   66    H    ASP  10           H        ASP  10   0.061 -12.639  -2.132
   67    HA   ASP  10           HA       ASP  10  -1.812 -10.792  -1.075
   68   1HB   ASP  10          2HB       ASP  10   0.032 -10.339   0.537
   69   2HB   ASP  10          1HB       ASP  10  -0.158 -12.065   0.227
   70    H    GLU  11           H        GLU  11  -2.109  -9.361  -3.023
   71    HA   GLU  11           HA       GLU  11  -0.015  -7.676  -4.035
   72   1HB   GLU  11          2HB       GLU  11  -2.623  -8.289  -4.640
   73   2HB   GLU  11          1HB       GLU  11  -2.782  -6.643  -4.025
   74   1HG   GLU  11          2HG       GLU  11  -1.246  -5.786  -5.638
   75   2HG   GLU  11          1HG       GLU  11  -0.707  -7.403  -6.089
   76    H    ILE  12           H        ILE  12   0.619  -7.393  -1.481
   77    HA   ILE  12           HA       ILE  12  -0.812  -5.134  -0.226
   78    HB   ILE  12           HB       ILE  12   1.494  -6.957   0.469
   79   1HG1  ILE  12          2HG1      ILE  12  -0.946  -7.649   0.703
   80   2HG1  ILE  12          1HG1      ILE  12   0.006  -7.740   2.187
   81   1HG2  ILE  12          1HG2      ILE  12   1.245  -5.673   2.762
   82   2HG2  ILE  12          2HG2      ILE  12   0.676  -4.360   1.731
   83   3HG2  ILE  12          3HG2      ILE  12   2.293  -5.027   1.500
   84   1HD1  ILE  12          1HD1      ILE  12  -1.868  -5.495   1.385
   85   2HD1  ILE  12          2HD1      ILE  12  -0.836  -5.472   2.814
   86   3HD1  ILE  12          3HD1      ILE  12  -2.127  -6.666   2.678
   87    H    VAL  13           H        VAL  13   2.615  -5.765  -1.090
   88    HA   VAL  13           HA       VAL  13   3.663  -3.202  -0.826
   89    HB   VAL  13           HB       VAL  13   5.262  -3.960  -2.589
   90   1HG1  VAL  13          1HG1      VAL  13   4.396  -5.571  -0.268
   91   2HG1  VAL  13          2HG1      VAL  13   6.003  -4.972  -0.687
   92   3HG1  VAL  13          3HG1      VAL  13   5.383  -6.441  -1.442
   93   1HG2  VAL  13          1HG2      VAL  13   4.759  -6.317  -3.497
   94   2HG2  VAL  13          2HG2      VAL  13   3.845  -4.985  -4.203
   95   3HG2  VAL  13          3HG2      VAL  13   3.094  -6.028  -2.996
   96    H    TYR  14           H        TYR  14   1.603  -4.443  -3.416
   97    HA   TYR  14           HA       TYR  14   1.979  -2.219  -5.232
   98   1HB   TYR  14          2HB       TYR  14   1.119  -4.588  -5.673
   99   2HB   TYR  14          1HB       TYR  14  -0.411  -4.061  -4.972
  100    HD1  TYR  14           1HD      TYR  14   2.114  -2.648  -7.376
  101    HD2  TYR  14           2HD      TYR  14  -2.021  -3.445  -6.529
  102    HE1  TYR  14           1HE      TYR  14   1.473  -1.622  -9.541
  103    HE2  TYR  14           2HE      TYR  14  -2.662  -2.421  -8.693
  104    HH   TYR  14           HH       TYR  14  -1.001  -0.433 -10.349
  105    H    LYS  15           H        LYS  15  -0.398  -2.960  -2.680
  106    HA   LYS  15           HA       LYS  15  -2.113  -0.697  -3.182
  107   1HB   LYS  15          2HB       LYS  15  -1.777  -2.893  -1.301
  108   2HB   LYS  15          1HB       LYS  15  -2.262  -1.414  -0.471
  109   1HG   LYS  15          2HG       LYS  15  -3.958  -1.265  -2.533
  110   2HG   LYS  15          1HG       LYS  15  -3.740  -3.016  -2.510
  111   1HD   LYS  15          2HD       LYS  15  -4.234  -1.640   0.096
  112   2HD   LYS  15          1HD       LYS  15  -5.599  -1.839  -1.004
  113   1HE   LYS  15          2HE       LYS  15  -4.603  -4.334  -1.157
  114   2HE   LYS  15          1HE       LYS  15  -4.050  -3.915   0.477
  115   1HZ   LYS  15          1HZ       LYS  15  -6.819  -3.687  -0.575
  116   2HZ   LYS  15          2HZ       LYS  15  -6.318  -3.089   0.935
  117   3HZ   LYS  15          3HZ       LYS  15  -6.277  -4.760   0.622
  118    H    ILE  16           H        ILE  16   0.793  -1.183  -1.227
  119    HA   ILE  16           HA       ILE  16   0.620   1.299   0.249
  120    HB   ILE  16           HB       ILE  16   3.036  -0.379  -0.490
  121   1HG1  ILE  16          2HG1      ILE  16   0.964  -0.711   1.700
  122   2HG1  ILE  16          1HG1      ILE  16   1.357  -1.861   0.423
  123   1HG2  ILE  16          1HG2      ILE  16   3.526   1.801   0.570
  124   2HG2  ILE  16          2HG2      ILE  16   3.919   0.464   1.650
  125   3HG2  ILE  16          3HG2      ILE  16   2.441   1.394   1.899
  126   1HD1  ILE  16          1HD1      ILE  16   3.506  -2.318   1.355
  127   2HD1  ILE  16          2HD1      ILE  16   2.382  -2.346   2.714
  128   3HD1  ILE  16          3HD1      ILE  16   3.405  -0.934   2.445
  129    H    ASN  17           H        ASN  17   2.382   0.313  -2.701
  130    HA   ASN  17           HA       ASN  17   3.811   2.695  -3.201
  131   1HB   ASN  17          2HB       ASN  17   3.327   0.251  -4.416
  132   2HB   ASN  17          1HB       ASN  17   2.642   1.402  -5.564
  133   1HD2  ASN  17          1HD2      ASN  17   5.359  -0.244  -5.313
  134   2HD2  ASN  17          2HD2      ASN  17   6.516   0.916  -5.759
  135    H    LYS  18           H        LYS  18   0.422   1.891  -3.895
  136    HA   LYS  18           HA       LYS  18  -0.112   4.270  -5.471
  137   1HB   LYS  18          2HB       LYS  18  -1.698   2.119  -4.079
  138   2HB   LYS  18          1HB       LYS  18  -2.524   3.494  -4.816
  139   1HG   LYS  18          2HG       LYS  18  -1.929   2.881  -6.964
  140   2HG   LYS  18          1HG       LYS  18  -0.454   2.067  -6.436
  141   1HD   LYS  18          2HD       LYS  18  -1.542   0.099  -5.967
  142   2HD   LYS  18          1HD       LYS  18  -3.030   0.914  -5.488
  143   1HE   LYS  18          2HE       LYS  18  -2.169   1.028  -8.370
  144   2HE   LYS  18          1HE       LYS  18  -2.989  -0.422  -7.757
  145   1HZ   LYS  18          1HZ       LYS  18  -4.629   1.174  -6.718
  146   2HZ   LYS  18          2HZ       LYS  18  -4.704   1.029  -8.409
  147   3HZ   LYS  18          3HZ       LYS  18  -3.953   2.380  -7.702
  148    H    ILE  19           H        ILE  19   0.025   3.575  -2.059
  149    HA   ILE  19           HA       ILE  19  -1.609   5.880  -1.255
  150    HB   ILE  19           HB       ILE  19   0.208   3.950   0.223
  151   1HG1  ILE  19          2HG1      ILE  19  -2.818   4.075   0.147
  152   2HG1  ILE  19          1HG1      ILE  19  -1.876   3.055  -0.940
  153   1HG2  ILE  19          1HG2      ILE  19  -1.882   5.229   1.786
  154   2HG2  ILE  19          2HG2      ILE  19  -0.785   6.425   1.094
  155   3HG2  ILE  19          3HG2      ILE  19  -0.151   5.130   2.110
  156   1HD1  ILE  19          1HD1      ILE  19  -1.357   2.911   2.011
  157   2HD1  ILE  19          2HD1      ILE  19  -1.134   1.670   0.780
  158   3HD1  ILE  19          3HD1      ILE  19  -2.756   2.071   1.342
  159    H    VAL  20           H        VAL  20   1.832   5.094  -1.579
  160    HA   VAL  20           HA       VAL  20   2.821   7.453  -0.226
  161    HB   VAL  20           HB       VAL  20   4.191   5.831  -2.384
  162   1HG1  VAL  20          1HG1      VAL  20   4.980   7.844  -0.468
  163   2HG1  VAL  20          2HG1      VAL  20   5.944   7.084  -1.734
  164   3HG1  VAL  20          3HG1      VAL  20   5.833   6.336  -0.141
  165   1HG2  VAL  20          1HG2      VAL  20   4.894   4.589  -0.074
  166   2HG2  VAL  20          2HG2      VAL  20   3.573   4.035  -1.104
  167   3HG2  VAL  20          3HG2      VAL  20   3.231   5.033   0.308
  168    H    GLU  21           H        GLU  21   2.455   6.629  -3.697
  169    HA   GLU  21           HA       GLU  21   3.416   9.039  -4.807
  170   1HB   GLU  21          2HB       GLU  21   1.930   8.373  -6.725
  171   2HB   GLU  21          1HB       GLU  21   2.906   7.041  -6.103
  172   1HG   GLU  21          2HG       GLU  21   1.023   6.197  -4.817
  173   2HG   GLU  21          1HG       GLU  21   0.041   7.589  -5.276
  174    H    ARG  22           H        ARG  22   0.181   8.260  -3.537
  175    HA   ARG  22           HA       ARG  22  -1.346  10.425  -4.385
  176   1HB   ARG  22          2HB       ARG  22  -2.145   8.586  -2.972
  177   2HB   ARG  22          1HB       ARG  22  -1.149   9.158  -1.633
  178   1HG   ARG  22          2HG       ARG  22  -3.306  10.018  -1.163
  179   2HG   ARG  22          1HG       ARG  22  -2.435  11.382  -1.866
  180   1HD   ARG  22          2HD       ARG  22  -3.784   9.672  -3.861
  181   2HD   ARG  22          1HD       ARG  22  -4.884  10.521  -2.754
  182    HE   ARG  22           HE       ARG  22  -3.013  12.449  -3.436
  183   1HH1  ARG  22          1HH2      ARG  22  -3.455  10.352  -5.867
  184   2HH1  ARG  22          2HH2      ARG  22  -4.378  11.387  -6.902
  185   1HH2  ARG  22          1HH1      ARG  22  -4.921  13.788  -4.463
  186   2HH2  ARG  22          2HH1      ARG  22  -5.209  13.332  -6.107
  187    H    ARG  23           H        ARG  23   1.236  10.408  -1.969
  188    HA   ARG  23           HA       ARG  23   0.775  12.964  -0.800
  189   1HB   ARG  23          2HB       ARG  23   3.133  11.150  -1.252
  190   2HB   ARG  23          1HB       ARG  23   3.380  12.739  -0.523
  191   1HG   ARG  23          2HG       ARG  23   2.412  12.122   1.435
  192   2HG   ARG  23          1HG       ARG  23   1.117  11.244   0.621
  193   1HD   ARG  23          2HD       ARG  23   2.495   9.297   0.327
  194   2HD   ARG  23          1HD       ARG  23   3.951  10.181   0.826
  195    HE   ARG  23           HE       ARG  23   3.298   9.771   3.051
  196   1HH1  ARG  23          1HH1      ARG  23   0.888   8.478   1.160
  197   2HH1  ARG  23          2HH1      ARG  23  -0.395   8.709   2.301
  198   1HH2  ARG  23          1HH2      ARG  23   1.508  10.654   4.449
  199   2HH2  ARG  23          2HH2      ARG  23  -0.044   9.942   4.162
  200    H    ARG  24           H        ARG  24   3.640  12.507  -2.827
  201    HA   ARG  24           HA       ARG  24   3.767  15.177  -3.750
  202   1HB   ARG  24          2HB       ARG  24   5.394  14.291  -5.296
  203   2HB   ARG  24          1HB       ARG  24   5.496  13.298  -3.842
  204   1HG   ARG  24          2HG       ARG  24   4.038  11.607  -4.879
  205   2HG   ARG  24          1HG       ARG  24   3.909  12.601  -6.331
  206   1HD   ARG  24          2HD       ARG  24   6.318  12.394  -6.734
  207   2HD   ARG  24          1HD       ARG  24   6.510  11.479  -5.226
  208    HE   ARG  24           HE       ARG  24   5.164   9.679  -6.211
  209   1HH1  ARG  24          1HH1      ARG  24   3.984  11.841  -8.204
  210   2HH1  ARG  24          2HH1      ARG  24   4.556  11.174  -9.697
  211   1HH2  ARG  24          1HH2      ARG  24   6.786   8.998  -8.173
  212   2HH2  ARG  24          2HH2      ARG  24   6.145   9.565  -9.679
  213    H    ALA  25           H        ALA  25   1.928  12.422  -4.963
  214    HA   ALA  25           HA       ALA  25   1.223  13.204  -7.544
  215   1HB   ALA  25          1HB       ALA  25  -0.370  11.988  -5.270
  216   2HB   ALA  25          2HB       ALA  25   0.433  11.145  -6.596
  217   3HB   ALA  25          3HB       ALA  25  -1.011  12.109  -6.908
  218    H    GLU  26           H        GLU  26  -0.267  14.307  -4.477
  219    HA   GLU  26           HA       GLU  26  -2.004  16.203  -5.840
  220   1HB   GLU  26          2HB       GLU  26  -2.838  16.594  -3.662
  221   2HB   GLU  26          1HB       GLU  26  -2.308  14.914  -3.603
  222   1HG   GLU  26          2HG       GLU  26  -0.005  16.107  -2.880
  223   2HG   GLU  26          1HG       GLU  26  -1.142  17.320  -2.290
  224    H    GLY  27           H        GLY  27   1.225  16.246  -4.511
  225   1HA   GLY  27          2HA       GLY  27   2.778  18.015  -5.164
  226   2HA   GLY  27          1HA       GLY  27   1.413  19.133  -5.234
  227    H    ALA  28           H        ALA  28   2.268  16.824  -2.660
  228    HA   ALA  28           HA       ALA  28   1.704  18.614  -0.519
  229   1HB   ALA  28          1HB       ALA  28   2.280  15.975  -0.837
  230   2HB   ALA  28          2HB       ALA  28   2.297  16.785   0.729
  231   3HB   ALA  28          3HB       ALA  28   3.802  16.548  -0.157
  232    H    LYS  29           H        LYS  29   4.022  18.504   1.098
  233    HA   LYS  29           HA       LYS  29   5.959  20.223  -0.417
  234   1HB   LYS  29          2HB       LYS  29   6.061  21.622   1.613
  235   2HB   LYS  29          1HB       LYS  29   4.402  21.509   1.025
  236   1HG   LYS  29          2HG       LYS  29   4.066  19.588   2.647
  237   2HG   LYS  29          1HG       LYS  29   5.639  19.992   3.335
  238   1HD   LYS  29          2HD       LYS  29   4.228  21.246   4.699
  239   2HD   LYS  29          1HD       LYS  29   4.625  22.426   3.451
  240   1HE   LYS  29          2HE       LYS  29   2.288  22.600   3.504
  241   2HE   LYS  29          1HE       LYS  29   2.497  21.367   2.246
  242   1HZ   LYS  29          1HZ       LYS  29   2.177  19.642   3.800
  243   2HZ   LYS  29          2HZ       LYS  29   0.936  20.760   4.112
  244   3HZ   LYS  29          3HZ       LYS  29   2.299  20.694   5.125
  245    H    SER  30           H        SER  30   5.488  18.183   2.488
  246    HA   SER  30           HA       SER  30   8.361  17.386   2.246
  247   1HB   SER  30          2HB       SER  30   6.728  18.357   4.558
  248   2HB   SER  30          1HB       SER  30   7.968  17.148   4.880
  249    HG   SER  30           HG       SER  30   8.238  19.737   3.768
  250    H    THR  31           H        THR  31   5.774  16.209   1.342
  251    HA   THR  31           HA       THR  31   5.792  13.653   2.898
  252    HB   THR  31           HB       THR  31   3.700  13.880   0.921
  253    HG1  THR  31           1HG      THR  31   2.772  15.753   2.219
  254   1HG2  THR  31          1HG2      THR  31   3.569  12.523   2.950
  255   2HG2  THR  31          2HG2      THR  31   2.276  13.722   2.951
  256   3HG2  THR  31          3HG2      THR  31   3.709  13.969   3.950
  257    H    ASP  32           H        ASP  32   7.908  14.247   1.054
  258    HA   ASP  32           HA       ASP  32   7.316  12.863  -1.478
  259   1HB   ASP  32          2HB       ASP  32   8.807  14.881  -1.184
  260   2HB   ASP  32          1HB       ASP  32   9.939  13.846  -0.312
  261    H    VAL  33           H        VAL  33   7.310  11.497   1.301
  262    HA   VAL  33           HA       VAL  33   9.473   9.739   1.661
  263    HB   VAL  33           HB       VAL  33   7.710   8.271   2.686
  264   1HG1  VAL  33          1HG1      VAL  33   7.651   9.672   4.465
  265   2HG1  VAL  33          2HG1      VAL  33   6.790  10.916   3.558
  266   3HG1  VAL  33          3HG1      VAL  33   8.547  10.801   3.447
  267   1HG2  VAL  33          1HG2      VAL  33   6.033   8.885   0.837
  268   2HG2  VAL  33          2HG2      VAL  33   5.757  10.377   1.737
  269   3HG2  VAL  33          3HG2      VAL  33   5.398   8.820   2.482
  270    H    SER  34           H        SER  34   8.708   7.131   1.311
  271    HA   SER  34           HA       SER  34   7.951   6.780  -1.547
  272   1HB   SER  34          2HB       SER  34  10.351   7.094  -1.583
  273   2HB   SER  34          1HB       SER  34  10.566   5.976  -0.240
  274    HG   SER  34           HG       SER  34   9.635   5.400  -2.860
  275    H    PHE  35           H        PHE  35   7.945   4.300  -2.021
  276    HA   PHE  35           HA       PHE  35   6.086   2.964  -0.401
  277   1HB   PHE  35          2HB       PHE  35   6.659   2.352  -2.697
  278   2HB   PHE  35          1HB       PHE  35   8.289   1.900  -2.198
  279    HD1  PHE  35           1HD      PHE  35   5.358   1.235  -0.076
  280    HD2  PHE  35           2HD      PHE  35   8.077  -0.411  -2.966
  281    HE1  PHE  35           1HE      PHE  35   4.559  -1.048   0.471
  282    HE2  PHE  35           2HE      PHE  35   7.277  -2.693  -2.418
  283    HZ   PHE  35           HZ       PHE  35   5.519  -3.012  -0.699
  284    H    SER  36           H        SER  36   9.539   2.013  -0.594
  285    HA   SER  36           HA       SER  36   9.725   0.282   1.544
  286   1HB   SER  36          2HB       SER  36  12.054   1.610   1.801
  287   2HB   SER  36          1HB       SER  36  11.716   0.573   0.418
  288    HG   SER  36           HG       SER  36  12.208   3.173   0.442
  289    H    SER  37           H        SER  37   9.960   3.849   1.775
  290    HA   SER  37           HA       SER  37  10.219   3.899   4.652
  291   1HB   SER  37          2HB       SER  37   9.029   6.157   3.092
  292   2HB   SER  37          1HB       SER  37  10.308   6.189   4.304
  293    HG   SER  37           HG       SER  37  11.611   5.067   2.700
  294    H    ILE  38           H        ILE  38   7.456   4.875   2.574
  295    HA   ILE  38           HA       ILE  38   5.535   5.168   4.623
  296    HB   ILE  38           HB       ILE  38   5.461   4.418   1.700
  297   1HG1  ILE  38          2HG1      ILE  38   6.100   6.732   2.486
  298   2HG1  ILE  38          1HG1      ILE  38   4.680   6.693   1.441
  299   1HG2  ILE  38          1HG2      ILE  38   3.260   4.364   3.693
  300   2HG2  ILE  38          2HG2      ILE  38   3.412   3.505   2.160
  301   3HG2  ILE  38          3HG2      ILE  38   2.914   5.196   2.178
  302   1HD1  ILE  38          1HD1      ILE  38   3.374   7.540   3.069
  303   2HD1  ILE  38          2HD1      ILE  38   4.839   7.810   4.014
  304   3HD1  ILE  38          3HD1      ILE  38   3.922   6.317   4.214
  305    H    SER  39           H        SER  39   6.934   2.272   3.295
  306    HA   SER  39           HA       SER  39   4.784   0.452   4.001
  307   1HB   SER  39          2HB       SER  39   7.733   0.169   3.378
  308   2HB   SER  39          1HB       SER  39   6.684  -1.216   3.659
  309    HG   SER  39           HG       SER  39   7.017   0.143   1.427
  310    H    THR  40           H        THR  40   7.936   1.237   5.517
  311    HA   THR  40           HA       THR  40   7.857  -0.448   7.746
  312    HB   THR  40           HB       THR  40   8.829   2.385   7.319
  313    HG1  THR  40           1HG      THR  40   9.712   0.350   6.316
  314   1HG2  THR  40          1HG2      THR  40   9.006   2.569   9.563
  315   2HG2  THR  40          2HG2      THR  40  10.267   1.341   9.449
  316   3HG2  THR  40          3HG2      THR  40   8.606   0.869   9.807
  317    H    MET  41           H        MET  41   6.672   2.943   7.705
  318    HA   MET  41           HA       MET  41   5.439   2.914  10.258
  319   1HB   MET  41          2HB       MET  41   4.182   4.853   9.313
  320   2HB   MET  41          1HB       MET  41   5.900   4.916   8.921
  321   1HG   MET  41          2HG       MET  41   5.544   4.573   6.691
  322   2HG   MET  41          1HG       MET  41   4.201   3.465   6.975
  323   1HE   MET  41          1HE       MET  41   2.117   3.780   7.175
  324   2HE   MET  41          2HE       MET  41   1.951   4.486   5.569
  325   3HE   MET  41          3HE       MET  41   1.127   5.227   6.938
  326    H    LEU  42           H        LEU  42   4.371   1.600   7.194
  327    HA   LEU  42           HA       LEU  42   1.560   1.398   7.755
  328   1HB   LEU  42          2HB       LEU  42   3.286   0.912   5.663
  329   2HB   LEU  42          1HB       LEU  42   2.804  -0.720   6.129
  330    HG   LEU  42           HG       LEU  42   0.800   1.505   5.704
  331   1HD1  LEU  42          1HD1      LEU  42   0.871  -0.517   3.622
  332   2HD1  LEU  42          2HD1      LEU  42   2.410   0.338   3.722
  333   3HD1  LEU  42          3HD1      LEU  42   0.915   1.239   3.469
  334   1HD2  LEU  42          1HD2      LEU  42   0.262  -1.413   5.337
  335   2HD2  LEU  42          2HD2      LEU  42  -0.805  -0.143   5.936
  336   3HD2  LEU  42          3HD2      LEU  42   0.445  -0.813   6.985
  337    H    LEU  43           H        LEU  43   4.018  -1.224   7.795
  338    HA   LEU  43           HA       LEU  43   2.369  -3.114   9.153
  339   1HB   LEU  43          2HB       LEU  43   4.353  -3.740   7.908
  340   2HB   LEU  43          1HB       LEU  43   5.374  -2.757   8.961
  341    HG   LEU  43           HG       LEU  43   3.852  -4.495  10.625
  342   1HD1  LEU  43          1HD1      LEU  43   5.100  -6.622   9.589
  343   2HD1  LEU  43          2HD1      LEU  43   4.870  -5.718   8.094
  344   3HD1  LEU  43          3HD1      LEU  43   3.477  -6.169   9.076
  345   1HD2  LEU  43          1HD2      LEU  43   5.870  -4.332  11.619
  346   2HD2  LEU  43          2HD2      LEU  43   6.571  -3.664  10.145
  347   3HD2  LEU  43          3HD2      LEU  43   6.531  -5.410  10.390
  348    H    GLU  44           H        GLU  44   4.486  -0.549  10.370
  349    HA   GLU  44           HA       GLU  44   4.615  -1.386  13.098
  350   1HB   GLU  44          2HB       GLU  44   6.138   0.264  12.496
  351   2HB   GLU  44          1HB       GLU  44   4.995   1.071  11.430
  352   1HG   GLU  44          2HG       GLU  44   4.296   2.454  13.064
  353   2HG   GLU  44          1HG       GLU  44   4.149   1.128  14.212
  354    H    LEU  45           H        LEU  45   2.294   0.363  11.153
  355    HA   LEU  45           HA       LEU  45   0.538   0.892  13.490
  356   1HB   LEU  45          2HB       LEU  45   0.525   2.789  12.196
  357   2HB   LEU  45          1HB       LEU  45   0.993   1.912  10.742
  358    HG   LEU  45           HG       LEU  45  -1.344   1.016  10.598
  359   1HD1  LEU  45          1HD1      LEU  45  -1.598   1.664  13.183
  360   2HD1  LEU  45          2HD1      LEU  45  -2.992   1.609  12.104
  361   3HD1  LEU  45          3HD1      LEU  45  -2.233   3.154  12.486
  362   1HD2  LEU  45          1HD2      LEU  45  -2.238   2.999   9.616
  363   2HD2  LEU  45          2HD2      LEU  45  -0.489   3.141   9.444
  364   3HD2  LEU  45          3HD2      LEU  45  -1.326   4.040  10.708
  365    H    GLY  46           H        GLY  46   1.088  -1.586  11.288
  366   1HA   GLY  46          2HA       GLY  46  -0.161  -3.508  10.779
  367   2HA   GLY  46          1HA       GLY  46  -1.321  -2.991  12.004
  368    H    LEU  47           H        LEU  47  -0.490  -0.860   9.355
  369    HA   LEU  47           HA       LEU  47  -1.938   0.111   7.741
  370   1HB   LEU  47          2HB       LEU  47  -1.141  -2.193   6.938
  371   2HB   LEU  47          1HB       LEU  47  -2.734  -2.791   7.404
  372    HG   LEU  47           HG       LEU  47  -2.761  -0.336   5.758
  373   1HD1  LEU  47          1HD1      LEU  47  -1.396  -1.089   4.131
  374   2HD1  LEU  47          2HD1      LEU  47  -2.528  -2.416   3.873
  375   3HD1  LEU  47          3HD1      LEU  47  -1.164  -2.621   4.972
  376   1HD2  LEU  47          1HD2      LEU  47  -4.430  -2.585   6.423
  377   2HD2  LEU  47          2HD2      LEU  47  -4.267  -2.486   4.670
  378   3HD2  LEU  47          3HD2      LEU  47  -4.873  -1.101   5.579
  379    H    ARG  48           H        ARG  48  -3.121  -0.436  10.528
  380    HA   ARG  48           HA       ARG  48  -5.899  -1.191  10.118
  381   1HB   ARG  48          2HB       ARG  48  -4.201  -0.040  12.316
  382   2HB   ARG  48          1HB       ARG  48  -5.951  -0.131  12.515
  383   1HG   ARG  48          2HG       ARG  48  -4.167  -2.476  11.794
  384   2HG   ARG  48          1HG       ARG  48  -4.801  -2.149  13.408
  385   1HD   ARG  48          2HD       ARG  48  -7.116  -2.054  12.018
  386   2HD   ARG  48          1HD       ARG  48  -6.212  -3.199  11.007
  387    HE   ARG  48           HE       ARG  48  -5.898  -4.616  12.989
  388   1HH1  ARG  48          1HH2      ARG  48  -8.701  -2.808  12.779
  389   2HH1  ARG  48          2HH2      ARG  48  -9.165  -2.996  14.437
  390   1HH2  ARG  48          1HH1      ARG  48  -6.173  -4.470  15.385
  391   2HH2  ARG  48          2HH1      ARG  48  -7.735  -3.939  15.913
  392    H    VAL  49           H        VAL  49  -4.314   1.956  10.811
  393    HA   VAL  49           HA       VAL  49  -6.399   3.695  11.026
  394    HB   VAL  49           HB       VAL  49  -3.855   3.908   9.408
  395   1HG1  VAL  49          1HG1      VAL  49  -4.564   5.901   8.647
  396   2HG1  VAL  49          2HG1      VAL  49  -4.721   6.451  10.315
  397   3HG1  VAL  49          3HG1      VAL  49  -6.096   5.709   9.498
  398   1HG2  VAL  49          1HG2      VAL  49  -4.000   3.518  12.001
  399   2HG2  VAL  49          2HG2      VAL  49  -4.474   5.215  12.047
  400   3HG2  VAL  49          3HG2      VAL  49  -2.908   4.755  11.380
  401    H    TYR  50           H        TYR  50  -5.089   4.156   7.842
  402    HA   TYR  50           HA       TYR  50  -7.307   4.925   6.470
  403   1HB   TYR  50          2HB       TYR  50  -6.066   3.049   4.709
  404   2HB   TYR  50          1HB       TYR  50  -5.860   4.793   4.750
  405    HD1  TYR  50           1HD      TYR  50  -4.389   1.556   5.570
  406    HD2  TYR  50           2HD      TYR  50  -4.049   5.801   6.128
  407    HE1  TYR  50           1HE      TYR  50  -2.038   1.277   6.315
  408    HE2  TYR  50           2HE      TYR  50  -1.702   5.520   6.876
  409    HH   TYR  50           HH       TYR  50  -0.346   2.379   7.514
  410    H    GLU  51           H        GLU  51  -6.690   1.606   7.459
  411    HA   GLU  51           HA       GLU  51  -8.783   0.435   5.862
  412   1HB   GLU  51          2HB       GLU  51  -6.604  -0.242   7.554
  413   2HB   GLU  51          1HB       GLU  51  -8.025  -1.058   8.173
  414   1HG   GLU  51          2HG       GLU  51  -7.813  -1.147   5.250
  415   2HG   GLU  51          1HG       GLU  51  -6.473  -1.944   6.073
  416    H    ALA  52           H        ALA  52  -8.485   1.580   9.220
  417    HA   ALA  52           HA       ALA  52 -11.037   0.611  10.136
  418   1HB   ALA  52          1HB       ALA  52 -10.491   1.855  12.073
  419   2HB   ALA  52          2HB       ALA  52  -9.601   3.065  11.148
  420   3HB   ALA  52          3HB       ALA  52  -8.915   1.457  11.385
  421    H    GLN  53           H        GLN  53 -10.202   3.159   8.004
  422    HA   GLN  53           HA       GLN  53 -12.897   4.375   8.361
  423   1HB   GLN  53          2HB       GLN  53 -10.284   5.671   7.528
  424   2HB   GLN  53          1HB       GLN  53 -11.825   6.506   7.732
  425   1HG   GLN  53          2HG       GLN  53 -11.863   5.825  10.117
  426   2HG   GLN  53          1HG       GLN  53 -10.292   5.049   9.905
  427   1HE2  GLN  53          1HE2      GLN  53  -8.817   6.408  10.959
  428   2HE2  GLN  53          2HE2      GLN  53  -8.710   8.085  10.714
  429    H    MET  54           H        MET  54 -12.289   2.165   6.591
  430    HA   MET  54           HA       MET  54 -11.839   3.156   3.890
  431   1HB   MET  54          2HB       MET  54 -12.620   0.598   5.250
  432   2HB   MET  54          1HB       MET  54 -12.837   0.725   3.504
  433   1HG   MET  54          2HG       MET  54 -10.228   1.463   4.835
  434   2HG   MET  54          1HG       MET  54 -10.576  -0.190   4.328
  435   1HE   MET  54          1HE       MET  54  -8.775   3.025   1.966
  436   2HE   MET  54          2HE       MET  54  -8.680   2.516   3.651
  437   3HE   MET  54          3HE       MET  54 -10.005   3.551   3.124
  438    H    GLU  55           H        GLU  55 -14.609   2.836   5.976
  439    HA   GLU  55           HA       GLU  55 -16.353   3.804   3.752
  440   1HB   GLU  55          2HB       GLU  55 -18.038   2.132   4.409
  441   2HB   GLU  55          1HB       GLU  55 -16.524   1.331   3.984
  442   1HG   GLU  55          2HG       GLU  55 -15.918   1.235   6.386
  443   2HG   GLU  55          1HG       GLU  55 -17.460   1.987   6.794
  444    H    ARG  56           H        ARG  56 -18.614   4.378   4.830
  445    HA   ARG  56           HA       ARG  56 -18.056   6.285   6.982
  446   1HB   ARG  56          2HB       ARG  56 -19.537   6.903   5.187
  447   2HB   ARG  56          1HB       ARG  56 -20.503   5.445   5.405
  448   1HG   ARG  56          2HG       ARG  56 -21.733   7.219   6.446
  449   2HG   ARG  56          1HG       ARG  56 -21.014   6.282   7.756
  450   1HD   ARG  56          2HD       ARG  56 -20.027   8.179   8.501
  451   2HD   ARG  56          1HD       ARG  56 -19.089   8.240   6.996
  452    HE   ARG  56           HE       ARG  56 -21.473   9.817   7.573
  453   1HH1  ARG  56          1HH1      ARG  56 -18.887   9.906   5.640
  454   2HH1  ARG  56          2HH1      ARG  56 -19.713  10.219   4.150
  455   1HH2  ARG  56          1HH2      ARG  56 -22.856   9.520   5.436
  456   2HH2  ARG  56          2HH2      ARG  56 -21.960  10.002   4.036
  Start of MODEL    9
    1   1H    ALA   2          1H        ALA   2   9.285 -18.287 -18.633
    2   2H    ALA   2          2H        ALA   2  10.356 -18.295 -19.951
    3   3H    ALA   2          3H        ALA   2   9.098 -19.436 -19.867
    4    HA   ALA   2           HA       ALA   2   8.905 -16.531 -20.426
    5   1HB   ALA   2          1HB       ALA   2   7.516 -17.668 -22.305
    6   2HB   ALA   2          2HB       ALA   2   8.257 -19.168 -21.747
    7   3HB   ALA   2          3HB       ALA   2   9.269 -17.858 -22.354
    8    H    LYS   3           H        LYS   3   7.165 -19.410 -19.282
    9    HA   LYS   3           HA       LYS   3   4.682 -17.801 -18.926
   10   1HB   LYS   3          2HB       LYS   3   5.408 -20.738 -18.833
   11   2HB   LYS   3          1HB       LYS   3   3.817 -20.152 -18.348
   12   1HG   LYS   3          2HG       LYS   3   4.998 -19.379 -21.010
   13   2HG   LYS   3          1HG       LYS   3   4.132 -20.902 -20.813
   14   1HD   LYS   3          2HD       LYS   3   2.769 -18.541 -19.671
   15   2HD   LYS   3          1HD       LYS   3   2.920 -18.535 -21.429
   16   1HE   LYS   3          2HE       LYS   3   1.238 -20.041 -21.582
   17   2HE   LYS   3          1HE       LYS   3   2.155 -21.178 -20.573
   18   1HZ   LYS   3          1HZ       LYS   3   0.383 -20.736 -19.208
   19   2HZ   LYS   3          2HZ       LYS   3   0.196 -19.142 -19.765
   20   3HZ   LYS   3          3HZ       LYS   3   1.458 -19.530 -18.696
   21    H    VAL   4           H        VAL   4   4.926 -16.614 -17.018
   22    HA   VAL   4           HA       VAL   4   5.603 -18.182 -14.548
   23    HB   VAL   4           HB       VAL   4   6.162 -15.259 -15.140
   24   1HG1  VAL   4          1HG1      VAL   4   7.560 -16.947 -13.088
   25   2HG1  VAL   4          2HG1      VAL   4   5.961 -16.299 -12.719
   26   3HG1  VAL   4          3HG1      VAL   4   7.289 -15.204 -13.103
   27   1HG2  VAL   4          1HG2      VAL   4   7.548 -16.448 -16.652
   28   2HG2  VAL   4          2HG2      VAL   4   7.832 -17.751 -15.499
   29   3HG2  VAL   4          3HG2      VAL   4   8.580 -16.174 -15.248
   30    H    GLN   5           H        GLN   5   3.236 -18.510 -14.310
   31    HA   GLN   5           HA       GLN   5   1.656 -16.044 -13.746
   32   1HB   GLN   5          2HB       GLN   5   0.922 -18.975 -14.050
   33   2HB   GLN   5          1HB       GLN   5  -0.237 -17.665 -13.831
   34   1HG   GLN   5          2HG       GLN   5   1.203 -16.682 -15.911
   35   2HG   GLN   5          1HG       GLN   5   1.338 -18.412 -16.230
   36   1HE2  GLN   5          1HE2      GLN   5  -0.622 -19.588 -16.760
   37   2HE2  GLN   5          2HE2      GLN   5  -2.080 -18.790 -17.106
   38    H    ALA   6           H        ALA   6   0.333 -16.030 -11.741
   39    HA   ALA   6           HA       ALA   6   1.040 -17.906  -9.586
   40   1HB   ALA   6          1HB       ALA   6   2.337 -16.420  -8.323
   41   2HB   ALA   6          2HB       ALA   6   1.674 -15.002  -9.133
   42   3HB   ALA   6          3HB       ALA   6   2.847 -16.023  -9.963
   43    H    TYR   7           H        TYR   7  -1.071 -18.248  -8.930
   44    HA   TYR   7           HA       TYR   7  -3.024 -16.041  -8.875
   45   1HB   TYR   7          2HB       TYR   7  -2.941 -18.983  -8.746
   46   2HB   TYR   7          1HB       TYR   7  -4.178 -18.262  -7.718
   47    HD1  TYR   7           1HD      TYR   7  -6.235 -17.684  -8.659
   48    HD2  TYR   7           2HD      TYR   7  -2.775 -17.978 -11.186
   49    HE1  TYR   7           1HE      TYR   7  -7.656 -17.282 -10.651
   50    HE2  TYR   7           2HE      TYR   7  -4.196 -17.573 -13.178
   51    HH   TYR   7           HH       TYR   7  -7.603 -17.708 -13.061
   52    H    VAL   8           H        VAL   8  -4.100 -15.365  -6.910
   53    HA   VAL   8           HA       VAL   8  -4.074 -14.649  -4.656
   54    HB   VAL   8           HB       VAL   8  -3.034 -17.486  -4.356
   55   1HG1  VAL   8          1HG1      VAL   8  -4.449 -15.566  -2.491
   56   2HG1  VAL   8          2HG1      VAL   8  -2.887 -16.349  -2.253
   57   3HG1  VAL   8          3HG1      VAL   8  -4.370 -17.302  -2.191
   58   1HG2  VAL   8          1HG2      VAL   8  -5.003 -17.669  -5.657
   59   2HG2  VAL   8          2HG2      VAL   8  -5.789 -16.336  -4.812
   60   3HG2  VAL   8          3HG2      VAL   8  -5.573 -17.889  -4.003
   61    H    SER   9           H        SER   9  -2.320 -13.106  -4.866
   62    HA   SER   9           HA       SER   9   0.250 -14.069  -3.662
   63   1HB   SER   9          2HB       SER   9   0.755 -13.864  -5.956
   64   2HB   SER   9          1HB       SER   9  -0.301 -12.467  -6.156
   65    HG   SER   9           HG       SER   9   2.162 -12.595  -4.745
   66    H    ASP  10           H        ASP  10   1.016 -12.708  -2.055
   67    HA   ASP  10           HA       ASP  10  -0.632 -10.678  -0.927
   68   1HB   ASP  10          2HB       ASP  10   1.384 -10.271   0.461
   69   2HB   ASP  10          1HB       ASP  10   1.073 -11.998   0.272
   70    H    GLU  11           H        GLU  11  -0.961  -9.482  -3.106
   71    HA   GLU  11           HA       GLU  11   1.202  -7.913  -4.219
   72   1HB   GLU  11          2HB       GLU  11  -1.512  -8.553  -4.735
   73   2HB   GLU  11          1HB       GLU  11  -1.426  -6.795  -4.640
   74   1HG   GLU  11          2HG       GLU  11   0.665  -7.033  -6.164
   75   2HG   GLU  11          1HG       GLU  11   0.045  -8.650  -6.504
   76    H    ILE  12           H        ILE  12   1.759  -7.264  -1.761
   77    HA   ILE  12           HA       ILE  12   0.146  -5.071  -0.674
   78    HB   ILE  12           HB       ILE  12   2.741  -6.463  -0.013
   79   1HG1  ILE  12          2HG1      ILE  12   0.539  -7.508   0.548
   80   2HG1  ILE  12          1HG1      ILE  12   1.501  -7.138   1.979
   81   1HG2  ILE  12          1HG2      ILE  12   1.548  -4.066   1.418
   82   2HG2  ILE  12          2HG2      ILE  12   3.064  -4.076   0.516
   83   3HG2  ILE  12          3HG2      ILE  12   2.910  -5.028   1.993
   84   1HD1  ILE  12          1HD1      ILE  12  -1.062  -5.973   1.078
   85   2HD1  ILE  12          2HD1      ILE  12   0.121  -4.802   1.662
   86   3HD1  ILE  12          3HD1      ILE  12  -0.402  -6.122   2.708
   87    H    VAL  13           H        VAL  13   3.305  -5.395  -2.312
   88    HA   VAL  13           HA       VAL  13   4.309  -2.810  -2.173
   89    HB   VAL  13           HB       VAL  13   4.168  -4.779  -4.472
   90   1HG1  VAL  13          1HG1      VAL  13   5.244  -3.313  -5.798
   91   2HG1  VAL  13          2HG1      VAL  13   6.447  -3.006  -4.546
   92   3HG1  VAL  13          3HG1      VAL  13   4.954  -2.068  -4.584
   93   1HG2  VAL  13          1HG2      VAL  13   5.998  -5.766  -3.528
   94   2HG2  VAL  13          2HG2      VAL  13   5.420  -4.990  -2.052
   95   3HG2  VAL  13          3HG2      VAL  13   6.683  -4.223  -3.016
   96    H    TYR  14           H        TYR  14   1.916  -3.992  -4.568
   97    HA   TYR  14           HA       TYR  14   1.520  -1.505  -5.910
   98   1HB   TYR  14          2HB       TYR  14   0.824  -3.866  -6.569
   99   2HB   TYR  14          1HB       TYR  14  -0.514  -3.701  -5.431
  100    HD1  TYR  14           1HD      TYR  14  -2.475  -2.501  -6.010
  101    HD2  TYR  14           2HD      TYR  14   1.044  -2.164  -8.449
  102    HE1  TYR  14           1HE      TYR  14  -3.778  -1.262  -7.718
  103    HE2  TYR  14           2HE      TYR  14  -0.260  -0.926 -10.158
  104    HH   TYR  14           HH       TYR  14  -2.872  -0.868 -10.790
  105    H    LYS  15           H        LYS  15  -0.308  -2.999  -3.212
  106    HA   LYS  15           HA       LYS  15  -2.222  -0.916  -2.874
  107   1HB   LYS  15          2HB       LYS  15  -1.255  -3.301  -1.534
  108   2HB   LYS  15          1HB       LYS  15  -1.645  -2.044  -0.359
  109   1HG   LYS  15          2HG       LYS  15  -3.502  -2.890  -2.598
  110   2HG   LYS  15          1HG       LYS  15  -3.598  -3.521  -0.953
  111   1HD   LYS  15          2HD       LYS  15  -3.747  -0.573  -1.645
  112   2HD   LYS  15          1HD       LYS  15  -5.158  -1.597  -1.381
  113   1HE   LYS  15          2HE       LYS  15  -3.620  -2.150   0.849
  114   2HE   LYS  15          1HE       LYS  15  -3.328  -0.417   0.593
  115   1HZ   LYS  15          1HZ       LYS  15  -6.001  -1.718   0.597
  116   2HZ   LYS  15          2HZ       LYS  15  -5.695  -0.058   0.398
  117   3HZ   LYS  15          3HZ       LYS  15  -5.362  -0.815   1.883
  118    H    ILE  16           H        ILE  16   0.954  -1.415  -1.294
  119    HA   ILE  16           HA       ILE  16   0.851   0.922   0.366
  120    HB   ILE  16           HB       ILE  16   3.178  -0.603  -0.853
  121   1HG1  ILE  16          2HG1      ILE  16   1.597  -0.932   1.714
  122   2HG1  ILE  16          1HG1      ILE  16   1.770  -2.105   0.407
  123   1HG2  ILE  16          1HG2      ILE  16   4.561   0.388   0.801
  124   2HG2  ILE  16          2HG2      ILE  16   3.177   0.993   1.711
  125   3HG2  ILE  16          3HG2      ILE  16   3.606   1.727   0.167
  126   1HD1  ILE  16          1HD1      ILE  16   3.270  -2.776   2.171
  127   2HD1  ILE  16          2HD1      ILE  16   3.928  -1.146   2.304
  128   3HD1  ILE  16          3HD1      ILE  16   4.258  -2.114   0.868
  129    H    ASN  17           H        ASN  17   2.595   0.384  -2.727
  130    HA   ASN  17           HA       ASN  17   3.617   2.920  -3.199
  131   1HB   ASN  17          2HB       ASN  17   2.834   0.567  -4.694
  132   2HB   ASN  17          1HB       ASN  17   2.524   2.021  -5.644
  133   1HD2  ASN  17          1HD2      ASN  17   4.657   3.661  -4.625
  134   2HD2  ASN  17          2HD2      ASN  17   6.131   2.984  -5.126
  135    H    LYS  18           H        LYS  18   0.305   1.813  -4.009
  136    HA   LYS  18           HA       LYS  18  -0.778   4.046  -5.231
  137   1HB   LYS  18          2HB       LYS  18  -1.792   2.070  -3.200
  138   2HB   LYS  18          1HB       LYS  18  -2.857   3.353  -3.777
  139   1HG   LYS  18          2HG       LYS  18  -2.475   2.642  -6.102
  140   2HG   LYS  18          1HG       LYS  18  -1.392   1.367  -5.540
  141   1HD   LYS  18          2HD       LYS  18  -3.614   0.431  -5.962
  142   2HD   LYS  18          1HD       LYS  18  -3.267   0.385  -4.234
  143   1HE   LYS  18          2HE       LYS  18  -4.454   2.917  -4.743
  144   2HE   LYS  18          1HE       LYS  18  -5.452   1.700  -5.566
  145   1HZ   LYS  18          1HZ       LYS  18  -5.685   0.463  -3.613
  146   2HZ   LYS  18          2HZ       LYS  18  -5.893   2.070  -3.101
  147   3HZ   LYS  18          3HZ       LYS  18  -4.418   1.272  -2.828
  148    H    ILE  19           H        ILE  19  -0.319   3.592  -1.715
  149    HA   ILE  19           HA       ILE  19  -1.388   6.205  -1.018
  150    HB   ILE  19           HB       ILE  19   0.234   4.063   0.373
  151   1HG1  ILE  19          2HG1      ILE  19  -2.310   4.729   1.546
  152   2HG1  ILE  19          1HG1      ILE  19  -2.524   4.458  -0.183
  153   1HG2  ILE  19          1HG2      ILE  19   0.803   6.313   1.298
  154   2HG2  ILE  19          2HG2      ILE  19  -0.060   5.303   2.458
  155   3HG2  ILE  19          3HG2      ILE  19  -0.913   6.589   1.603
  156   1HD1  ILE  19          1HD1      ILE  19  -0.771   2.434   0.621
  157   2HD1  ILE  19          2HD1      ILE  19  -2.489   2.248   0.267
  158   3HD1  ILE  19          3HD1      ILE  19  -1.956   2.530   1.924
  159    H    VAL  20           H        VAL  20   1.848   4.878  -1.630
  160    HA   VAL  20           HA       VAL  20   3.315   7.209  -0.747
  161    HB   VAL  20           HB       VAL  20   4.176   5.200  -2.836
  162   1HG1  VAL  20          1HG1      VAL  20   5.835   6.857  -2.409
  163   2HG1  VAL  20          2HG1      VAL  20   6.326   5.450  -1.465
  164   3HG1  VAL  20          3HG1      VAL  20   5.537   6.813  -0.671
  165   1HG2  VAL  20          1HG2      VAL  20   3.321   4.728  -0.066
  166   2HG2  VAL  20          2HG2      VAL  20   4.957   4.159  -0.394
  167   3HG2  VAL  20          3HG2      VAL  20   3.608   3.570  -1.364
  168    H    GLU  21           H        GLU  21   2.424   6.018  -4.013
  169    HA   GLU  21           HA       GLU  21   3.478   8.130  -5.546
  170   1HB   GLU  21          2HB       GLU  21   1.745   7.423  -7.183
  171   2HB   GLU  21          1HB       GLU  21   2.524   6.034  -6.424
  172   1HG   GLU  21          2HG       GLU  21   0.619   5.394  -5.354
  173   2HG   GLU  21          1HG       GLU  21   0.151   7.055  -4.989
  174    H    ARG  22           H        ARG  22   0.681   8.087  -3.447
  175    HA   ARG  22           HA       ARG  22  -0.709  10.363  -4.546
  176   1HB   ARG  22          2HB       ARG  22  -1.454   8.514  -2.893
  177   2HB   ARG  22          1HB       ARG  22  -0.664   9.489  -1.653
  178   1HG   ARG  22          2HG       ARG  22  -2.532  10.735  -1.521
  179   2HG   ARG  22          1HG       ARG  22  -2.219  11.290  -3.167
  180   1HD   ARG  22          2HD       ARG  22  -3.549   9.507  -4.107
  181   2HD   ARG  22          1HD       ARG  22  -3.695   8.714  -2.526
  182    HE   ARG  22           HE       ARG  22  -4.703  11.151  -1.937
  183   1HH1  ARG  22          1HH2      ARG  22  -5.366   8.760  -4.308
  184   2HH1  ARG  22          2HH2      ARG  22  -6.889   9.441  -4.771
  185   1HH2  ARG  22          1HH1      ARG  22  -6.599  12.187  -2.673
  186   2HH2  ARG  22          2HH1      ARG  22  -7.588  11.380  -3.843
  187    H    ARG  23           H        ARG  23   1.349  10.120  -1.608
  188    HA   ARG  23           HA       ARG  23   1.517  12.795  -0.892
  189   1HB   ARG  23          2HB       ARG  23   2.935  10.367  -0.465
  190   2HB   ARG  23          1HB       ARG  23   4.143  11.603  -0.821
  191   1HG   ARG  23          2HG       ARG  23   3.852  12.557   1.196
  192   2HG   ARG  23          1HG       ARG  23   2.109  12.666   0.943
  193   1HD   ARG  23          2HD       ARG  23   2.359   9.992   1.410
  194   2HD   ARG  23          1HD       ARG  23   3.663  10.629   2.432
  195    HE   ARG  23           HE       ARG  23   1.949  12.173   3.436
  196   1HH1  ARG  23          1HH1      ARG  23  -0.204  11.680   1.390
  197   2HH1  ARG  23          2HH1      ARG  23  -1.254  10.591   2.233
  198   1HH2  ARG  23          1HH2      ARG  23   1.094   9.782   4.653
  199   2HH2  ARG  23          2HH2      ARG  23  -0.520   9.517   4.081
  200    H    ARG  24           H        ARG  24   3.768  11.181  -3.179
  201    HA   ARG  24           HA       ARG  24   4.974  13.659  -4.056
  202   1HB   ARG  24          2HB       ARG  24   6.065  12.201  -5.667
  203   2HB   ARG  24          1HB       ARG  24   5.940  11.320  -4.143
  204   1HG   ARG  24          2HG       ARG  24   3.753  10.351  -5.039
  205   2HG   ARG  24          1HG       ARG  24   4.216  11.010  -6.607
  206   1HD   ARG  24          2HD       ARG  24   5.780   8.986  -4.965
  207   2HD   ARG  24          1HD       ARG  24   4.995   8.712  -6.533
  208    HE   ARG  24           HE       ARG  24   7.506  10.174  -6.106
  209   1HH1  ARG  24          1HH1      ARG  24   5.855   8.426  -8.338
  210   2HH1  ARG  24          2HH1      ARG  24   6.141   9.475  -9.686
  211   1HH2  ARG  24          1HH2      ARG  24   7.415  12.053  -7.748
  212   2HH2  ARG  24          2HH2      ARG  24   7.023  11.529  -9.351
  213    H    ALA  25           H        ALA  25   2.361  11.591  -5.322
  214    HA   ALA  25           HA       ALA  25   1.862  12.672  -7.826
  215   1HB   ALA  25          1HB       ALA  25  -0.651  12.446  -6.839
  216   2HB   ALA  25          2HB       ALA  25   0.237  11.606  -5.568
  217   3HB   ALA  25          3HB       ALA  25   0.339  11.042  -7.236
  218    H    GLU  26           H        GLU  26   0.926  14.056  -4.674
  219    HA   GLU  26           HA       GLU  26  -0.309  16.414  -5.814
  220   1HB   GLU  26          2HB       GLU  26   0.454  15.324  -3.148
  221   2HB   GLU  26          1HB       GLU  26   0.208  17.068  -3.251
  222   1HG   GLU  26          2HG       GLU  26  -1.958  16.231  -4.632
  223   2HG   GLU  26          1HG       GLU  26  -1.758  14.858  -3.542
  224    H    GLY  27           H        GLY  27   2.937  15.540  -4.737
  225   1HA   GLY  27          2HA       GLY  27   4.939  16.655  -5.420
  226   2HA   GLY  27          1HA       GLY  27   3.969  18.030  -5.946
  227    H    ALA  28           H        ALA  28   3.133  16.866  -2.838
  228    HA   ALA  28           HA       ALA  28   4.589  19.181  -1.617
  229   1HB   ALA  28          1HB       ALA  28   2.064  19.125  -1.660
  230   2HB   ALA  28          2HB       ALA  28   2.744  19.229  -0.036
  231   3HB   ALA  28          3HB       ALA  28   2.137  17.687  -0.642
  232    H    LYS  29           H        LYS  29   5.809  16.583  -2.042
  233    HA   LYS  29           HA       LYS  29   7.218  16.113   0.308
  234   1HB   LYS  29          2HB       LYS  29   4.452  15.222   0.428
  235   2HB   LYS  29          1HB       LYS  29   5.557  13.869   0.674
  236   1HG   LYS  29          2HG       LYS  29   6.511  16.173   2.123
  237   2HG   LYS  29          1HG       LYS  29   4.833  15.848   2.559
  238   1HD   LYS  29          2HD       LYS  29   6.205  13.346   2.396
  239   2HD   LYS  29          1HD       LYS  29   7.170  14.435   3.393
  240   1HE   LYS  29          2HE       LYS  29   4.187  14.188   3.819
  241   2HE   LYS  29          1HE       LYS  29   5.326  13.072   4.602
  242   1HZ   LYS  29          1HZ       LYS  29   5.208  14.839   6.088
  243   2HZ   LYS  29          2HZ       LYS  29   5.150  16.010   4.859
  244   3HZ   LYS  29          3HZ       LYS  29   6.603  15.196   5.193
  245    H    SER  30           H        SER  30   7.353  15.789  -2.649
  246    HA   SER  30           HA       SER  30   7.683  12.885  -3.029
  247   1HB   SER  30          2HB       SER  30   8.147  13.593  -5.368
  248   2HB   SER  30          1HB       SER  30   6.652  14.302  -4.766
  249    HG   SER  30           HG       SER  30   8.344  15.696  -5.852
  250    H    THR  31           H        THR  31   9.404  14.773  -1.335
  251    HA   THR  31           HA       THR  31  12.074  14.127  -2.525
  252    HB   THR  31           HB       THR  31  12.866  15.936  -1.057
  253    HG1  THR  31           1HG      THR  31  11.734  16.429   0.618
  254   1HG2  THR  31          1HG2      THR  31  12.141  17.550  -2.472
  255   2HG2  THR  31          2HG2      THR  31  10.449  17.269  -2.064
  256   3HG2  THR  31          3HG2      THR  31  11.248  16.249  -3.261
  257    H    ASP  32           H        ASP  32  10.042  13.875   0.348
  258    HA   ASP  32           HA       ASP  32  12.076  12.172   1.712
  259   1HB   ASP  32          2HB       ASP  32  10.541  14.283   2.528
  260   2HB   ASP  32          1HB       ASP  32   9.529  12.926   3.023
  261    H    VAL  33           H        VAL  33   8.585  12.214   0.911
  262    HA   VAL  33           HA       VAL  33   7.762   9.731   1.826
  263    HB   VAL  33           HB       VAL  33   6.520  11.581   0.556
  264   1HG1  VAL  33          1HG1      VAL  33   7.074   9.963  -1.909
  265   2HG1  VAL  33          2HG1      VAL  33   8.233  11.203  -1.426
  266   3HG1  VAL  33          3HG1      VAL  33   6.560  11.646  -1.767
  267   1HG2  VAL  33          1HG2      VAL  33   4.995   9.806  -0.586
  268   2HG2  VAL  33          2HG2      VAL  33   5.220   9.709   1.161
  269   3HG2  VAL  33          3HG2      VAL  33   6.117   8.628   0.095
  270    H    SER  34           H        SER  34   7.814   7.592   0.996
  271    HA   SER  34           HA       SER  34   9.037   6.857  -1.511
  272   1HB   SER  34          2HB       SER  34  10.910   7.798   0.060
  273   2HB   SER  34          1HB       SER  34  10.749   6.257   0.896
  274    HG   SER  34           HG       SER  34  12.016   5.554  -0.626
  275    H    PHE  35           H        PHE  35   8.769   4.614  -1.873
  276    HA   PHE  35           HA       PHE  35   6.792   3.148  -0.630
  277   1HB   PHE  35          2HB       PHE  35   8.091   2.605  -2.709
  278   2HB   PHE  35          1HB       PHE  35   9.416   2.048  -1.687
  279    HD1  PHE  35           1HD      PHE  35   9.073   0.101  -0.147
  280    HD2  PHE  35           2HD      PHE  35   6.134   1.268  -3.054
  281    HE1  PHE  35           1HE      PHE  35   7.971  -2.109   0.080
  282    HE2  PHE  35           2HE      PHE  35   5.032  -0.942  -2.827
  283    HZ   PHE  35           HZ       PHE  35   5.951  -2.631  -1.260
  284    H    SER  36           H        SER  36  10.280   2.788   0.148
  285    HA   SER  36           HA       SER  36  10.004   1.031   2.344
  286   1HB   SER  36          2HB       SER  36  11.976   3.177   1.561
  287   2HB   SER  36          1HB       SER  36  12.219   2.211   3.013
  288    HG   SER  36           HG       SER  36  13.104   0.893   1.611
  289    H    SER  37           H        SER  37   9.519   4.518   2.159
  290    HA   SER  37           HA       SER  37   9.469   4.908   5.058
  291   1HB   SER  37          2HB       SER  37   8.411   6.686   2.848
  292   2HB   SER  37          1HB       SER  37   8.966   7.181   4.444
  293    HG   SER  37           HG       SER  37  10.540   7.487   2.777
  294    H    ILE  38           H        ILE  38   7.014   4.725   2.458
  295    HA   ILE  38           HA       ILE  38   4.757   5.137   4.220
  296    HB   ILE  38           HB       ILE  38   5.122   3.962   1.452
  297   1HG1  ILE  38          2HG1      ILE  38   5.682   6.357   1.722
  298   2HG1  ILE  38          1HG1      ILE  38   4.226   6.153   0.748
  299   1HG2  ILE  38          1HG2      ILE  38   3.005   3.203   1.627
  300   2HG2  ILE  38          2HG2      ILE  38   2.491   4.886   1.737
  301   3HG2  ILE  38          3HG2      ILE  38   2.803   3.961   3.205
  302   1HD1  ILE  38          1HD1      ILE  38   4.533   7.579   3.225
  303   2HD1  ILE  38          2HD1      ILE  38   3.387   6.259   3.457
  304   3HD1  ILE  38          3HD1      ILE  38   3.107   7.459   2.194
  305    H    SER  39           H        SER  39   6.233   2.204   2.791
  306    HA   SER  39           HA       SER  39   4.360   0.335   3.894
  307   1HB   SER  39          2HB       SER  39   5.691  -0.472   2.158
  308   2HB   SER  39          1HB       SER  39   7.145   0.303   2.779
  309    HG   SER  39           HG       SER  39   5.836  -2.035   3.682
  310    H    THR  40           H        THR  40   7.548   1.452   5.076
  311    HA   THR  40           HA       THR  40   7.856  -0.161   7.335
  312    HB   THR  40           HB       THR  40   8.482   2.742   6.771
  313    HG1  THR  40           1HG      THR  40  10.167   1.884   5.887
  314   1HG2  THR  40          1HG2      THR  40   8.659   2.882   9.055
  315   2HG2  THR  40          2HG2      THR  40  10.224   2.136   8.724
  316   3HG2  THR  40          3HG2      THR  40   8.867   1.141   9.250
  317    H    MET  41           H        MET  41   6.227   3.048   7.307
  318    HA   MET  41           HA       MET  41   5.279   2.802  10.024
  319   1HB   MET  41          2HB       MET  41   4.196   4.875   9.537
  320   2HB   MET  41          1HB       MET  41   5.680   4.883   8.585
  321   1HG   MET  41          2HG       MET  41   4.274   5.414   6.870
  322   2HG   MET  41          1HG       MET  41   3.969   3.678   6.844
  323   1HE   MET  41          1HE       MET  41   1.471   3.721   5.885
  324   2HE   MET  41          2HE       MET  41   2.106   5.323   5.515
  325   3HE   MET  41          3HE       MET  41   0.484   5.158   6.183
  326    H    LEU  42           H        LEU  42   3.976   1.818   6.909
  327    HA   LEU  42           HA       LEU  42   1.225   1.516   7.699
  328   1HB   LEU  42          2HB       LEU  42   2.790   1.261   5.412
  329   2HB   LEU  42          1HB       LEU  42   2.235  -0.384   5.714
  330    HG   LEU  42           HG       LEU  42   0.373   2.000   5.714
  331   1HD1  LEU  42          1HD1      LEU  42   1.582   0.510   3.486
  332   2HD1  LEU  42          2HD1      LEU  42   0.736   2.056   3.475
  333   3HD1  LEU  42          3HD1      LEU  42  -0.180   0.550   3.435
  334   1HD2  LEU  42          1HD2      LEU  42  -0.124  -0.327   6.830
  335   2HD2  LEU  42          2HD2      LEU  42  -0.335  -0.872   5.165
  336   3HD2  LEU  42          3HD2      LEU  42  -1.352   0.418   5.807
  337    H    LEU  43           H        LEU  43   3.913  -0.853   7.518
  338    HA   LEU  43           HA       LEU  43   2.375  -3.061   8.541
  339   1HB   LEU  43          2HB       LEU  43   4.370  -3.461   7.286
  340   2HB   LEU  43          1HB       LEU  43   5.323  -2.409   8.338
  341    HG   LEU  43           HG       LEU  43   4.033  -4.418   9.935
  342   1HD1  LEU  43          1HD1      LEU  43   5.683  -6.228   8.792
  343   2HD1  LEU  43          2HD1      LEU  43   5.215  -5.319   7.357
  344   3HD1  LEU  43          3HD1      LEU  43   3.981  -6.085   8.357
  345   1HD2  LEU  43          1HD2      LEU  43   6.481  -4.967  10.407
  346   2HD2  LEU  43          2HD2      LEU  43   6.019  -3.286  10.674
  347   3HD2  LEU  43          3HD2      LEU  43   6.896  -3.737   9.214
  348    H    GLU  44           H        GLU  44   4.602  -0.745  10.115
  349    HA   GLU  44           HA       GLU  44   4.590  -1.873  12.722
  350   1HB   GLU  44          2HB       GLU  44   4.801   0.955  11.648
  351   2HB   GLU  44          1HB       GLU  44   5.061   0.568  13.349
  352   1HG   GLU  44          2HG       GLU  44   6.724  -1.223  12.445
  353   2HG   GLU  44          1HG       GLU  44   6.681  -0.277  10.957
  354    H    LEU  45           H        LEU  45   2.235   0.029  10.985
  355    HA   LEU  45           HA       LEU  45   0.523   0.298  13.405
  356   1HB   LEU  45          2HB       LEU  45   0.414   2.347  12.409
  357   2HB   LEU  45          1HB       LEU  45   1.042   1.727  10.887
  358    HG   LEU  45           HG       LEU  45  -1.256   0.763  10.442
  359   1HD1  LEU  45          1HD1      LEU  45  -3.064   1.253  11.823
  360   2HD1  LEU  45          2HD1      LEU  45  -2.291   2.689  12.496
  361   3HD1  LEU  45          3HD1      LEU  45  -1.780   1.084  13.020
  362   1HD2  LEU  45          1HD2      LEU  45  -2.261   3.181  10.142
  363   2HD2  LEU  45          2HD2      LEU  45  -0.835   2.706   9.220
  364   3HD2  LEU  45          3HD2      LEU  45  -0.661   3.698  10.668
  365    H    GLY  46           H        GLY  46   1.046  -1.879  10.908
  366   1HA   GLY  46          2HA       GLY  46  -0.272  -3.563   9.928
  367   2HA   GLY  46          1HA       GLY  46  -1.174  -3.520  11.446
  368    H    LEU  47           H        LEU  47  -0.825  -0.944   9.037
  369    HA   LEU  47           HA       LEU  47  -2.547   0.440   8.144
  370   1HB   LEU  47          2HB       LEU  47  -3.621  -0.788   6.395
  371   2HB   LEU  47          1HB       LEU  47  -2.068  -1.576   6.655
  372    HG   LEU  47           HG       LEU  47  -4.282  -2.631   8.311
  373   1HD1  LEU  47          1HD1      LEU  47  -5.452  -2.168   6.176
  374   2HD1  LEU  47          2HD1      LEU  47  -5.277  -3.899   6.465
  375   3HD1  LEU  47          3HD1      LEU  47  -4.216  -3.084   5.314
  376   1HD2  LEU  47          1HD2      LEU  47  -2.524  -4.190   6.445
  377   2HD2  LEU  47          2HD2      LEU  47  -3.110  -4.629   8.050
  378   3HD2  LEU  47          3HD2      LEU  47  -1.807  -3.451   7.878
  379    H    ARG  48           H        ARG  48  -3.137  -0.470  10.925
  380    HA   ARG  48           HA       ARG  48  -5.938  -1.235  11.054
  381   1HB   ARG  48          2HB       ARG  48  -3.686  -0.588  12.826
  382   2HB   ARG  48          1HB       ARG  48  -5.248  -0.086  13.474
  383   1HG   ARG  48          2HG       ARG  48  -5.544  -2.227  14.121
  384   2HG   ARG  48          1HG       ARG  48  -5.730  -2.624  12.412
  385   1HD   ARG  48          2HD       ARG  48  -3.647  -3.568  12.278
  386   2HD   ARG  48          1HD       ARG  48  -2.926  -2.358  13.358
  387    HE   ARG  48           HE       ARG  48  -4.807  -4.335  14.539
  388   1HH1  ARG  48          1HH2      ARG  48  -1.623  -4.376  13.596
  389   2HH1  ARG  48          2HH2      ARG  48  -0.957  -4.627  15.176
  390   1HH2  ARG  48          1HH1      ARG  48  -3.963  -4.094  16.819
  391   2HH2  ARG  48          2HH1      ARG  48  -2.282  -4.467  17.000
  392    H    VAL  49           H        VAL  49  -4.826   1.606  12.798
  393    HA   VAL  49           HA       VAL  49  -7.138   3.142  12.533
  394    HB   VAL  49           HB       VAL  49  -5.013   3.501  13.917
  395   1HG1  VAL  49          1HG1      VAL  49  -3.112   4.329  12.960
  396   2HG1  VAL  49          2HG1      VAL  49  -4.005   5.320  11.806
  397   3HG1  VAL  49          3HG1      VAL  49  -3.773   3.600  11.496
  398   1HG2  VAL  49          1HG2      VAL  49  -5.240   6.155  13.348
  399   2HG2  VAL  49          2HG2      VAL  49  -6.417   5.264  14.313
  400   3HG2  VAL  49          3HG2      VAL  49  -6.712   5.541  12.597
  401    H    TYR  50           H        TYR  50  -4.655   2.552  10.145
  402    HA   TYR  50           HA       TYR  50  -5.016   4.756   8.397
  403   1HB   TYR  50          2HB       TYR  50  -3.220   3.163   8.144
  404   2HB   TYR  50          1HB       TYR  50  -4.358   1.831   7.956
  405    HD1  TYR  50           1HD      TYR  50  -5.513   1.441   5.864
  406    HD2  TYR  50           2HD      TYR  50  -2.938   4.846   6.351
  407    HE1  TYR  50           1HE      TYR  50  -5.569   1.833   3.417
  408    HE2  TYR  50           2HE      TYR  50  -2.994   5.237   3.902
  409    HH   TYR  50           HH       TYR  50  -4.932   3.151   1.752
  410    H    GLU  51           H        GLU  51  -6.606   1.532   8.233
  411    HA   GLU  51           HA       GLU  51  -8.438   2.276   6.161
  412   1HB   GLU  51          2HB       GLU  51  -7.526   0.014   7.389
  413   2HB   GLU  51          1HB       GLU  51  -9.141   0.142   8.078
  414   1HG   GLU  51          2HG       GLU  51  -9.209   0.713   5.247
  415   2HG   GLU  51          1HG       GLU  51  -8.455  -0.854   5.538
  416    H    ALA  52           H        ALA  52  -8.324   3.059   9.482
  417    HA   ALA  52           HA       ALA  52 -11.210   3.164   9.961
  418   1HB   ALA  52          1HB       ALA  52  -8.886   4.434  11.443
  419   2HB   ALA  52          2HB       ALA  52  -9.419   2.770  11.677
  420   3HB   ALA  52          3HB       ALA  52 -10.493   4.105  12.092
  421    H    GLN  53           H        GLN  53  -8.673   5.698   9.725
  422    HA   GLN  53           HA       GLN  53 -10.344   7.956   9.714
  423   1HB   GLN  53          2HB       GLN  53  -8.424   9.072   8.826
  424   2HB   GLN  53          1HB       GLN  53  -7.787   7.718   9.759
  425   1HG   GLN  53          2HG       GLN  53  -7.597   6.380   7.698
  426   2HG   GLN  53          1HG       GLN  53  -8.233   7.731   6.759
  427   1HE2  GLN  53          1HE2      GLN  53  -5.817   7.702   9.435
  428   2HE2  GLN  53          2HE2      GLN  53  -4.590   8.447   8.531
  429    H    MET  54           H        MET  54  -9.886   5.564   7.220
  430    HA   MET  54           HA       MET  54 -11.001   7.275   5.086
  431   1HB   MET  54          2HB       MET  54 -10.133   4.376   5.296
  432   2HB   MET  54          1HB       MET  54 -10.718   5.109   3.802
  433   1HG   MET  54          2HG       MET  54  -8.339   6.082   5.412
  434   2HG   MET  54          1HG       MET  54  -8.246   5.150   3.919
  435   1HE   MET  54          1HE       MET  54 -10.690   6.841   1.930
  436   2HE   MET  54          2HE       MET  54  -9.461   5.583   2.020
  437   3HE   MET  54          3HE       MET  54  -9.125   7.073   1.141
  438    H    GLU  55           H        GLU  55 -11.955   4.255   6.773
  439    HA   GLU  55           HA       GLU  55 -14.804   4.912   6.092
  440   1HB   GLU  55          2HB       GLU  55 -13.165   2.402   5.914
  441   2HB   GLU  55          1HB       GLU  55 -14.900   2.269   6.203
  442   1HG   GLU  55          2HG       GLU  55 -14.632   4.181   4.156
  443   2HG   GLU  55          1HG       GLU  55 -13.507   2.887   3.739
  444    H    ARG  56           H        ARG  56 -16.354   3.827   7.658
  445    HA   ARG  56           HA       ARG  56 -15.332   2.966  10.261
  446   1HB   ARG  56          2HB       ARG  56 -16.143   4.938  11.477
  447   2HB   ARG  56          1HB       ARG  56 -14.978   5.437  10.250
  448   1HG   ARG  56          2HG       ARG  56 -17.148   5.652   8.743
  449   2HG   ARG  56          1HG       ARG  56 -17.948   5.819  10.307
  450   1HD   ARG  56          2HD       ARG  56 -15.809   7.495  10.649
  451   2HD   ARG  56          1HD       ARG  56 -16.147   7.708   8.919
  452    HE   ARG  56           HE       ARG  56 -18.562   8.101   9.611
  453   1HH1  ARG  56          1HH1      ARG  56 -16.334  10.119  10.628
  454   2HH1  ARG  56          2HH1      ARG  56 -17.008  10.506  12.175
  455   1HH2  ARG  56          1HH2      ARG  56 -19.286   7.891  12.131
  456   2HH2  ARG  56          2HH2      ARG  56 -18.681   9.245  13.027
  Start of MODEL   10
    1   1H    ALA   2          1H        ALA   2  -6.715 -19.519 -11.097
    2   2H    ALA   2          2H        ALA   2  -6.864 -18.705  -9.612
    3   3H    ALA   2          3H        ALA   2  -7.636 -20.200  -9.846
    4    HA   ALA   2           HA       ALA   2  -5.541 -20.302  -8.482
    5   1HB   ALA   2          1HB       ALA   2  -5.259 -22.452  -9.312
    6   2HB   ALA   2          2HB       ALA   2  -5.288 -21.915 -10.992
    7   3HB   ALA   2          3HB       ALA   2  -6.792 -22.034 -10.079
    8    H    LYS   3           H        LYS   3  -5.290 -18.092 -10.731
    9    HA   LYS   3           HA       LYS   3  -2.468 -18.631 -11.541
   10   1HB   LYS   3          2HB       LYS   3  -4.770 -17.527 -12.763
   11   2HB   LYS   3          1HB       LYS   3  -3.638 -16.191 -12.556
   12   1HG   LYS   3          2HG       LYS   3  -1.894 -17.406 -13.713
   13   2HG   LYS   3          1HG       LYS   3  -2.890 -18.860 -13.779
   14   1HD   LYS   3          2HD       LYS   3  -3.581 -18.126 -15.800
   15   2HD   LYS   3          1HD       LYS   3  -4.515 -16.917 -14.918
   16   1HE   LYS   3          2HE       LYS   3  -3.278 -15.398 -16.099
   17   2HE   LYS   3          1HE       LYS   3  -1.977 -15.802 -14.961
   18   1HZ   LYS   3          1HZ       LYS   3  -1.762 -17.857 -16.575
   19   2HZ   LYS   3          2HZ       LYS   3  -0.962 -16.391 -16.897
   20   3HZ   LYS   3          3HZ       LYS   3  -2.416 -16.761 -17.692
   21    H    VAL   4           H        VAL   4  -2.293 -18.161  -8.962
   22    HA   VAL   4           HA       VAL   4  -1.733 -15.225  -8.666
   23    HB   VAL   4           HB       VAL   4  -2.426 -17.216  -6.490
   24   1HG1  VAL   4          1HG1      VAL   4  -1.510 -15.326  -5.467
   25   2HG1  VAL   4          2HG1      VAL   4  -3.227 -14.919  -5.497
   26   3HG1  VAL   4          3HG1      VAL   4  -2.135 -14.232  -6.701
   27   1HG2  VAL   4          1HG2      VAL   4  -4.285 -17.148  -8.082
   28   2HG2  VAL   4          2HG2      VAL   4  -4.250 -15.384  -8.083
   29   3HG2  VAL   4          3HG2      VAL   4  -4.728 -16.256  -6.626
   30    H    GLN   5           H        GLN   5  -0.720 -18.518  -7.737
   31    HA   GLN   5           HA       GLN   5   1.371 -19.301  -6.937
   32   1HB   GLN   5          2HB       GLN   5   2.310 -17.105  -8.807
   33   2HB   GLN   5          1HB       GLN   5   3.158 -18.603  -8.418
   34   1HG   GLN   5          2HG       GLN   5   0.672 -19.482  -9.295
   35   2HG   GLN   5          1HG       GLN   5   1.031 -18.132 -10.369
   36   1HE2  GLN   5          1HE2      GLN   5   1.479 -19.563 -12.197
   37   2HE2  GLN   5          2HE2      GLN   5   2.882 -20.515 -12.248
   38    H    ALA   6           H        ALA   6   3.773 -18.070  -6.432
   39    HA   ALA   6           HA       ALA   6   4.899 -16.651  -4.908
   40   1HB   ALA   6          1HB       ALA   6   3.376 -15.047  -6.334
   41   2HB   ALA   6          2HB       ALA   6   4.115 -14.443  -4.850
   42   3HB   ALA   6          3HB       ALA   6   2.424 -14.943  -4.853
   43    H    TYR   7           H        TYR   7   4.733 -18.270  -3.215
   44    HA   TYR   7           HA       TYR   7   2.529 -18.803  -1.551
   45   1HB   TYR   7          2HB       TYR   7   5.520 -18.714  -1.099
   46   2HB   TYR   7          1HB       TYR   7   4.409 -19.315   0.130
   47    HD1  TYR   7           1HD      TYR   7   5.738 -19.877  -3.277
   48    HD2  TYR   7           2HD      TYR   7   3.250 -21.419  -0.134
   49    HE1  TYR   7           1HE      TYR   7   5.645 -22.072  -4.427
   50    HE2  TYR   7           2HE      TYR   7   3.156 -23.614  -1.285
   51    HH   TYR   7           HH       TYR   7   3.493 -24.608  -3.373
   52    H    VAL   8           H        VAL   8   1.312 -17.072  -0.765
   53    HA   VAL   8           HA       VAL   8   0.812 -15.111   0.465
   54    HB   VAL   8           HB       VAL   8   3.237 -16.242   1.896
   55   1HG1  VAL   8          1HG1      VAL   8   1.956 -13.756   2.287
   56   2HG1  VAL   8          2HG1      VAL   8   3.097 -14.548   3.373
   57   3HG1  VAL   8          3HG1      VAL   8   1.364 -14.812   3.571
   58   1HG2  VAL   8          1HG2      VAL   8   1.080 -17.632   1.568
   59   2HG2  VAL   8          2HG2      VAL   8   0.327 -16.479   2.670
   60   3HG2  VAL   8          3HG2      VAL   8   1.687 -17.460   3.216
   61    H    SER   9           H        SER   9   1.527 -13.806  -1.473
   62    HA   SER   9           HA       SER   9   4.242 -12.680  -1.440
   63   1HB   SER   9          2HB       SER   9   3.476 -12.837  -3.603
   64   2HB   SER   9          1HB       SER   9   1.792 -12.645  -3.125
   65    HG   SER   9           HG       SER   9   2.595 -10.818  -4.253
   66    H    ASP  10           H        ASP  10   4.739 -10.499  -0.919
   67    HA   ASP  10           HA       ASP  10   3.295  -9.270   1.206
   68   1HB   ASP  10          2HB       ASP  10   5.379  -8.321  -0.774
   69   2HB   ASP  10          1HB       ASP  10   4.837  -7.330   0.581
   70    H    GLU  11           H        GLU  11   1.073  -9.304   0.166
   71    HA   GLU  11           HA       GLU  11   0.364  -7.780  -2.127
   72   1HB   GLU  11          2HB       GLU  11  -1.069  -9.421  -0.972
   73   2HB   GLU  11          1HB       GLU  11  -1.159  -8.362   0.436
   74   1HG   GLU  11          2HG       GLU  11  -1.922  -7.213  -2.214
   75   2HG   GLU  11          1HG       GLU  11  -3.051  -8.332  -1.450
   76    H    ILE  12           H        ILE  12   1.475  -6.729   0.950
   77    HA   ILE  12           HA       ILE  12   0.081  -4.198   1.114
   78    HB   ILE  12           HB       ILE  12   2.600  -5.386   2.292
   79   1HG1  ILE  12          2HG1      ILE  12   0.269  -6.162   2.969
   80   2HG1  ILE  12          1HG1      ILE  12   1.275  -5.561   4.288
   81   1HG2  ILE  12          1HG2      ILE  12   2.210  -3.299   3.903
   82   2HG2  ILE  12          2HG2      ILE  12   1.545  -2.591   2.432
   83   3HG2  ILE  12          3HG2      ILE  12   3.214  -3.161   2.459
   84   1HD1  ILE  12          1HD1      ILE  12  -0.420  -3.569   2.860
   85   2HD1  ILE  12          2HD1      ILE  12   0.014  -3.656   4.568
   86   3HD1  ILE  12          3HD1      ILE  12  -1.245  -4.710   3.922
   87    H    VAL  13           H        VAL  13   3.141  -5.246  -0.358
   88    HA   VAL  13           HA       VAL  13   4.494  -2.911  -0.902
   89    HB   VAL  13           HB       VAL  13   3.819  -5.207  -2.768
   90   1HG1  VAL  13          1HG1      VAL  13   6.279  -3.475  -2.935
   91   2HG1  VAL  13          2HG1      VAL  13   4.798  -3.016  -3.775
   92   3HG1  VAL  13          3HG1      VAL  13   5.593  -4.540  -4.162
   93   1HG2  VAL  13          1HG2      VAL  13   5.426  -6.402  -1.681
   94   2HG2  VAL  13          2HG2      VAL  13   5.140  -5.263  -0.364
   95   3HG2  VAL  13          3HG2      VAL  13   6.472  -4.995  -1.488
   96    H    TYR  14           H        TYR  14   1.660  -4.106  -2.729
   97    HA   TYR  14           HA       TYR  14   1.546  -1.917  -4.588
   98   1HB   TYR  14          2HB       TYR  14   0.167  -4.330  -3.943
   99   2HB   TYR  14          1HB       TYR  14  -1.035  -3.041  -4.032
  100    HD1  TYR  14           1HD      TYR  14  -2.013  -2.794  -6.124
  101    HD2  TYR  14           2HD      TYR  14   2.116  -3.945  -5.868
  102    HE1  TYR  14           1HE      TYR  14  -1.871  -2.831  -8.598
  103    HE2  TYR  14           2HE      TYR  14   2.259  -3.982  -8.343
  104    HH   TYR  14           HH       TYR  14   0.425  -4.338 -10.284
  105    H    LYS  15           H        LYS  15  -0.347  -2.569  -1.616
  106    HA   LYS  15           HA       LYS  15  -1.935  -0.260  -1.554
  107   1HB   LYS  15          2HB       LYS  15  -2.278  -2.026   0.005
  108   2HB   LYS  15          1HB       LYS  15  -0.610  -1.946   0.575
  109   1HG   LYS  15          2HG       LYS  15  -1.106  -0.330   2.072
  110   2HG   LYS  15          1HG       LYS  15  -1.973   0.615   0.860
  111   1HD   LYS  15          2HD       LYS  15  -3.143  -1.838   2.194
  112   2HD   LYS  15          1HD       LYS  15  -3.400  -0.199   2.793
  113   1HE   LYS  15          2HE       LYS  15  -3.905  -0.387  -0.081
  114   2HE   LYS  15          1HE       LYS  15  -4.954  -1.469   0.858
  115   1HZ   LYS  15          1HZ       LYS  15  -5.836   0.247   2.044
  116   2HZ   LYS  15          2HZ       LYS  15  -5.524   1.074   0.593
  117   3HZ   LYS  15          3HZ       LYS  15  -4.453   1.220   1.904
  118    H    ILE  16           H        ILE  16   1.431  -0.651  -0.426
  119    HA   ILE  16           HA       ILE  16   1.675   1.978   0.726
  120    HB   ILE  16           HB       ILE  16   3.780   0.155  -0.485
  121   1HG1  ILE  16          2HG1      ILE  16   2.402  -1.078   1.115
  122   2HG1  ILE  16          1HG1      ILE  16   3.967  -0.726   1.849
  123   1HG2  ILE  16          1HG2      ILE  16   4.236   2.644   0.274
  124   2HG2  ILE  16          2HG2      ILE  16   5.359   1.363   0.731
  125   3HG2  ILE  16          3HG2      ILE  16   4.167   1.946   1.893
  126   1HD1  ILE  16          1HD1      ILE  16   2.547  -0.064   3.559
  127   2HD1  ILE  16          2HD1      ILE  16   1.284   0.463   2.448
  128   3HD1  ILE  16          3HD1      ILE  16   2.722   1.456   2.683
  129    H    ASN  17           H        ASN  17   2.613   0.672  -2.476
  130    HA   ASN  17           HA       ASN  17   3.844   2.845  -3.665
  131   1HB   ASN  17          2HB       ASN  17   1.874   0.774  -4.606
  132   2HB   ASN  17          1HB       ASN  17   2.452   1.999  -5.737
  133   1HD2  ASN  17          1HD2      ASN  17   3.228  -1.016  -4.295
  134   2HD2  ASN  17          2HD2      ASN  17   4.851  -1.095  -4.787
  135    H    LYS  18           H        LYS  18   0.413   2.500  -2.892
  136    HA   LYS  18           HA       LYS  18  -0.494   4.805  -4.395
  137   1HB   LYS  18          2HB       LYS  18  -1.501   2.879  -2.365
  138   2HB   LYS  18          1HB       LYS  18  -2.354   4.420  -2.459
  139   1HG   LYS  18          2HG       LYS  18  -3.351   3.833  -4.391
  140   2HG   LYS  18          1HG       LYS  18  -1.806   3.381  -5.112
  141   1HD   LYS  18          2HD       LYS  18  -2.287   1.198  -4.860
  142   2HD   LYS  18          1HD       LYS  18  -2.528   1.428  -3.127
  143   1HE   LYS  18          2HE       LYS  18  -4.716   0.940  -3.532
  144   2HE   LYS  18          1HE       LYS  18  -4.818   2.552  -4.267
  145   1HZ   LYS  18          1HZ       LYS  18  -4.521  -0.054  -5.549
  146   2HZ   LYS  18          2HZ       LYS  18  -3.655   1.238  -6.234
  147   3HZ   LYS  18          3HZ       LYS  18  -5.345   1.326  -6.086
  148    H    ILE  19           H        ILE  19   0.028   4.299  -0.879
  149    HA   ILE  19           HA       ILE  19  -0.456   6.916   0.019
  150    HB   ILE  19           HB       ILE  19   1.640   4.919   0.938
  151   1HG1  ILE  19          2HG1      ILE  19  -0.937   5.112   2.353
  152   2HG1  ILE  19          1HG1      ILE  19  -1.076   4.521   0.697
  153   1HG2  ILE  19          1HG2      ILE  19   1.961   7.091   1.991
  154   2HG2  ILE  19          2HG2      ILE  19   1.233   5.994   3.164
  155   3HG2  ILE  19          3HG2      ILE  19   0.241   7.206   2.355
  156   1HD1  ILE  19          1HD1      ILE  19  -0.385   2.979   2.887
  157   2HD1  ILE  19          2HD1      ILE  19   1.178   3.338   2.153
  158   3HD1  ILE  19          3HD1      ILE  19  -0.083   2.551   1.203
  159    H    VAL  20           H        VAL  20   2.707   5.533  -0.978
  160    HA   VAL  20           HA       VAL  20   4.197   7.964  -0.719
  161    HB   VAL  20           HB       VAL  20   4.594   5.590  -2.567
  162   1HG1  VAL  20          1HG1      VAL  20   6.190   7.970  -1.894
  163   2HG1  VAL  20          2HG1      VAL  20   6.328   6.876  -3.270
  164   3HG1  VAL  20          3HG1      VAL  20   7.064   6.447  -1.727
  165   1HG2  VAL  20          1HG2      VAL  20   6.155   5.660  -0.114
  166   2HG2  VAL  20          2HG2      VAL  20   5.160   4.359  -0.767
  167   3HG2  VAL  20          3HG2      VAL  20   4.424   5.625   0.217
  168    H    GLU  21           H        GLU  21   3.098   6.378  -3.747
  169    HA   GLU  21           HA       GLU  21   3.662   8.432  -5.557
  170   1HB   GLU  21          2HB       GLU  21   1.381   6.445  -5.373
  171   2HB   GLU  21          1HB       GLU  21   1.683   7.421  -6.811
  172   1HG   GLU  21          2HG       GLU  21   3.978   5.905  -5.644
  173   2HG   GLU  21          1HG       GLU  21   2.760   4.999  -6.541
  174    H    ARG  22           H        ARG  22   0.728   8.038  -3.555
  175    HA   ARG  22           HA       ARG  22  -0.916  10.068  -4.460
  176   1HB   ARG  22          2HB       ARG  22  -1.520   8.653  -2.612
  177   2HB   ARG  22          1HB       ARG  22  -0.152   9.221  -1.653
  178   1HG   ARG  22          2HG       ARG  22  -1.136  11.499  -1.628
  179   2HG   ARG  22          1HG       ARG  22  -2.525  10.893  -2.532
  180   1HD   ARG  22          2HD       ARG  22  -2.185   9.134  -0.330
  181   2HD   ARG  22          1HD       ARG  22  -2.073  10.786   0.310
  182    HE   ARG  22           HE       ARG  22  -4.294  11.217  -0.494
  183   1HH1  ARG  22          1HH2      ARG  22  -4.024   9.743  -3.116
  184   2HH1  ARG  22          2HH2      ARG  22  -5.129   8.428  -2.894
  185   1HH2  ARG  22          1HH1      ARG  22  -5.318   8.819   0.546
  186   2HH2  ARG  22          2HH1      ARG  22  -5.862   7.905  -0.821
  187    H    ARG  23           H        ARG  23   1.811  10.496  -2.169
  188    HA   ARG  23           HA       ARG  23   1.693  13.211  -1.641
  189   1HB   ARG  23          2HB       ARG  23   3.636  11.096  -1.685
  190   2HB   ARG  23          1HB       ARG  23   4.394  12.569  -2.287
  191   1HG   ARG  23          2HG       ARG  23   2.674  12.745   0.159
  192   2HG   ARG  23          1HG       ARG  23   4.297  12.074   0.317
  193   1HD   ARG  23          2HD       ARG  23   4.660  14.348  -1.276
  194   2HD   ARG  23          1HD       ARG  23   3.502  14.855  -0.030
  195    HE   ARG  23           HE       ARG  23   5.856  13.295   0.872
  196   1HH1  ARG  23          1HH1      ARG  23   4.065  14.891   2.698
  197   2HH1  ARG  23          2HH1      ARG  23   5.026  16.302   2.990
  198   1HH2  ARG  23          1HH2      ARG  23   7.163  15.725   0.321
  199   2HH2  ARG  23          2HH2      ARG  23   6.779  16.775   1.643
  200    H    ARG  24           H        ARG  24   3.362  11.782  -4.484
  201    HA   ARG  24           HA       ARG  24   3.858  14.332  -5.746
  202   1HB   ARG  24          2HB       ARG  24   4.636  11.688  -6.030
  203   2HB   ARG  24          1HB       ARG  24   3.656  11.962  -7.472
  204   1HG   ARG  24          2HG       ARG  24   5.015  13.789  -8.173
  205   2HG   ARG  24          1HG       ARG  24   5.818  13.888  -6.605
  206   1HD   ARG  24          2HD       ARG  24   6.118  11.222  -7.710
  207   2HD   ARG  24          1HD       ARG  24   6.717  12.444  -8.848
  208    HE   ARG  24           HE       ARG  24   7.502  12.770  -6.010
  209   1HH1  ARG  24          1HH1      ARG  24   8.835  10.353  -7.237
  210   2HH1  ARG  24          2HH1      ARG  24  10.290  11.043  -7.875
  211   1HH2  ARG  24          1HH2      ARG  24   9.136  14.308  -7.693
  212   2HH2  ARG  24          2HH2      ARG  24  10.460  13.281  -8.135
  213    H    ALA  25           H        ALA  25   1.530  11.721  -6.556
  214    HA   ALA  25           HA       ALA  25   0.122  12.971  -8.619
  215   1HB   ALA  25          1HB       ALA  25  -1.319  11.514  -6.417
  216   2HB   ALA  25          2HB       ALA  25  -0.099  10.662  -7.361
  217   3HB   ALA  25          3HB       ALA  25  -1.511  11.351  -8.163
  218    H    GLU  26           H        GLU  26   0.181  13.782  -5.229
  219    HA   GLU  26           HA       GLU  26  -2.146  15.583  -5.509
  220   1HB   GLU  26          2HB       GLU  26  -0.497  14.542  -3.197
  221   2HB   GLU  26          1HB       GLU  26  -1.771  15.744  -2.992
  222   1HG   GLU  26          2HG       GLU  26  -2.864  13.673  -4.590
  223   2HG   GLU  26          1HG       GLU  26  -2.025  12.889  -3.250
  224    H    GLY  27           H        GLY  27   1.348  15.603  -5.216
  225   1HA   GLY  27          2HA       GLY  27   2.359  17.749  -6.136
  226   2HA   GLY  27          1HA       GLY  27   1.263  18.592  -5.041
  227    H    ALA  28           H        ALA  28   3.579  15.873  -4.767
  228    HA   ALA  28           HA       ALA  28   4.226  16.214  -2.041
  229   1HB   ALA  28          1HB       ALA  28   4.845  14.278  -3.403
  230   2HB   ALA  28          2HB       ALA  28   6.304  14.986  -2.711
  231   3HB   ALA  28          3HB       ALA  28   5.895  15.285  -4.400
  232    H    LYS  29           H        LYS  29   6.993  16.633  -1.907
  233    HA   LYS  29           HA       LYS  29   7.401  19.409  -2.945
  234   1HB   LYS  29          2HB       LYS  29   6.760  18.593  -0.284
  235   2HB   LYS  29          1HB       LYS  29   8.433  19.158  -0.281
  236   1HG   LYS  29          2HG       LYS  29   7.825  21.286  -1.161
  237   2HG   LYS  29          1HG       LYS  29   6.210  20.725  -1.602
  238   1HD   LYS  29          2HD       LYS  29   6.774  20.343   1.239
  239   2HD   LYS  29          1HD       LYS  29   6.890  22.035   0.757
  240   1HE   LYS  29          2HE       LYS  29   4.643  22.204   0.421
  241   2HE   LYS  29          1HE       LYS  29   4.566  20.632  -0.398
  242   1HZ   LYS  29          1HZ       LYS  29   3.601  20.966   2.024
  243   2HZ   LYS  29          2HZ       LYS  29   5.214  20.647   2.452
  244   3HZ   LYS  29          3HZ       LYS  29   4.329  19.511   1.549
  245    H    SER  30           H        SER  30   8.908  16.655  -1.219
  246    HA   SER  30           HA       SER  30  11.333  17.008  -2.917
  247   1HB   SER  30          2HB       SER  30  11.070  17.269   0.063
  248   2HB   SER  30          1HB       SER  30  12.570  16.639  -0.610
  249    HG   SER  30           HG       SER  30  11.569  19.179  -0.606
  250    H    THR  31           H        THR  31  12.951  15.100  -1.905
  251    HA   THR  31           HA       THR  31  11.504  12.611  -2.485
  252    HB   THR  31           HB       THR  31  13.744  11.682  -2.506
  253    HG1  THR  31           1HG      THR  31  14.763  14.117  -1.544
  254   1HG2  THR  31          1HG2      THR  31  13.841  14.533  -3.530
  255   2HG2  THR  31          2HG2      THR  31  13.123  13.173  -4.394
  256   3HG2  THR  31          3HG2      THR  31  14.857  13.197  -4.072
  257    H    ASP  32           H        ASP  32  11.517  14.374   0.225
  258    HA   ASP  32           HA       ASP  32  12.464  12.862   2.379
  259   1HB   ASP  32          2HB       ASP  32  11.224  15.134   2.229
  260   2HB   ASP  32          1HB       ASP  32   9.744  14.178   2.336
  261    H    VAL  33           H        VAL  33   9.717  12.217   0.288
  262    HA   VAL  33           HA       VAL  33   8.761  10.017   2.045
  263    HB   VAL  33           HB       VAL  33   7.207  11.650   0.995
  264   1HG1  VAL  33          1HG1      VAL  33   8.839  11.035  -1.310
  265   2HG1  VAL  33          2HG1      VAL  33   7.640  12.313  -1.114
  266   3HG1  VAL  33          3HG1      VAL  33   7.143  10.715  -1.671
  267   1HG2  VAL  33          1HG2      VAL  33   7.068   8.762   0.098
  268   2HG2  VAL  33          2HG2      VAL  33   5.747   9.900  -0.169
  269   3HG2  VAL  33          3HG2      VAL  33   6.254   9.508   1.474
  270    H    SER  34           H        SER  34   8.789   7.826   1.347
  271    HA   SER  34           HA       SER  34   9.958   7.147  -1.281
  272   1HB   SER  34          2HB       SER  34  11.270   6.368   1.341
  273   2HB   SER  34          1HB       SER  34  11.849   5.969  -0.273
  274    HG   SER  34           HG       SER  34  11.677   8.446  -0.477
  275    H    PHE  35           H        PHE  35   9.558   4.933  -1.837
  276    HA   PHE  35           HA       PHE  35   7.222   3.711  -0.801
  277   1HB   PHE  35          2HB       PHE  35   8.313   3.323  -3.015
  278   2HB   PHE  35          1HB       PHE  35   9.604   2.444  -2.194
  279    HD1  PHE  35           1HD      PHE  35   5.861   2.510  -2.458
  280    HD2  PHE  35           2HD      PHE  35   9.397   0.134  -1.909
  281    HE1  PHE  35           1HE      PHE  35   4.482   0.449  -2.496
  282    HE2  PHE  35           2HE      PHE  35   8.018  -1.927  -1.947
  283    HZ   PHE  35           HZ       PHE  35   5.561  -1.769  -2.241
  284    H    SER  36           H        SER  36  10.652   3.118  -0.025
  285    HA   SER  36           HA       SER  36  10.170   0.895   1.753
  286   1HB   SER  36          2HB       SER  36  12.546   1.789   2.535
  287   2HB   SER  36          1HB       SER  36  12.348   1.055   0.947
  288    HG   SER  36           HG       SER  36  13.381   2.996   0.656
  289    H    SER  37           H        SER  37  10.118   4.390   2.148
  290    HA   SER  37           HA       SER  37  10.199   4.317   5.074
  291   1HB   SER  37          2HB       SER  37  10.399   6.587   4.809
  292   2HB   SER  37          1HB       SER  37  10.723   6.153   3.133
  293    HG   SER  37           HG       SER  37   8.579   7.428   4.241
  294    H    ILE  38           H        ILE  38   7.668   4.820   2.592
  295    HA   ILE  38           HA       ILE  38   5.526   5.137   4.534
  296    HB   ILE  38           HB       ILE  38   5.653   4.540   1.570
  297   1HG1  ILE  38          2HG1      ILE  38   6.586   6.737   2.521
  298   2HG1  ILE  38          1HG1      ILE  38   5.359   6.890   1.264
  299   1HG2  ILE  38          1HG2      ILE  38   3.232   5.675   1.903
  300   2HG2  ILE  38          2HG2      ILE  38   3.369   4.838   3.450
  301   3HG2  ILE  38          3HG2      ILE  38   3.474   3.929   1.943
  302   1HD1  ILE  38          1HD1      ILE  38   5.119   8.327   3.428
  303   2HD1  ILE  38          2HD1      ILE  38   4.553   6.826   4.161
  304   3HD1  ILE  38          3HD1      ILE  38   3.691   7.515   2.784
  305    H    SER  39           H        SER  39   7.086   2.416   3.005
  306    HA   SER  39           HA       SER  39   5.001   0.475   3.121
  307   1HB   SER  39          2HB       SER  39   7.901   0.640   2.796
  308   2HB   SER  39          1HB       SER  39   7.408  -0.839   3.617
  309    HG   SER  39           HG       SER  39   7.291  -1.225   1.438
  310    H    THR  40           H        THR  40   7.804   0.239   5.285
  311    HA   THR  40           HA       THR  40   6.735  -1.261   7.326
  312    HB   THR  40           HB       THR  40   9.051  -0.517   7.232
  313    HG1  THR  40           1HG      THR  40   7.898   0.651   9.534
  314   1HG2  THR  40          1HG2      THR  40   8.044   1.917   6.561
  315   2HG2  THR  40          2HG2      THR  40   9.702   1.664   7.104
  316   3HG2  THR  40          3HG2      THR  40   8.472   2.201   8.247
  317    H    MET  41           H        MET  41   6.207   2.211   6.805
  318    HA   MET  41           HA       MET  41   5.026   2.999   9.211
  319   1HB   MET  41          2HB       MET  41   5.359   3.981   6.654
  320   2HB   MET  41          1HB       MET  41   3.604   3.871   6.785
  321   1HG   MET  41          2HG       MET  41   4.832   4.954   9.206
  322   2HG   MET  41          1HG       MET  41   5.179   5.934   7.782
  323   1HE   MET  41          1HE       MET  41   3.429   5.605   5.954
  324   2HE   MET  41          2HE       MET  41   2.629   7.149   6.242
  325   3HE   MET  41          3HE       MET  41   1.675   5.669   6.169
  326    H    LEU  42           H        LEU  42   3.173   1.788   6.377
  327    HA   LEU  42           HA       LEU  42   0.681   1.502   7.689
  328   1HB   LEU  42          2HB       LEU  42   2.048   0.541   5.257
  329   2HB   LEU  42          1HB       LEU  42   0.728  -0.495   5.799
  330    HG   LEU  42           HG       LEU  42   0.058   1.369   4.201
  331   1HD1  LEU  42          1HD1      LEU  42  -1.513   2.070   6.536
  332   2HD1  LEU  42          2HD1      LEU  42  -1.210   0.333   6.489
  333   3HD1  LEU  42          3HD1      LEU  42  -1.986   1.130   5.121
  334   1HD2  LEU  42          1HD2      LEU  42   0.210   3.595   4.830
  335   2HD2  LEU  42          2HD2      LEU  42   1.650   2.962   5.629
  336   3HD2  LEU  42          3HD2      LEU  42   0.171   3.218   6.553
  337    H    LEU  43           H        LEU  43   3.018  -1.136   6.970
  338    HA   LEU  43           HA       LEU  43   1.802  -3.207   8.395
  339   1HB   LEU  43          2HB       LEU  43   3.753  -3.558   7.027
  340   2HB   LEU  43          1HB       LEU  43   4.715  -2.461   8.021
  341    HG   LEU  43           HG       LEU  43   3.594  -4.401   9.768
  342   1HD1  LEU  43          1HD1      LEU  43   3.294  -5.776   7.702
  343   2HD1  LEU  43          2HD1      LEU  43   4.450  -6.487   8.829
  344   3HD1  LEU  43          3HD1      LEU  43   5.025  -5.640   7.395
  345   1HD2  LEU  43          1HD2      LEU  43   6.065  -5.029   9.964
  346   2HD2  LEU  43          2HD2      LEU  43   5.687  -3.327  10.230
  347   3HD2  LEU  43          3HD2      LEU  43   6.372  -3.849   8.690
  348    H    GLU  44           H        GLU  44   4.031  -0.717   9.677
  349    HA   GLU  44           HA       GLU  44   4.120  -1.701  12.369
  350   1HB   GLU  44          2HB       GLU  44   4.497   0.977  11.015
  351   2HB   GLU  44          1HB       GLU  44   4.681   0.806  12.761
  352   1HG   GLU  44          2HG       GLU  44   6.282  -1.140  12.222
  353   2HG   GLU  44          1HG       GLU  44   6.293  -0.512  10.575
  354    H    LEU  45           H        LEU  45   1.702  -0.129  10.518
  355    HA   LEU  45           HA       LEU  45   0.154   0.739  12.905
  356   1HB   LEU  45          2HB       LEU  45   0.193   1.230   9.944
  357   2HB   LEU  45          1HB       LEU  45  -1.301   1.536  10.832
  358    HG   LEU  45           HG       LEU  45   1.225   2.614  11.995
  359   1HD1  LEU  45          1HD1      LEU  45   1.752   3.903  10.228
  360   2HD1  LEU  45          2HD1      LEU  45   0.125   4.587  10.237
  361   3HD1  LEU  45          3HD1      LEU  45   0.470   3.138   9.291
  362   1HD2  LEU  45          1HD2      LEU  45  -1.096   2.832  13.005
  363   2HD2  LEU  45          2HD2      LEU  45  -1.518   3.854  11.632
  364   3HD2  LEU  45          3HD2      LEU  45  -0.255   4.361  12.753
  365    H    GLY  46           H        GLY  46   0.550  -2.006  10.999
  366   1HA   GLY  46          2HA       GLY  46  -0.719  -3.979  10.863
  367   2HA   GLY  46          1HA       GLY  46  -1.810  -3.284  12.064
  368    H    LEU  47           H        LEU  47  -1.421  -1.127   9.523
  369    HA   LEU  47           HA       LEU  47  -2.684  -0.644   7.571
  370   1HB   LEU  47          2HB       LEU  47  -2.569  -3.329   7.591
  371   2HB   LEU  47          1HB       LEU  47  -4.298  -3.131   7.874
  372    HG   LEU  47           HG       LEU  47  -3.471  -1.298   5.822
  373   1HD1  LEU  47          1HD1      LEU  47  -2.303  -2.561   4.312
  374   2HD1  LEU  47          2HD1      LEU  47  -3.078  -4.063   4.815
  375   3HD1  LEU  47          3HD1      LEU  47  -1.755  -3.392   5.767
  376   1HD2  LEU  47          1HD2      LEU  47  -5.364  -2.129   4.763
  377   2HD2  LEU  47          2HD2      LEU  47  -5.708  -2.600   6.427
  378   3HD2  LEU  47          3HD2      LEU  47  -5.058  -3.783   5.290
  379    H    ARG  48           H        ARG  48  -4.353  -1.906  10.445
  380    HA   ARG  48           HA       ARG  48  -6.934  -0.778   9.826
  381   1HB   ARG  48          2HB       ARG  48  -6.296  -2.646  11.445
  382   2HB   ARG  48          1HB       ARG  48  -5.742  -1.380  12.542
  383   1HG   ARG  48          2HG       ARG  48  -7.948  -1.689  13.247
  384   2HG   ARG  48          1HG       ARG  48  -8.113  -0.345  12.117
  385   1HD   ARG  48          2HD       ARG  48  -9.665  -1.626  11.054
  386   2HD   ARG  48          1HD       ARG  48  -8.302  -2.612  10.489
  387    HE   ARG  48           HE       ARG  48  -8.733  -3.557  13.043
  388   1HH1  ARG  48          1HH1      ARG  48 -10.220  -3.622   9.982
  389   2HH1  ARG  48          2HH1      ARG  48 -11.538  -4.633  10.473
  390   1HH2  ARG  48          1HH2      ARG  48 -10.660  -4.603  13.827
  391   2HH2  ARG  48          2HH2      ARG  48 -11.788  -5.186  12.650
  392    H    VAL  49           H        VAL  49  -4.659   0.225  12.417
  393    HA   VAL  49           HA       VAL  49  -5.732   2.657  13.138
  394    HB   VAL  49           HB       VAL  49  -2.797   2.115  12.592
  395   1HG1  VAL  49          1HG1      VAL  49  -4.305   4.224  13.950
  396   2HG1  VAL  49          2HG1      VAL  49  -2.615   4.202  13.447
  397   3HG1  VAL  49          3HG1      VAL  49  -3.087   3.484  14.987
  398   1HG2  VAL  49          1HG2      VAL  49  -3.502   1.618  15.299
  399   2HG2  VAL  49          2HG2      VAL  49  -2.948   0.448  14.101
  400   3HG2  VAL  49          3HG2      VAL  49  -4.673   0.756  14.302
  401    H    TYR  50           H        TYR  50  -3.945   1.957  10.162
  402    HA   TYR  50           HA       TYR  50  -3.705   4.730   9.321
  403   1HB   TYR  50          2HB       TYR  50  -2.166   3.095   8.489
  404   2HB   TYR  50          1HB       TYR  50  -3.472   2.023   7.984
  405    HD1  TYR  50           1HD      TYR  50  -3.738   1.922   5.679
  406    HD2  TYR  50           2HD      TYR  50  -2.652   5.659   7.496
  407    HE1  TYR  50           1HE      TYR  50  -3.781   3.016   3.454
  408    HE2  TYR  50           2HE      TYR  50  -2.695   6.754   5.271
  409    HH   TYR  50           HH       TYR  50  -3.461   4.892   2.324
  410    H    GLU  51           H        GLU  51  -5.554   2.097   7.739
  411    HA   GLU  51           HA       GLU  51  -7.278   3.762   6.252
  412   1HB   GLU  51          2HB       GLU  51  -6.702   1.128   6.480
  413   2HB   GLU  51          1HB       GLU  51  -8.259   1.164   7.302
  414   1HG   GLU  51          2HG       GLU  51  -8.354   2.765   4.898
  415   2HG   GLU  51          1HG       GLU  51  -7.807   1.131   4.526
  416    H    ALA  52           H        ALA  52  -7.311   2.935   9.633
  417    HA   ALA  52           HA       ALA  52 -10.072   3.235  10.253
  418   1HB   ALA  52          1HB       ALA  52  -9.125   3.796  12.526
  419   2HB   ALA  52          2HB       ALA  52  -7.527   3.850  11.783
  420   3HB   ALA  52          3HB       ALA  52  -8.437   2.340  11.808
  421    H    GLN  53           H        GLN  53  -7.612   5.608   9.478
  422    HA   GLN  53           HA       GLN  53  -8.558   7.962  10.648
  423   1HB   GLN  53          2HB       GLN  53  -7.514   9.053   8.700
  424   2HB   GLN  53          1HB       GLN  53  -6.537   7.682   9.230
  425   1HG   GLN  53          2HG       GLN  53  -7.795   6.285   7.504
  426   2HG   GLN  53          1HG       GLN  53  -8.421   7.807   6.869
  427   1HE2  GLN  53          1HE2      GLN  53  -6.801   9.380   6.016
  428   2HE2  GLN  53          2HE2      GLN  53  -5.286   8.826   5.486
  429    H    MET  54           H        MET  54  -9.739   6.398   7.659
  430    HA   MET  54           HA       MET  54 -12.364   7.710   8.026
  431   1HB   MET  54          2HB       MET  54 -10.619   8.118   5.575
  432   2HB   MET  54          1HB       MET  54 -12.244   8.765   5.802
  433   1HG   MET  54          2HG       MET  54 -11.370   9.930   7.882
  434   2HG   MET  54          1HG       MET  54  -9.750   9.460   7.369
  435   1HE   MET  54          1HE       MET  54 -12.768  12.107   5.234
  436   2HE   MET  54          2HE       MET  54 -13.031  10.702   6.266
  437   3HE   MET  54          3HE       MET  54 -12.589  10.475   4.576
  438    H    GLU  55           H        GLU  55 -10.629   6.179   5.289
  439    HA   GLU  55           HA       GLU  55 -11.907   3.619   5.511
  440   1HB   GLU  55          2HB       GLU  55 -13.958   4.786   5.117
  441   2HB   GLU  55          1HB       GLU  55 -13.237   5.762   3.837
  442   1HG   GLU  55          2HG       GLU  55 -13.281   4.026   2.295
  443   2HG   GLU  55          1HG       GLU  55 -13.241   2.780   3.543
  444    H    ARG  56           H        ARG  56 -11.360   2.244   3.676
  445    HA   ARG  56           HA       ARG  56  -8.862   2.595   2.487
  446   1HB   ARG  56          2HB       ARG  56  -9.956   0.474   2.450
  447   2HB   ARG  56          1HB       ARG  56 -11.367   1.136   1.623
  448   1HG   ARG  56          2HG       ARG  56  -8.986   1.665   0.077
  449   2HG   ARG  56          1HG       ARG  56  -9.102  -0.059   0.434
  450   1HD   ARG  56          2HD       ARG  56 -10.583  -0.174  -1.289
  451   2HD   ARG  56          1HD       ARG  56 -11.723   0.684  -0.232
  452    HE   ARG  56           HE       ARG  56 -10.062   2.678  -1.263
  453   1HH1  ARG  56          1HH2      ARG  56 -12.462   0.438  -2.276
  454   2HH1  ARG  56          2HH2      ARG  56 -12.740   1.212  -3.799
  455   1HH2  ARG  56          1HH1      ARG  56 -10.272   3.602  -3.337
  456   2HH2  ARG  56          2HH1      ARG  56 -11.502   3.003  -4.400
  Start of MODEL   11
    1   1H    ALA   2          1H        ALA   2  -5.505 -27.009   1.396
    2   2H    ALA   2          2H        ALA   2  -5.564 -26.206  -0.100
    3   3H    ALA   2          3H        ALA   2  -6.437 -25.602   1.227
    4    HA   ALA   2           HA       ALA   2  -4.623 -24.204   1.263
    5   1HB   ALA   2          1HB       ALA   2  -3.207 -25.141   3.119
    6   2HB   ALA   2          2HB       ALA   2  -3.980 -26.704   2.857
    7   3HB   ALA   2          3HB       ALA   2  -4.937 -25.327   3.402
    8    H    LYS   3           H        LYS   3  -2.602 -23.694   0.384
    9    HA   LYS   3           HA       LYS   3  -1.239 -25.883  -1.147
   10   1HB   LYS   3          2HB       LYS   3  -2.375 -23.834  -2.255
   11   2HB   LYS   3          1HB       LYS   3  -1.018 -22.906  -1.614
   12   1HG   LYS   3          2HG       LYS   3   0.304 -25.006  -2.732
   13   2HG   LYS   3          1HG       LYS   3  -1.080 -24.883  -3.818
   14   1HD   LYS   3          2HD       LYS   3   0.266 -23.326  -4.839
   15   2HD   LYS   3          1HD       LYS   3  -0.458 -22.269  -3.626
   16   1HE   LYS   3          2HE       LYS   3   1.752 -21.818  -3.140
   17   2HE   LYS   3          1HE       LYS   3   1.614 -23.310  -2.188
   18   1HZ   LYS   3          1HZ       LYS   3   2.107 -24.480  -4.385
   19   2HZ   LYS   3          2HZ       LYS   3   3.407 -23.713  -3.603
   20   3HZ   LYS   3          3HZ       LYS   3   2.656 -22.972  -4.935
   21    H    VAL   4           H        VAL   4  -0.028 -26.395   0.885
   22    HA   VAL   4           HA       VAL   4   1.723 -26.053   2.466
   23    HB   VAL   4           HB       VAL   4   3.827 -25.606   1.152
   24   1HG1  VAL   4          1HG1      VAL   4   3.699 -27.784   0.598
   25   2HG1  VAL   4          2HG1      VAL   4   2.558 -27.426  -0.697
   26   3HG1  VAL   4          3HG1      VAL   4   1.970 -27.728   0.940
   27   1HG2  VAL   4          1HG2      VAL   4   3.684 -25.174  -1.218
   28   2HG2  VAL   4          2HG2      VAL   4   2.707 -23.951  -0.412
   29   3HG2  VAL   4          3HG2      VAL   4   1.930 -25.326  -1.198
   30    H    GLN   5           H        GLN   5   0.541 -24.167   3.499
   31    HA   GLN   5           HA       GLN   5   0.645 -21.997   4.430
   32   1HB   GLN   5          2HB       GLN   5   3.340 -21.899   3.048
   33   2HB   GLN   5          1HB       GLN   5   2.854 -21.053   4.519
   34   1HG   GLN   5          2HG       GLN   5   2.382 -23.501   5.397
   35   2HG   GLN   5          1HG       GLN   5   3.531 -23.948   4.136
   36   1HE2  GLN   5          1HE2      GLN   5   5.417 -24.370   5.352
   37   2HE2  GLN   5          2HE2      GLN   5   6.139 -23.247   6.402
   38    H    ALA   6           H        ALA   6   0.436 -19.736   3.759
   39    HA   ALA   6           HA       ALA   6   0.361 -19.326   0.789
   40   1HB   ALA   6          1HB       ALA   6  -1.736 -19.099   2.894
   41   2HB   ALA   6          2HB       ALA   6  -1.895 -19.557   1.197
   42   3HB   ALA   6          3HB       ALA   6  -1.737 -17.857   1.641
   43    H    TYR   7           H        TYR   7   2.173 -17.944   0.709
   44    HA   TYR   7           HA       TYR   7   2.029 -15.480   2.419
   45   1HB   TYR   7          2HB       TYR   7   4.582 -15.522   1.895
   46   2HB   TYR   7          1HB       TYR   7   3.954 -16.683   3.063
   47    HD1  TYR   7           1HD      TYR   7   4.188 -19.007   2.705
   48    HD2  TYR   7           2HD      TYR   7   4.829 -16.278  -0.550
   49    HE1  TYR   7           1HE      TYR   7   5.026 -20.873   1.304
   50    HE2  TYR   7           2HE      TYR   7   5.666 -18.144  -1.950
   51    HH   TYR   7           HH       TYR   7   5.832 -21.471  -0.668
   52    H    VAL   8           H        VAL   8   0.556 -15.369   0.100
   53    HA   VAL   8           HA       VAL   8   2.324 -13.918  -1.842
   54    HB   VAL   8           HB       VAL   8  -0.372 -15.263  -2.220
   55   1HG1  VAL   8          1HG1      VAL   8   1.129 -14.933  -4.628
   56   2HG1  VAL   8          2HG1      VAL   8   1.078 -13.374  -3.804
   57   3HG1  VAL   8          3HG1      VAL   8  -0.423 -14.208  -4.205
   58   1HG2  VAL   8          1HG2      VAL   8   1.924 -16.580  -1.750
   59   2HG2  VAL   8          2HG2      VAL   8   2.142 -16.271  -3.474
   60   3HG2  VAL   8          3HG2      VAL   8   0.732 -17.167  -2.910
   61    H    SER   9           H        SER   9   1.737 -12.270   0.160
   62    HA   SER   9           HA       SER   9  -0.877 -10.951  -0.218
   63   1HB   SER   9          2HB       SER   9   1.099 -11.231   1.802
   64   2HB   SER   9          1HB       SER   9   1.010  -9.513   1.420
   65    HG   SER   9           HG       SER   9  -1.302 -11.092   1.807
   66    H    ASP  10           H        ASP  10   0.429 -10.805  -2.628
   67    HA   ASP  10           HA       ASP  10   2.203  -8.609  -3.016
   68   1HB   ASP  10          2HB       ASP  10   1.495 -10.574  -4.540
   69   2HB   ASP  10          1HB       ASP  10   0.111  -9.569  -4.972
   70    H    GLU  11           H        GLU  11  -1.363  -8.795  -3.201
   71    HA   GLU  11           HA       GLU  11  -2.046  -6.277  -4.133
   72   1HB   GLU  11          2HB       GLU  11  -3.147  -8.112  -2.020
   73   2HB   GLU  11          1HB       GLU  11  -3.939  -6.565  -2.326
   74   1HG   GLU  11          2HG       GLU  11  -3.246  -8.260  -4.687
   75   2HG   GLU  11          1HG       GLU  11  -4.611  -8.760  -3.688
   76    H    ILE  12           H        ILE  12  -1.183  -7.077  -0.747
   77    HA   ILE  12           HA       ILE  12  -1.554  -4.567   0.450
   78    HB   ILE  12           HB       ILE  12   0.444  -6.803   0.823
   79   1HG1  ILE  12          2HG1      ILE  12  -1.989  -7.151   1.328
   80   2HG1  ILE  12          1HG1      ILE  12  -0.957  -7.317   2.749
   81   1HG2  ILE  12          1HG2      ILE  12   0.409  -4.113   2.047
   82   2HG2  ILE  12          2HG2      ILE  12   1.718  -5.292   1.956
   83   3HG2  ILE  12          3HG2      ILE  12   0.478  -5.446   3.201
   84   1HD1  ILE  12          1HD1      ILE  12  -1.977  -5.593   3.780
   85   2HD1  ILE  12          2HD1      ILE  12  -3.170  -5.611   2.480
   86   3HD1  ILE  12          3HD1      ILE  12  -1.762  -4.554   2.372
   87    H    VAL  13           H        VAL  13   1.382  -5.759  -1.225
   88    HA   VAL  13           HA       VAL  13   2.959  -3.404  -0.881
   89    HB   VAL  13           HB       VAL  13   2.875  -5.566  -3.006
   90   1HG1  VAL  13          1HG1      VAL  13   5.446  -4.274  -2.579
   91   2HG1  VAL  13          2HG1      VAL  13   4.234  -3.120  -3.134
   92   3HG1  VAL  13          3HG1      VAL  13   4.580  -4.562  -4.089
   93   1HG2  VAL  13          1HG2      VAL  13   5.141  -5.607  -1.229
   94   2HG2  VAL  13          2HG2      VAL  13   3.894  -6.836  -1.450
   95   3HG2  VAL  13          3HG2      VAL  13   3.658  -5.540  -0.276
   96    H    TYR  14           H        TYR  14   0.522  -4.277  -3.301
   97    HA   TYR  14           HA       TYR  14   1.045  -2.202  -5.194
   98   1HB   TYR  14          2HB       TYR  14  -0.560  -4.355  -5.046
   99   2HB   TYR  14          1HB       TYR  14  -1.742  -3.110  -4.640
  100    HD1  TYR  14           1HD      TYR  14  -1.572  -4.877  -7.210
  101    HD2  TYR  14           2HD      TYR  14  -0.261  -0.895  -6.274
  102    HE1  TYR  14           1HE      TYR  14  -1.745  -4.257  -9.606
  103    HE2  TYR  14           2HE      TYR  14  -0.435  -0.274  -8.668
  104    HH   TYR  14           HH       TYR  14  -0.313  -1.873 -10.993
  105    H    LYS  15           H        LYS  15  -1.302  -2.315  -2.485
  106    HA   LYS  15           HA       LYS  15  -2.429   0.244  -2.747
  107   1HB   LYS  15          2HB       LYS  15  -2.679  -1.831  -1.061
  108   2HB   LYS  15          1HB       LYS  15  -1.713  -0.772  -0.031
  109   1HG   LYS  15          2HG       LYS  15  -3.872  -0.075   0.504
  110   2HG   LYS  15          1HG       LYS  15  -3.450   1.061  -0.780
  111   1HD   LYS  15          2HD       LYS  15  -5.099   0.278  -2.098
  112   2HD   LYS  15          1HD       LYS  15  -4.531  -1.380  -1.903
  113   1HE   LYS  15          2HE       LYS  15  -5.929  -0.196   0.445
  114   2HE   LYS  15          1HE       LYS  15  -6.934  -0.574  -0.968
  115   1HZ   LYS  15          1HZ       LYS  15  -5.087  -2.398   0.472
  116   2HZ   LYS  15          2HZ       LYS  15  -5.760  -2.763  -1.044
  117   3HZ   LYS  15          3HZ       LYS  15  -6.768  -2.556   0.308
  118    H    ILE  16           H        ILE  16   0.755  -0.666  -1.552
  119    HA   ILE  16           HA       ILE  16   1.349   1.882  -0.282
  120    HB   ILE  16           HB       ILE  16   3.178  -0.287  -1.357
  121   1HG1  ILE  16          2HG1      ILE  16   1.355  -1.095   0.197
  122   2HG1  ILE  16          1HG1      ILE  16   2.988  -1.333   0.818
  123   1HG2  ILE  16          1HG2      ILE  16   4.818   0.577   0.130
  124   2HG2  ILE  16          2HG2      ILE  16   3.636   1.566   0.988
  125   3HG2  ILE  16          3HG2      ILE  16   4.125   1.998  -0.650
  126   1HD1  ILE  16          1HD1      ILE  16   0.837   0.190   1.971
  127   2HD1  ILE  16          2HD1      ILE  16   2.192   1.263   1.625
  128   3HD1  ILE  16          3HD1      ILE  16   2.429  -0.155   2.647
  129    H    ASN  17           H        ASN  17   2.727   0.378  -3.241
  130    HA   ASN  17           HA       ASN  17   4.141   2.492  -4.311
  131   1HB   ASN  17          2HB       ASN  17   2.417   0.316  -5.460
  132   2HB   ASN  17          1HB       ASN  17   3.119   1.506  -6.557
  133   1HD2  ASN  17          1HD2      ASN  17   3.744  -1.510  -5.513
  134   2HD2  ASN  17          2HD2      ASN  17   5.440  -1.483  -5.456
  135    H    LYS  18           H        LYS  18   0.649   2.239  -4.039
  136    HA   LYS  18           HA       LYS  18   0.061   4.443  -5.858
  137   1HB   LYS  18          2HB       LYS  18  -1.447   2.938  -3.701
  138   2HB   LYS  18          1HB       LYS  18  -2.193   4.217  -4.660
  139   1HG   LYS  18          2HG       LYS  18  -2.166   2.971  -6.604
  140   2HG   LYS  18          1HG       LYS  18  -0.742   2.051  -6.116
  141   1HD   LYS  18          2HD       LYS  18  -2.020   0.705  -4.598
  142   2HD   LYS  18          1HD       LYS  18  -3.429   1.754  -4.759
  143   1HE   LYS  18          2HE       LYS  18  -2.285   0.400  -7.199
  144   2HE   LYS  18          1HE       LYS  18  -3.401  -0.471  -6.128
  145   1HZ   LYS  18          1HZ       LYS  18  -3.919   2.242  -7.220
  146   2HZ   LYS  18          2HZ       LYS  18  -4.997   1.273  -6.332
  147   3HZ   LYS  18          3HZ       LYS  18  -4.537   0.819  -7.903
  148    H    ILE  19           H        ILE  19  -0.272   4.132  -2.298
  149    HA   ILE  19           HA       ILE  19  -0.712   6.805  -1.628
  150    HB   ILE  19           HB       ILE  19   0.961   4.667  -0.269
  151   1HG1  ILE  19          2HG1      ILE  19  -1.824   5.485   0.499
  152   2HG1  ILE  19          1HG1      ILE  19  -1.595   4.408  -0.880
  153   1HG2  ILE  19          1HG2      ILE  19  -0.031   6.174   1.752
  154   2HG2  ILE  19          2HG2      ILE  19   0.198   7.423   0.528
  155   3HG2  ILE  19          3HG2      ILE  19   1.564   6.438   1.050
  156   1HD1  ILE  19          1HD1      ILE  19  -1.748   3.576   1.732
  157   2HD1  ILE  19          2HD1      ILE  19  -0.005   3.679   1.490
  158   3HD1  ILE  19          3HD1      ILE  19  -0.984   2.660   0.434
  159    H    VAL  20           H        VAL  20   2.496   5.203  -1.798
  160    HA   VAL  20           HA       VAL  20   4.196   7.351  -1.334
  161    HB   VAL  20           HB       VAL  20   5.579   6.139  -3.257
  162   1HG1  VAL  20          1HG1      VAL  20   6.153   5.877  -0.957
  163   2HG1  VAL  20          2HG1      VAL  20   5.999   4.252  -1.625
  164   3HG1  VAL  20          3HG1      VAL  20   4.703   4.928  -0.638
  165   1HG2  VAL  20          1HG2      VAL  20   4.600   4.392  -4.283
  166   2HG2  VAL  20          2HG2      VAL  20   3.075   4.910  -3.572
  167   3HG2  VAL  20          3HG2      VAL  20   4.071   3.719  -2.742
  168    H    GLU  21           H        GLU  21   3.415   6.372  -4.675
  169    HA   GLU  21           HA       GLU  21   4.252   8.641  -6.039
  170   1HB   GLU  21          2HB       GLU  21   1.969   6.707  -6.410
  171   2HB   GLU  21          1HB       GLU  21   2.255   7.989  -7.588
  172   1HG   GLU  21          2HG       GLU  21   4.728   6.631  -6.873
  173   2HG   GLU  21          1HG       GLU  21   3.531   5.503  -7.511
  174    H    ARG  22           H        ARG  22   1.365   8.293  -4.053
  175    HA   ARG  22           HA       ARG  22  -0.007  10.657  -5.007
  176   1HB   ARG  22          2HB       ARG  22  -0.320   8.525  -3.102
  177   2HB   ARG  22          1HB       ARG  22  -0.668  10.058  -2.303
  178   1HG   ARG  22          2HG       ARG  22  -2.293  10.642  -4.003
  179   2HG   ARG  22          1HG       ARG  22  -1.864   9.222  -4.958
  180   1HD   ARG  22          2HD       ARG  22  -2.465   8.041  -2.572
  181   2HD   ARG  22          1HD       ARG  22  -3.586   9.416  -2.555
  182    HE   ARG  22           HE       ARG  22  -3.479   8.040  -5.133
  183   1HH1  ARG  22          1HH2      ARG  22  -4.315   6.577  -2.350
  184   2HH1  ARG  22          2HH2      ARG  22  -6.019   6.480  -2.647
  185   1HH2  ARG  22          1HH1      ARG  22  -5.935   8.613  -5.379
  186   2HH2  ARG  22          2HH1      ARG  22  -6.936   7.631  -4.363
  187    H    ARG  23           H        ARG  23   2.355  10.041  -2.426
  188    HA   ARG  23           HA       ARG  23   2.252  12.321  -0.868
  189   1HB   ARG  23          2HB       ARG  23   4.016  10.258  -1.357
  190   2HB   ARG  23          1HB       ARG  23   4.956  11.671  -1.842
  191   1HG   ARG  23          2HG       ARG  23   5.437  11.719   0.404
  192   2HG   ARG  23          1HG       ARG  23   3.922  12.621   0.454
  193   1HD   ARG  23          2HD       ARG  23   2.689  10.743   1.207
  194   2HD   ARG  23          1HD       ARG  23   3.958   9.606   0.706
  195    HE   ARG  23           HE       ARG  23   5.071  10.069   2.734
  196   1HH1  ARG  23          1HH1      ARG  23   2.174  11.506   3.104
  197   2HH1  ARG  23          2HH1      ARG  23   2.711  12.859   4.041
  198   1HH2  ARG  23          1HH2      ARG  23   6.076  12.284   3.434
  199   2HH2  ARG  23          2HH2      ARG  23   4.920  13.301   4.227
  200    H    ARG  24           H        ARG  24   3.740  12.070  -4.111
  201    HA   ARG  24           HA       ARG  24   4.587  14.845  -4.190
  202   1HB   ARG  24          2HB       ARG  24   4.477  12.455  -5.939
  203   2HB   ARG  24          1HB       ARG  24   4.450  13.999  -6.789
  204   1HG   ARG  24          2HG       ARG  24   6.483  14.709  -5.612
  205   2HG   ARG  24          1HG       ARG  24   6.502  13.195  -4.705
  206   1HD   ARG  24          2HD       ARG  24   6.329  12.331  -7.342
  207   2HD   ARG  24          1HD       ARG  24   7.430  13.720  -7.435
  208    HE   ARG  24           HE       ARG  24   7.933  11.872  -5.196
  209   1HH1  ARG  24          1HH2      ARG  24   8.364  12.183  -8.569
  210   2HH1  ARG  24          2HH2      ARG  24  10.039  11.740  -8.547
  211   1HH2  ARG  24          1HH1      ARG  24  10.224  11.582  -5.089
  212   2HH2  ARG  24          2HH1      ARG  24  11.092  11.400  -6.577
  213    H    ALA  25           H        ALA  25   2.036  13.143  -6.066
  214    HA   ALA  25           HA       ALA  25   0.759  15.299  -7.252
  215   1HB   ALA  25          1HB       ALA  25   0.096  12.608  -6.326
  216   2HB   ALA  25          2HB       ALA  25  -0.427  13.439  -7.791
  217   3HB   ALA  25          3HB       ALA  25  -1.308  13.675  -6.282
  218    H    GLU  26           H        GLU  26   0.797  14.420  -3.862
  219    HA   GLU  26           HA       GLU  26  -1.314  16.307  -3.119
  220   1HB   GLU  26          2HB       GLU  26   0.295  14.150  -1.939
  221   2HB   GLU  26          1HB       GLU  26  -0.003  15.486  -0.826
  222   1HG   GLU  26          2HG       GLU  26  -2.450  15.036  -2.160
  223   2HG   GLU  26          1HG       GLU  26  -1.834  13.440  -1.730
  224    H    GLY  27           H        GLY  27   2.221  16.188  -3.212
  225   1HA   GLY  27          2HA       GLY  27   3.203  18.538  -3.475
  226   2HA   GLY  27          1HA       GLY  27   2.274  18.940  -2.030
  227    H    ALA  28           H        ALA  28   4.287  16.099  -2.846
  228    HA   ALA  28           HA       ALA  28   5.336  15.672  -0.269
  229   1HB   ALA  28          1HB       ALA  28   7.329  14.789  -1.839
  230   2HB   ALA  28          2HB       ALA  28   6.117  15.074  -3.089
  231   3HB   ALA  28          3HB       ALA  28   5.772  13.962  -1.763
  232    H    LYS  29           H        LYS  29   8.057  15.819  -0.269
  233    HA   LYS  29           HA       LYS  29   8.684  18.722  -0.691
  234   1HB   LYS  29          2HB       LYS  29   8.769  16.959   1.705
  235   2HB   LYS  29          1HB       LYS  29  10.114  18.086   1.516
  236   1HG   LYS  29          2HG       LYS  29   8.102  19.773   0.965
  237   2HG   LYS  29          1HG       LYS  29   7.225  18.645   2.000
  238   1HD   LYS  29          2HD       LYS  29   9.825  19.263   3.127
  239   2HD   LYS  29          1HD       LYS  29   8.898  20.737   2.842
  240   1HE   LYS  29          2HE       LYS  29   6.947  19.656   4.028
  241   2HE   LYS  29          1HE       LYS  29   8.030  18.319   4.462
  242   1HZ   LYS  29          1HZ       LYS  29   8.061  19.991   6.193
  243   2HZ   LYS  29          2HZ       LYS  29   8.468  21.197   5.065
  244   3HZ   LYS  29          3HZ       LYS  29   9.566  19.948   5.415
  245    H    SER  30           H        SER  30  10.147  15.521   0.008
  246    HA   SER  30           HA       SER  30  12.264  16.140  -2.007
  247   1HB   SER  30          2HB       SER  30  12.493  15.735   0.930
  248   2HB   SER  30          1HB       SER  30  13.708  14.930  -0.058
  249    HG   SER  30           HG       SER  30  14.607  16.827  -0.116
  250    H    THR  31           H        THR  31  13.792  13.862  -1.693
  251    HA   THR  31           HA       THR  31  11.969  11.775  -2.705
  252    HB   THR  31           HB       THR  31  14.202  12.464  -3.703
  253    HG1  THR  31           1HG      THR  31  14.580  10.423  -4.323
  254   1HG2  THR  31          1HG2      THR  31  15.786  10.765  -1.995
  255   2HG2  THR  31          2HG2      THR  31  15.040  12.047  -1.040
  256   3HG2  THR  31          3HG2      THR  31  16.051  12.454  -2.427
  257    H    ASP  32           H        ASP  32  12.949  12.697   0.334
  258    HA   ASP  32           HA       ASP  32  13.850  10.412   1.686
  259   1HB   ASP  32          2HB       ASP  32  12.035  12.720   2.363
  260   2HB   ASP  32          1HB       ASP  32  12.369  11.477   3.570
  261    H    VAL  33           H        VAL  33  10.672  11.063   0.344
  262    HA   VAL  33           HA       VAL  33   9.343   8.895   1.809
  263    HB   VAL  33           HB       VAL  33   8.293  11.042   0.993
  264   1HG1  VAL  33          1HG1      VAL  33   8.601   9.675  -1.699
  265   2HG1  VAL  33          2HG1      VAL  33   9.443  11.138  -1.185
  266   3HG1  VAL  33          3HG1      VAL  33   7.693  11.158  -1.403
  267   1HG2  VAL  33          1HG2      VAL  33   6.205  10.012   0.429
  268   2HG2  VAL  33          2HG2      VAL  33   7.032   8.874   1.492
  269   3HG2  VAL  33          3HG2      VAL  33   7.010   8.598  -0.251
  270    H    SER  34           H        SER  34   8.778   6.862   0.927
  271    HA   SER  34           HA       SER  34   9.228   6.136  -1.839
  272   1HB   SER  34          2HB       SER  34  11.493   6.319  -0.187
  273   2HB   SER  34          1HB       SER  34  11.153   4.595  -0.298
  274    HG   SER  34           HG       SER  34  12.488   5.441  -2.014
  275    H    PHE  35           H        PHE  35   9.360   3.533  -1.886
  276    HA   PHE  35           HA       PHE  35   6.960   2.502  -0.810
  277   1HB   PHE  35          2HB       PHE  35   8.182   1.510  -2.675
  278   2HB   PHE  35          1HB       PHE  35   9.554   1.154  -1.625
  279    HD1  PHE  35           1HD      PHE  35   9.709  -0.970  -0.679
  280    HD2  PHE  35           2HD      PHE  35   5.853   0.550  -1.813
  281    HE1  PHE  35           1HE      PHE  35   8.671  -3.133  -0.049
  282    HE2  PHE  35           2HE      PHE  35   4.816  -1.613  -1.183
  283    HZ   PHE  35           HZ       PHE  35   6.225  -3.454  -0.301
  284    H    SER  36           H        SER  36  10.259   1.615   0.291
  285    HA   SER  36           HA       SER  36   9.605   0.228   2.620
  286   1HB   SER  36          2HB       SER  36  11.864   1.867   1.609
  287   2HB   SER  36          1HB       SER  36  11.865   1.563   3.344
  288    HG   SER  36           HG       SER  36  12.413  -0.112   1.288
  289    H    SER  37           H        SER  37  10.092   3.766   2.313
  290    HA   SER  37           HA       SER  37   9.604   4.427   5.045
  291   1HB   SER  37          2HB       SER  37  10.566   6.095   3.720
  292   2HB   SER  37          1HB       SER  37   9.465   5.801   2.379
  293    HG   SER  37           HG       SER  37   8.663   6.834   4.897
  294    H    ILE  38           H        ILE  38   7.334   4.950   2.316
  295    HA   ILE  38           HA       ILE  38   5.030   5.460   3.859
  296    HB   ILE  38           HB       ILE  38   5.568   4.312   1.120
  297   1HG1  ILE  38          2HG1      ILE  38   6.009   6.733   1.671
  298   2HG1  ILE  38          1HG1      ILE  38   4.818   6.504   0.393
  299   1HG2  ILE  38          1HG2      ILE  38   2.915   5.150   1.116
  300   2HG2  ILE  38          2HG2      ILE  38   3.058   4.244   2.622
  301   3HG2  ILE  38          3HG2      ILE  38   3.467   3.477   1.088
  302   1HD1  ILE  38          1HD1      ILE  38   3.587   6.501   3.033
  303   2HD1  ILE  38          2HD1      ILE  38   3.187   7.466   1.612
  304   3HD1  ILE  38          3HD1      ILE  38   4.458   8.001   2.712
  305    H    SER  39           H        SER  39   6.367   2.347   2.763
  306    HA   SER  39           HA       SER  39   4.138   0.764   3.750
  307   1HB   SER  39          2HB       SER  39   5.786   0.185   1.921
  308   2HB   SER  39          1HB       SER  39   7.004  -0.043   3.173
  309    HG   SER  39           HG       SER  39   6.084  -2.018   2.817
  310    H    THR  40           H        THR  40   7.464   1.349   4.952
  311    HA   THR  40           HA       THR  40   7.449  -0.215   7.266
  312    HB   THR  40           HB       THR  40   8.596   2.532   6.694
  313    HG1  THR  40           1HG      THR  40   9.791  -0.036   6.745
  314   1HG2  THR  40          1HG2      THR  40   8.520   1.031   9.165
  315   2HG2  THR  40          2HG2      THR  40   9.197   2.630   8.859
  316   3HG2  THR  40          3HG2      THR  40  10.180   1.190   8.592
  317    H    MET  41           H        MET  41   6.146   3.099   6.895
  318    HA   MET  41           HA       MET  41   5.386   3.417   9.653
  319   1HB   MET  41          2HB       MET  41   4.017   5.282   8.674
  320   2HB   MET  41          1HB       MET  41   5.689   5.281   8.118
  321   1HG   MET  41          2HG       MET  41   5.126   4.622   5.981
  322   2HG   MET  41          1HG       MET  41   3.696   3.744   6.516
  323   1HE   MET  41          1HE       MET  41   1.981   4.098   5.764
  324   2HE   MET  41          2HE       MET  41   1.686   5.359   4.567
  325   3HE   MET  41          3HE       MET  41   0.926   5.463   6.154
  326    H    LEU  42           H        LEU  42   3.783   1.943   6.876
  327    HA   LEU  42           HA       LEU  42   1.124   1.859   7.994
  328   1HB   LEU  42          2HB       LEU  42   2.513   1.113   5.634
  329   2HB   LEU  42          1HB       LEU  42   1.711  -0.341   6.228
  330    HG   LEU  42           HG       LEU  42   0.419   2.336   5.645
  331   1HD1  LEU  42          1HD1      LEU  42  -0.371   1.378   3.735
  332   2HD1  LEU  42          2HD1      LEU  42  -0.616  -0.188   4.509
  333   3HD1  LEU  42          3HD1      LEU  42   0.989   0.274   3.941
  334   1HD2  LEU  42          1HD2      LEU  42  -0.393   0.072   7.360
  335   2HD2  LEU  42          2HD2      LEU  42  -1.611   0.573   6.187
  336   3HD2  LEU  42          3HD2      LEU  42  -0.974   1.738   7.347
  337    H    LEU  43           H        LEU  43   3.737  -0.591   7.839
  338    HA   LEU  43           HA       LEU  43   2.311  -2.603   9.303
  339   1HB   LEU  43          2HB       LEU  43   4.614  -2.429   7.862
  340   2HB   LEU  43          1HB       LEU  43   5.263  -2.490   9.503
  341    HG   LEU  43           HG       LEU  43   3.389  -4.422   9.697
  342   1HD1  LEU  43          1HD1      LEU  43   2.570  -4.461   7.489
  343   2HD1  LEU  43          2HD1      LEU  43   3.752  -5.769   7.497
  344   3HD1  LEU  43          3HD1      LEU  43   4.170  -4.207   6.793
  345   1HD2  LEU  43          1HD2      LEU  43   5.403  -5.956   8.845
  346   2HD2  LEU  43          2HD2      LEU  43   5.519  -5.054  10.356
  347   3HD2  LEU  43          3HD2      LEU  43   6.274  -4.421   8.893
  348    H    GLU  44           H        GLU  44   3.811   0.324  10.344
  349    HA   GLU  44           HA       GLU  44   4.604  -0.455  13.005
  350   1HB   GLU  44          2HB       GLU  44   3.923   2.056  11.510
  351   2HB   GLU  44          1HB       GLU  44   4.024   2.143  13.268
  352   1HG   GLU  44          2HG       GLU  44   6.248   0.628  12.191
  353   2HG   GLU  44          1HG       GLU  44   6.172   2.230  11.456
  354    H    LEU  45           H        LEU  45   1.604   0.457  11.470
  355    HA   LEU  45           HA       LEU  45   0.116   0.346  14.049
  356   1HB   LEU  45          2HB       LEU  45  -0.241   1.476  11.298
  357   2HB   LEU  45          1HB       LEU  45  -1.691   1.090  12.225
  358    HG   LEU  45           HG       LEU  45  -0.309   2.376  14.138
  359   1HD1  LEU  45          1HD1      LEU  45   1.601   3.181  13.172
  360   2HD1  LEU  45          2HD1      LEU  45   0.524   4.459  12.604
  361   3HD1  LEU  45          3HD1      LEU  45   0.927   3.109  11.545
  362   1HD2  LEU  45          1HD2      LEU  45  -2.444   3.190  13.720
  363   2HD2  LEU  45          2HD2      LEU  45  -2.162   3.332  11.987
  364   3HD2  LEU  45          3HD2      LEU  45  -1.472   4.521  13.091
  365    H    GLY  46           H        GLY  46   1.018  -1.651  11.466
  366   1HA   GLY  46          2HA       GLY  46   0.401  -3.913  11.111
  367   2HA   GLY  46          1HA       GLY  46  -0.907  -3.710  12.279
  368    H    LEU  47           H        LEU  47  -0.652  -1.309   9.805
  369    HA   LEU  47           HA       LEU  47  -2.020  -0.852   7.930
  370   1HB   LEU  47          2HB       LEU  47  -1.231  -3.507   7.829
  371   2HB   LEU  47          1HB       LEU  47  -2.985  -3.616   7.670
  372    HG   LEU  47           HG       LEU  47  -2.361  -1.486   6.024
  373   1HD1  LEU  47          1HD1      LEU  47  -0.538  -2.572   4.556
  374   2HD1  LEU  47          2HD1      LEU  47  -0.145  -3.537   5.978
  375   3HD1  LEU  47          3HD1      LEU  47  -0.009  -1.780   6.040
  376   1HD2  LEU  47          1HD2      LEU  47  -3.902  -3.447   5.638
  377   2HD2  LEU  47          2HD2      LEU  47  -2.487  -4.400   5.192
  378   3HD2  LEU  47          3HD2      LEU  47  -2.948  -3.000   4.224
  379    H    ARG  48           H        ARG  48  -3.116  -1.661  10.886
  380    HA   ARG  48           HA       ARG  48  -5.919  -2.252  10.385
  381   1HB   ARG  48          2HB       ARG  48  -4.071  -1.741  12.629
  382   2HB   ARG  48          1HB       ARG  48  -5.736  -1.240  12.932
  383   1HG   ARG  48          2HG       ARG  48  -5.211  -3.932  11.712
  384   2HG   ARG  48          1HG       ARG  48  -5.003  -3.716  13.450
  385   1HD   ARG  48          2HD       ARG  48  -7.431  -2.447  12.936
  386   2HD   ARG  48          1HD       ARG  48  -7.479  -3.891  11.901
  387    HE   ARG  48           HE       ARG  48  -7.682  -3.953  14.742
  388   1HH1  ARG  48          1HH2      ARG  48  -7.722  -6.088  12.343
  389   2HH1  ARG  48          2HH2      ARG  48  -6.705  -7.290  13.064
  390   1HH2  ARG  48          1HH1      ARG  48  -5.594  -5.207  15.605
  391   2HH2  ARG  48          2HH1      ARG  48  -5.501  -6.791  14.911
  392    H    VAL  49           H        VAL  49  -4.837   0.525  12.296
  393    HA   VAL  49           HA       VAL  49  -6.952   2.241  11.875
  394    HB   VAL  49           HB       VAL  49  -3.980   2.848  11.984
  395   1HG1  VAL  49          1HG1      VAL  49  -6.394   4.569  11.961
  396   2HG1  VAL  49          2HG1      VAL  49  -4.733   4.951  11.505
  397   3HG1  VAL  49          3HG1      VAL  49  -5.201   4.939  13.206
  398   1HG2  VAL  49          1HG2      VAL  49  -5.820   3.140  14.311
  399   2HG2  VAL  49          2HG2      VAL  49  -4.134   2.627  14.272
  400   3HG2  VAL  49          3HG2      VAL  49  -5.410   1.497  13.821
  401    H    TYR  50           H        TYR  50  -4.245   1.657   9.644
  402    HA   TYR  50           HA       TYR  50  -4.591   3.724   7.785
  403   1HB   TYR  50          2HB       TYR  50  -2.802   2.093   7.654
  404   2HB   TYR  50          1HB       TYR  50  -3.957   0.778   7.422
  405    HD1  TYR  50           1HD      TYR  50  -3.025   4.082   5.909
  406    HD2  TYR  50           2HD      TYR  50  -4.421   0.075   5.244
  407    HE1  TYR  50           1HE      TYR  50  -2.980   4.475   3.460
  408    HE2  TYR  50           2HE      TYR  50  -4.374   0.466   2.796
  409    HH   TYR  50           HH       TYR  50  -3.255   1.943   1.192
  410    H    GLU  51           H        GLU  51  -6.206   0.519   7.707
  411    HA   GLU  51           HA       GLU  51  -7.903   1.059   5.496
  412   1HB   GLU  51          2HB       GLU  51  -7.214  -1.039   7.091
  413   2HB   GLU  51          1HB       GLU  51  -8.843  -0.712   7.670
  414   1HG   GLU  51          2HG       GLU  51  -8.828  -0.551   4.809
  415   2HG   GLU  51          1HG       GLU  51  -8.083  -2.072   5.296
  416    H    ALA  52           H        ALA  52  -7.973   2.282   8.702
  417    HA   ALA  52           HA       ALA  52 -10.780   2.574   9.158
  418   1HB   ALA  52          1HB       ALA  52  -8.721   4.611   9.979
  419   2HB   ALA  52          2HB       ALA  52  -8.629   2.971  10.623
  420   3HB   ALA  52          3HB       ALA  52 -10.063   3.954  10.917
  421    H    GLN  53           H        GLN  53  -8.420   4.784   7.627
  422    HA   GLN  53           HA       GLN  53 -10.610   6.563   6.770
  423   1HB   GLN  53          2HB       GLN  53  -8.807   8.096   6.285
  424   2HB   GLN  53          1HB       GLN  53  -8.442   7.332   7.833
  425   1HG   GLN  53          2HG       GLN  53  -7.165   5.574   6.375
  426   2HG   GLN  53          1HG       GLN  53  -7.188   6.839   5.144
  427   1HE2  GLN  53          1HE2      GLN  53  -6.055   6.101   8.451
  428   2HE2  GLN  53          2HE2      GLN  53  -4.879   7.326   8.495
  429    H    MET  54           H        MET  54 -10.469   3.926   5.541
  430    HA   MET  54           HA       MET  54  -9.112   3.934   3.021
  431   1HB   MET  54          2HB       MET  54 -10.954   2.338   4.541
  432   2HB   MET  54          1HB       MET  54 -11.543   2.449   2.882
  433   1HG   MET  54          2HG       MET  54  -8.627   1.970   3.212
  434   2HG   MET  54          1HG       MET  54  -9.693   0.637   3.657
  435   1HE   MET  54          1HE       MET  54  -8.088  -0.377   0.743
  436   2HE   MET  54          2HE       MET  54  -9.636  -1.204   0.904
  437   3HE   MET  54          3HE       MET  54  -8.749  -0.721   2.346
  438    H    GLU  55           H        GLU  55 -12.492   4.790   3.855
  439    HA   GLU  55           HA       GLU  55 -12.588   6.421   1.342
  440   1HB   GLU  55          2HB       GLU  55 -13.702   4.264   0.991
  441   2HB   GLU  55          1HB       GLU  55 -14.663   4.501   2.451
  442   1HG   GLU  55          2HG       GLU  55 -15.572   6.614   1.397
  443   2HG   GLU  55          1HG       GLU  55 -14.773   6.130  -0.099
  444    H    ARG  56           H        ARG  56 -14.223   8.161   1.461
  445    HA   ARG  56           HA       ARG  56 -15.224   8.790   4.200
  446   1HB   ARG  56          2HB       ARG  56 -14.261  11.090   3.915
  447   2HB   ARG  56          1HB       ARG  56 -13.025   9.833   3.983
  448   1HG   ARG  56          2HG       ARG  56 -12.333  10.265   1.877
  449   2HG   ARG  56          1HG       ARG  56 -13.988  10.285   1.262
  450   1HD   ARG  56          2HD       ARG  56 -13.740  12.534   1.033
  451   2HD   ARG  56          1HD       ARG  56 -13.778  12.625   2.805
  452    HE   ARG  56           HE       ARG  56 -11.176  11.908   1.606
  453   1HH1  ARG  56          1HH2      ARG  56 -12.906  14.735   1.624
  454   2HH1  ARG  56          2HH2      ARG  56 -11.798  15.637   2.604
  455   1HH2  ARG  56          1HH1      ARG  56  -9.883  12.874   3.451
  456   2HH2  ARG  56          2HH1      ARG  56 -10.087  14.583   3.638
  Start of MODEL   12
    1   1H    ALA   2          1H        ALA   2  11.928 -21.381  -3.770
    2   2H    ALA   2          2H        ALA   2  12.448 -21.666  -2.176
    3   3H    ALA   2          3H        ALA   2  13.120 -22.550  -3.463
    4    HA   ALA   2           HA       ALA   2  14.474 -20.597  -2.489
    5   1HB   ALA   2          1HB       ALA   2  14.927 -20.091  -5.093
    6   2HB   ALA   2          2HB       ALA   2  13.889 -21.506  -5.269
    7   3HB   ALA   2          3HB       ALA   2  15.387 -21.620  -4.345
    8    H    LYS   3           H        LYS   3  12.972 -19.436  -5.457
    9    HA   LYS   3           HA       LYS   3  12.630 -16.767  -4.253
   10   1HB   LYS   3          2HB       LYS   3  13.604 -17.087  -6.488
   11   2HB   LYS   3          1HB       LYS   3  12.132 -17.898  -7.026
   12   1HG   LYS   3          2HG       LYS   3  10.891 -15.934  -7.045
   13   2HG   LYS   3          1HG       LYS   3  11.921 -15.151  -5.845
   14   1HD   LYS   3          2HD       LYS   3  13.175 -15.890  -8.448
   15   2HD   LYS   3          1HD       LYS   3  12.063 -14.521  -8.444
   16   1HE   LYS   3          2HE       LYS   3  14.150 -14.662  -6.290
   17   2HE   LYS   3          1HE       LYS   3  14.629 -14.128  -7.913
   18   1HZ   LYS   3          1HZ       LYS   3  12.383 -12.796  -7.686
   19   2HZ   LYS   3          2HZ       LYS   3  13.849 -12.165  -7.107
   20   3HZ   LYS   3          3HZ       LYS   3  12.755 -12.898  -6.035
   21    H    VAL   4           H        VAL   4  10.886 -18.139  -2.826
   22    HA   VAL   4           HA       VAL   4   8.386 -18.941  -3.697
   23    HB   VAL   4           HB       VAL   4   9.116 -18.927  -1.366
   24   1HG1  VAL   4          1HG1      VAL   4   8.941 -15.914  -1.660
   25   2HG1  VAL   4          2HG1      VAL   4  10.397 -16.862  -1.356
   26   3HG1  VAL   4          3HG1      VAL   4   9.144 -16.748  -0.119
   27   1HG2  VAL   4          1HG2      VAL   4   6.619 -18.677  -2.047
   28   2HG2  VAL   4          2HG2      VAL   4   6.781 -17.019  -1.468
   29   3HG2  VAL   4          3HG2      VAL   4   7.053 -18.369  -0.365
   30    H    GLN   5           H        GLN   5   6.454 -17.887  -4.328
   31    HA   GLN   5           HA       GLN   5   6.705 -15.376  -5.725
   32   1HB   GLN   5          2HB       GLN   5   4.340 -17.051  -4.822
   33   2HB   GLN   5          1HB       GLN   5   4.218 -15.696  -5.946
   34   1HG   GLN   5          2HG       GLN   5   4.693 -17.138  -7.610
   35   2HG   GLN   5          1HG       GLN   5   6.319 -17.272  -6.934
   36   1HE2  GLN   5          1HE2      GLN   5   3.694 -19.141  -7.822
   37   2HE2  GLN   5          2HE2      GLN   5   3.963 -20.482  -6.816
   38    H    ALA   6           H        ALA   6   5.541 -13.378  -5.194
   39    HA   ALA   6           HA       ALA   6   5.052 -11.616  -3.693
   40   1HB   ALA   6          1HB       ALA   6   3.798 -13.327  -1.706
   41   2HB   ALA   6          2HB       ALA   6   3.356 -13.825  -3.339
   42   3HB   ALA   6          3HB       ALA   6   3.048 -12.173  -2.808
   43    H    TYR   7           H        TYR   7   7.405 -11.508  -3.134
   44    HA   TYR   7           HA       TYR   7   8.178 -12.774  -0.560
   45   1HB   TYR   7          2HB       TYR   7   9.544 -12.602  -2.780
   46   2HB   TYR   7          1HB       TYR   7   9.848 -10.939  -2.276
   47    HD1  TYR   7           1HD      TYR   7  10.339 -14.501  -1.402
   48    HD2  TYR   7           2HD      TYR   7  11.262 -10.433  -0.384
   49    HE1  TYR   7           1HE      TYR   7  12.113 -15.290   0.141
   50    HE2  TYR   7           2HE      TYR   7  13.036 -11.222   1.161
   51    HH   TYR   7           HH       TYR   7  14.515 -13.398   1.298
   52    H    VAL   8           H        VAL   8   9.308 -11.302   1.049
   53    HA   VAL   8           HA       VAL   8   9.200  -9.441   2.504
   54    HB   VAL   8           HB       VAL   8   8.903  -8.259  -0.267
   55   1HG1  VAL   8          1HG1      VAL   8   9.882  -6.316   1.553
   56   2HG1  VAL   8          2HG1      VAL   8   8.423  -6.991   2.275
   57   3HG1  VAL   8          3HG1      VAL   8   8.359  -6.282   0.663
   58   1HG2  VAL   8          1HG2      VAL   8  11.149  -8.450  -0.311
   59   2HG2  VAL   8          2HG2      VAL   8  11.065  -9.330   1.213
   60   3HG2  VAL   8          3HG2      VAL   8  11.288  -7.581   1.216
   61    H    SER   9           H        SER   9   7.037  -7.870   0.235
   62    HA   SER   9           HA       SER   9   4.806  -8.202   2.212
   63   1HB   SER   9          2HB       SER   9   5.091  -6.026   0.141
   64   2HB   SER   9          1HB       SER   9   4.178  -5.989   1.647
   65    HG   SER   9           HG       SER   9   5.942  -5.487   2.693
   66    H    ASP  10           H        ASP  10   2.870  -9.032   1.446
   67    HA   ASP  10           HA       ASP  10   2.801 -10.309  -1.143
   68   1HB   ASP  10          2HB       ASP  10   0.609  -9.769   0.884
   69   2HB   ASP  10          1HB       ASP  10   0.589 -11.014  -0.364
   70    H    GLU  11           H        GLU  11  -0.259  -9.337  -1.049
   71    HA   GLU  11           HA       GLU  11  -0.076  -7.552  -3.285
   72   1HB   GLU  11          2HB       GLU  11  -2.515  -7.337  -2.874
   73   2HB   GLU  11          1HB       GLU  11  -1.991  -9.017  -2.762
   74   1HG   GLU  11          2HG       GLU  11  -1.718  -7.741  -0.188
   75   2HG   GLU  11          1HG       GLU  11  -3.360  -7.520  -0.793
   76    H    ILE  12           H        ILE  12   0.309  -7.011   0.082
   77    HA   ILE  12           HA       ILE  12  -0.746  -4.433   0.505
   78    HB   ILE  12           HB       ILE  12   1.735  -5.870   1.470
   79   1HG1  ILE  12          2HG1      ILE  12  -0.582  -6.717   2.046
   80   2HG1  ILE  12          1HG1      ILE  12   0.409  -6.292   3.443
   81   1HG2  ILE  12          1HG2      ILE  12   0.557  -3.291   2.552
   82   2HG2  ILE  12          2HG2      ILE  12   2.064  -3.409   1.642
   83   3HG2  ILE  12          3HG2      ILE  12   1.929  -4.174   3.225
   84   1HD1  ILE  12          1HD1      ILE  12  -1.610  -4.429   2.162
   85   2HD1  ILE  12          2HD1      ILE  12  -0.708  -4.144   3.650
   86   3HD1  ILE  12          3HD1      ILE  12  -1.934  -5.411   3.589
   87    H    VAL  13           H        VAL  13   2.151  -5.416  -1.259
   88    HA   VAL  13           HA       VAL  13   3.655  -3.089  -1.426
   89    HB   VAL  13           HB       VAL  13   4.240  -3.936  -3.705
   90   1HG1  VAL  13          1HG1      VAL  13   5.122  -6.030  -2.957
   91   2HG1  VAL  13          2HG1      VAL  13   3.823  -6.235  -1.783
   92   3HG1  VAL  13          3HG1      VAL  13   5.054  -4.997  -1.529
   93   1HG2  VAL  13          1HG2      VAL  13   2.978  -6.172  -4.243
   94   2HG2  VAL  13          2HG2      VAL  13   2.226  -4.637  -4.677
   95   3HG2  VAL  13          3HG2      VAL  13   1.709  -5.492  -3.223
   96    H    TYR  14           H        TYR  14   0.747  -3.863  -3.367
   97    HA   TYR  14           HA       TYR  14   0.727  -1.469  -4.934
   98   1HB   TYR  14          2HB       TYR  14  -1.460  -3.333  -3.959
   99   2HB   TYR  14          1HB       TYR  14  -1.694  -2.111  -5.209
  100    HD1  TYR  14           1HD      TYR  14  -0.375  -2.230  -7.330
  101    HD2  TYR  14           2HD      TYR  14  -0.361  -5.389  -4.425
  102    HE1  TYR  14           1HE      TYR  14   0.538  -3.789  -9.033
  103    HE2  TYR  14           2HE      TYR  14   0.552  -6.953  -6.126
  104    HH   TYR  14           HH       TYR  14   0.959  -7.236  -8.330
  105    H    LYS  15           H        LYS  15  -1.359  -2.289  -2.150
  106    HA   LYS  15           HA       LYS  15  -2.645   0.092  -1.727
  107   1HB   LYS  15          2HB       LYS  15  -2.292  -2.253  -0.380
  108   2HB   LYS  15          1HB       LYS  15  -1.476  -1.129   0.706
  109   1HG   LYS  15          2HG       LYS  15  -3.518  -0.597   1.507
  110   2HG   LYS  15          1HG       LYS  15  -3.811   0.212  -0.032
  111   1HD   LYS  15          2HD       LYS  15  -4.423  -2.693   0.591
  112   2HD   LYS  15          1HD       LYS  15  -5.607  -1.396   0.426
  113   1HE   LYS  15          2HE       LYS  15  -5.137  -1.131  -1.910
  114   2HE   LYS  15          1HE       LYS  15  -3.685  -2.144  -1.798
  115   1HZ   LYS  15          1HZ       LYS  15  -5.560  -3.430  -2.624
  116   2HZ   LYS  15          2HZ       LYS  15  -6.469  -3.032  -1.246
  117   3HZ   LYS  15          3HZ       LYS  15  -5.079  -3.998  -1.100
  118    H    ILE  16           H        ILE  16   0.735  -0.612  -0.884
  119    HA   ILE  16           HA       ILE  16   1.185   1.853   0.570
  120    HB   ILE  16           HB       ILE  16   3.116   0.001  -0.865
  121   1HG1  ILE  16          2HG1      ILE  16   1.490  -1.088   0.770
  122   2HG1  ILE  16          1HG1      ILE  16   3.199  -1.291   1.158
  123   1HG2  ILE  16          1HG2      ILE  16   4.189   2.067  -0.185
  124   2HG2  ILE  16          2HG2      ILE  16   4.669   0.802   0.948
  125   3HG2  ILE  16          3HG2      ILE  16   3.441   1.980   1.410
  126   1HD1  ILE  16          1HD1      ILE  16   2.939  -0.216   3.119
  127   2HD1  ILE  16          2HD1      ILE  16   1.201  -0.196   2.821
  128   3HD1  ILE  16          3HD1      ILE  16   2.199   1.166   2.313
  129    H    ASN  17           H        ASN  17   2.428   0.819  -2.638
  130    HA   ASN  17           HA       ASN  17   3.525   3.186  -3.555
  131   1HB   ASN  17          2HB       ASN  17   2.591   0.732  -4.600
  132   2HB   ASN  17          1HB       ASN  17   1.881   1.988  -5.613
  133   1HD2  ASN  17          1HD2      ASN  17   4.409   0.018  -5.757
  134   2HD2  ASN  17          2HD2      ASN  17   5.602   1.040  -6.399
  135    H    LYS  18           H        LYS  18   0.122   2.490  -3.072
  136    HA   LYS  18           HA       LYS  18  -1.013   4.562  -4.686
  137   1HB   LYS  18          2HB       LYS  18  -1.775   2.605  -2.706
  138   2HB   LYS  18          1HB       LYS  18  -2.594   4.132  -2.373
  139   1HG   LYS  18          2HG       LYS  18  -3.951   3.880  -4.155
  140   2HG   LYS  18          1HG       LYS  18  -2.586   3.543  -5.221
  141   1HD   LYS  18          2HD       LYS  18  -2.620   1.214  -3.918
  142   2HD   LYS  18          1HD       LYS  18  -4.317   1.643  -3.697
  143   1HE   LYS  18          2HE       LYS  18  -3.343   2.091  -6.443
  144   2HE   LYS  18          1HE       LYS  18  -3.331   0.390  -5.938
  145   1HZ   LYS  18          1HZ       LYS  18  -5.592   2.279  -6.030
  146   2HZ   LYS  18          2HZ       LYS  18  -5.616   0.987  -4.925
  147   3HZ   LYS  18          3HZ       LYS  18  -5.512   0.680  -6.592
  148    H    ILE  19           H        ILE  19  -1.133   4.649  -1.128
  149    HA   ILE  19           HA       ILE  19  -1.500   7.360  -0.755
  150    HB   ILE  19           HB       ILE  19  -1.266   5.290   0.842
  151   1HG1  ILE  19          2HG1      ILE  19  -0.600   7.018   2.724
  152   2HG1  ILE  19          1HG1      ILE  19  -0.708   8.183   1.402
  153   1HG2  ILE  19          1HG2      ILE  19   0.864   5.346   2.129
  154   2HG2  ILE  19          2HG2      ILE  19   1.509   6.509   0.969
  155   3HG2  ILE  19          3HG2      ILE  19   1.111   4.872   0.447
  156   1HD1  ILE  19          1HD1      ILE  19  -2.895   8.129   2.315
  157   2HD1  ILE  19          2HD1      ILE  19  -2.870   6.374   2.477
  158   3HD1  ILE  19          3HD1      ILE  19  -2.991   7.111   0.879
  159    H    VAL  20           H        VAL  20   1.673   5.737  -1.125
  160    HA   VAL  20           HA       VAL  20   3.321   8.029  -0.772
  161    HB   VAL  20           HB       VAL  20   3.775   5.674  -2.627
  162   1HG1  VAL  20          1HG1      VAL  20   6.085   6.047  -2.233
  163   2HG1  VAL  20          2HG1      VAL  20   5.762   7.102  -0.858
  164   3HG1  VAL  20          3HG1      VAL  20   5.416   7.658  -2.496
  165   1HG2  VAL  20          1HG2      VAL  20   3.797   4.286  -0.850
  166   2HG2  VAL  20          2HG2      VAL  20   3.079   5.589   0.095
  167   3HG2  VAL  20          3HG2      VAL  20   4.830   5.385   0.060
  168    H    GLU  21           H        GLU  21   2.034   6.610  -3.804
  169    HA   GLU  21           HA       GLU  21   3.103   8.257  -5.740
  170   1HB   GLU  21          2HB       GLU  21   1.173   6.402  -5.650
  171   2HB   GLU  21          1HB       GLU  21   0.147   7.830  -5.777
  172   1HG   GLU  21          2HG       GLU  21   0.841   8.308  -7.908
  173   2HG   GLU  21          1HG       GLU  21   2.476   7.716  -7.619
  174    H    ARG  22           H        ARG  22   0.261   9.071  -3.712
  175    HA   ARG  22           HA       ARG  22  -0.517  11.521  -4.715
  176   1HB   ARG  22          2HB       ARG  22  -0.100  10.559  -1.875
  177   2HB   ARG  22          1HB       ARG  22  -0.920  12.075  -2.243
  178   1HG   ARG  22          2HG       ARG  22  -2.098  10.201  -3.960
  179   2HG   ARG  22          1HG       ARG  22  -1.932   9.356  -2.421
  180   1HD   ARG  22          2HD       ARG  22  -3.196  11.027  -1.255
  181   2HD   ARG  22          1HD       ARG  22  -3.112  12.143  -2.632
  182    HE   ARG  22           HE       ARG  22  -4.378  10.250  -3.893
  183   1HH1  ARG  22          1HH2      ARG  22  -4.310   9.610  -0.619
  184   2HH1  ARG  22          2HH2      ARG  22  -6.028   9.526  -0.410
  185   1HH2  ARG  22          1HH1      ARG  22  -6.737  10.696  -3.596
  186   2HH2  ARG  22          2HH1      ARG  22  -7.402  10.141  -2.097
  187    H    ARG  23           H        ARG  23   2.185  11.059  -2.397
  188    HA   ARG  23           HA       ARG  23   3.053  13.690  -2.093
  189   1HB   ARG  23          2HB       ARG  23   4.013  11.046  -1.698
  190   2HB   ARG  23          1HB       ARG  23   5.302  11.934  -2.513
  191   1HG   ARG  23          2HG       ARG  23   5.399  12.116  -0.012
  192   2HG   ARG  23          1HG       ARG  23   5.245  13.675  -0.821
  193   1HD   ARG  23          2HD       ARG  23   3.176  14.058   0.066
  194   2HD   ARG  23          1HD       ARG  23   2.668  12.373  -0.164
  195    HE   ARG  23           HE       ARG  23   3.289  12.042   2.085
  196   1HH1  ARG  23          1HH2      ARG  23   4.645  14.964   0.998
  197   2HH1  ARG  23          2HH2      ARG  23   5.872  15.028   2.218
  198   1HH2  ARG  23          1HH1      ARG  23   5.136  11.893   3.502
  199   2HH2  ARG  23          2HH1      ARG  23   6.151  13.290   3.635
  200    H    ARG  24           H        ARG  24   4.340  11.438  -4.582
  201    HA   ARG  24           HA       ARG  24   5.717  13.496  -6.050
  202   1HB   ARG  24          2HB       ARG  24   5.674  10.769  -5.966
  203   2HB   ARG  24          1HB       ARG  24   4.780  11.060  -7.458
  204   1HG   ARG  24          2HG       ARG  24   6.888  11.131  -8.354
  205   2HG   ARG  24          1HG       ARG  24   6.809  12.808  -7.811
  206   1HD   ARG  24          2HD       ARG  24   8.514  12.451  -6.363
  207   2HD   ARG  24          1HD       ARG  24   7.636  11.100  -5.620
  208    HE   ARG  24           HE       ARG  24   8.980   9.656  -6.905
  209   1HH1  ARG  24          1HH2      ARG  24   9.668  12.820  -7.832
  210   2HH1  ARG  24          2HH2      ARG  24  10.280  12.409  -9.399
  211   1HH2  ARG  24          1HH1      ARG  24   9.356   9.073  -9.177
  212   2HH2  ARG  24          2HH1      ARG  24  10.104  10.286 -10.160
  213    H    ALA  25           H        ALA  25   2.618  11.797  -6.685
  214    HA   ALA  25           HA       ALA  25   1.810  12.978  -9.059
  215   1HB   ALA  25          1HB       ALA  25  -0.516  12.826  -7.988
  216   2HB   ALA  25          2HB       ALA  25   0.310  12.364  -6.500
  217   3HB   ALA  25          3HB       ALA  25   0.449  11.350  -7.938
  218    H    GLU  26           H        GLU  26   1.962  14.467  -5.860
  219    HA   GLU  26           HA       GLU  26   0.643  16.920  -6.709
  220   1HB   GLU  26          2HB       GLU  26   0.238  16.387  -4.482
  221   2HB   GLU  26          1HB       GLU  26   1.842  15.695  -4.255
  222   1HG   GLU  26          2HG       GLU  26   2.678  17.655  -3.526
  223   2HG   GLU  26          1HG       GLU  26   1.971  18.527  -4.881
  224    H    GLY  27           H        GLY  27   3.914  15.660  -6.373
  225   1HA   GLY  27          2HA       GLY  27   5.621  16.783  -7.833
  226   2HA   GLY  27          1HA       GLY  27   4.954  18.318  -7.276
  227    H    ALA  28           H        ALA  28   5.819  15.361  -5.467
  228    HA   ALA  28           HA       ALA  28   7.421  17.083  -3.624
  229   1HB   ALA  28          1HB       ALA  28   6.777  14.219  -3.074
  230   2HB   ALA  28          2HB       ALA  28   5.429  15.356  -3.111
  231   3HB   ALA  28          3HB       ALA  28   6.757  15.601  -1.978
  232    H    LYS  29           H        LYS  29   9.570  16.391  -3.033
  233    HA   LYS  29           HA       LYS  29  10.766  14.171  -4.623
  234   1HB   LYS  29          2HB       LYS  29  11.843  17.008  -4.513
  235   2HB   LYS  29          1HB       LYS  29  12.507  15.669  -5.451
  236   1HG   LYS  29          2HG       LYS  29  10.136  15.550  -6.523
  237   2HG   LYS  29          1HG       LYS  29   9.941  17.184  -5.888
  238   1HD   LYS  29          2HD       LYS  29  12.348  16.395  -7.534
  239   2HD   LYS  29          1HD       LYS  29  10.862  16.979  -8.282
  240   1HE   LYS  29          2HE       LYS  29  11.204  19.134  -7.575
  241   2HE   LYS  29          1HE       LYS  29  11.893  18.617  -6.022
  242   1HZ   LYS  29          1HZ       LYS  29  13.553  19.567  -7.596
  243   2HZ   LYS  29          2HZ       LYS  29  13.255  18.257  -8.635
  244   3HZ   LYS  29          3HZ       LYS  29  13.909  17.988  -7.089
  245    H    SER  30           H        SER  30  10.438  13.641  -2.088
  246    HA   SER  30           HA       SER  30  13.109  14.095  -0.839
  247   1HB   SER  30          2HB       SER  30  11.547  14.350   1.322
  248   2HB   SER  30          1HB       SER  30  11.953  15.735   0.314
  249    HG   SER  30           HG       SER  30   9.661  15.412   0.784
  250    H    THR  31           H        THR  31  13.723  12.371   0.572
  251    HA   THR  31           HA       THR  31  12.636   9.777  -0.007
  252    HB   THR  31           HB       THR  31  14.311  10.582   2.380
  253    HG1  THR  31           1HG      THR  31  15.703  11.300   1.009
  254   1HG2  THR  31          1HG2      THR  31  13.435   8.117   1.368
  255   2HG2  THR  31          2HG2      THR  31  14.697   8.375   2.571
  256   3HG2  THR  31          3HG2      THR  31  15.120   8.249   0.865
  257    H    ASP  32           H        ASP  32  11.472  12.229   2.024
  258    HA   ASP  32           HA       ASP  32  10.553  10.947   4.346
  259   1HB   ASP  32          2HB       ASP  32  10.012  13.307   2.765
  260   2HB   ASP  32          1HB       ASP  32   8.501  12.657   3.405
  261    H    VAL  33           H        VAL  33   9.242  10.822   1.056
  262    HA   VAL  33           HA       VAL  33   7.245   8.791   1.999
  263    HB   VAL  33           HB       VAL  33   6.308  10.949   1.215
  264   1HG1  VAL  33          1HG1      VAL  33   7.201  12.022  -0.551
  265   2HG1  VAL  33          2HG1      VAL  33   6.871  10.640  -1.596
  266   3HG1  VAL  33          3HG1      VAL  33   8.385  10.724  -0.696
  267   1HG2  VAL  33          1HG2      VAL  33   4.579   9.885   0.192
  268   2HG2  VAL  33          2HG2      VAL  33   5.516   8.418   0.479
  269   3HG2  VAL  33          3HG2      VAL  33   5.613   9.237  -1.081
  270    H    SER  34           H        SER  34   7.093   6.880   0.759
  271    HA   SER  34           HA       SER  34   8.152   6.413  -1.826
  272   1HB   SER  34          2HB       SER  34  10.352   6.767  -1.279
  273   2HB   SER  34          1HB       SER  34  10.071   6.478   0.437
  274    HG   SER  34           HG       SER  34  11.027   4.809  -1.418
  275    H    PHE  35           H        PHE  35   8.915   3.866  -1.875
  276    HA   PHE  35           HA       PHE  35   6.608   2.363  -1.026
  277   1HB   PHE  35          2HB       PHE  35   8.211   1.987  -2.990
  278   2HB   PHE  35          1HB       PHE  35   9.332   1.299  -1.814
  279    HD1  PHE  35           1HD      PHE  35   9.203  -0.985  -1.345
  280    HD2  PHE  35           2HD      PHE  35   5.736   1.048  -2.858
  281    HE1  PHE  35           1HE      PHE  35   7.979  -3.140  -1.435
  282    HE2  PHE  35           2HE      PHE  35   4.512  -1.106  -2.949
  283    HZ   PHE  35           HZ       PHE  35   5.633  -3.200  -2.236
  284    H    SER  36           H        SER  36  10.033   1.882  -0.070
  285    HA   SER  36           HA       SER  36   9.366   0.319   2.262
  286   1HB   SER  36          2HB       SER  36  11.507   0.349   0.901
  287   2HB   SER  36          1HB       SER  36  11.888   1.891   1.662
  288    HG   SER  36           HG       SER  36  12.251  -0.570   2.606
  289    H    SER  37           H        SER  37   9.349   3.710   1.665
  290    HA   SER  37           HA       SER  37   9.931   4.564   4.401
  291   1HB   SER  37          2HB       SER  37  10.424   6.092   2.657
  292   2HB   SER  37          1HB       SER  37   8.876   5.815   1.863
  293    HG   SER  37           HG       SER  37   8.731   7.742   2.955
  294    H    ILE  38           H        ILE  38   6.951   4.904   2.431
  295    HA   ILE  38           HA       ILE  38   5.217   5.421   4.633
  296    HB   ILE  38           HB       ILE  38   5.034   4.626   1.761
  297   1HG1  ILE  38          2HG1      ILE  38   3.903   6.705   1.555
  298   2HG1  ILE  38          1HG1      ILE  38   3.491   6.743   3.269
  299   1HG2  ILE  38          1HG2      ILE  38   2.604   4.612   3.577
  300   2HG2  ILE  38          2HG2      ILE  38   3.350   3.166   2.898
  301   3HG2  ILE  38          3HG2      ILE  38   2.615   4.362   1.831
  302   1HD1  ILE  38          1HD1      ILE  38   5.630   7.387   3.910
  303   2HD1  ILE  38          2HD1      ILE  38   5.491   8.204   2.351
  304   3HD1  ILE  38          3HD1      ILE  38   6.382   6.686   2.476
  305    H    SER  39           H        SER  39   6.072   2.362   2.994
  306    HA   SER  39           HA       SER  39   4.258   0.613   4.253
  307   1HB   SER  39          2HB       SER  39   6.955   0.491   3.021
  308   2HB   SER  39          1HB       SER  39   6.529  -0.875   4.047
  309    HG   SER  39           HG       SER  39   5.807  -1.266   1.959
  310    H    THR  40           H        THR  40   7.414   1.798   5.425
  311    HA   THR  40           HA       THR  40   7.763   0.287   7.742
  312    HB   THR  40           HB       THR  40   8.197   3.233   7.175
  313    HG1  THR  40           1HG      THR  40  10.408   2.312   7.040
  314   1HG2  THR  40          1HG2      THR  40   8.186   2.941   9.584
  315   2HG2  THR  40          2HG2      THR  40   9.858   3.110   9.048
  316   3HG2  THR  40          3HG2      THR  40   9.218   1.516   9.452
  317    H    MET  41           H        MET  41   6.374   3.576   7.948
  318    HA   MET  41           HA       MET  41   5.188   3.325  10.478
  319   1HB   MET  41          2HB       MET  41   3.725   5.189   9.641
  320   2HB   MET  41          1HB       MET  41   5.431   5.425   9.260
  321   1HG   MET  41          2HG       MET  41   5.129   4.829   6.992
  322   2HG   MET  41          1HG       MET  41   3.569   4.070   7.310
  323   1HE   MET  41          1HE       MET  41   2.612   6.666   4.961
  324   2HE   MET  41          2HE       MET  41   1.455   5.793   5.962
  325   3HE   MET  41          3HE       MET  41   2.911   4.977   5.396
  326    H    LEU  42           H        LEU  42   4.001   2.217   7.345
  327    HA   LEU  42           HA       LEU  42   1.284   1.678   8.136
  328   1HB   LEU  42          2HB       LEU  42   2.983   1.500   5.859
  329   2HB   LEU  42          1HB       LEU  42   2.254  -0.091   6.086
  330    HG   LEU  42           HG       LEU  42   0.406   2.192   6.431
  331   1HD1  LEU  42          1HD1      LEU  42   0.668   3.164   4.415
  332   2HD1  LEU  42          2HD1      LEU  42   0.634   1.597   3.606
  333   3HD1  LEU  42          3HD1      LEU  42   2.157   2.237   4.223
  334   1HD2  LEU  42          1HD2      LEU  42   0.310  -0.588   5.950
  335   2HD2  LEU  42          2HD2      LEU  42  -0.305   0.173   4.481
  336   3HD2  LEU  42          3HD2      LEU  42  -1.059   0.523   6.037
  337    H    LEU  43           H        LEU  43   4.041  -0.580   7.656
  338    HA   LEU  43           HA       LEU  43   2.749  -2.896   8.675
  339   1HB   LEU  43          2HB       LEU  43   4.852  -2.837   7.374
  340   2HB   LEU  43          1HB       LEU  43   5.672  -2.086   8.743
  341    HG   LEU  43           HG       LEU  43   4.507  -4.265   9.932
  342   1HD1  LEU  43          1HD1      LEU  43   3.742  -5.408   8.036
  343   2HD1  LEU  43          2HD1      LEU  43   5.332  -6.129   8.282
  344   3HD1  LEU  43          3HD1      LEU  43   5.107  -4.888   7.049
  345   1HD2  LEU  43          1HD2      LEU  43   7.190  -4.581   8.620
  346   2HD2  LEU  43          2HD2      LEU  43   6.702  -4.970  10.269
  347   3HD2  LEU  43          3HD2      LEU  43   6.964  -3.290   9.801
  348    H    GLU  44           H        GLU  44   4.830  -0.521  10.375
  349    HA   GLU  44           HA       GLU  44   4.860  -1.753  12.923
  350   1HB   GLU  44          2HB       GLU  44   5.022   1.056  11.856
  351   2HB   GLU  44          1HB       GLU  44   5.006   0.793  13.601
  352   1HG   GLU  44          2HG       GLU  44   7.235   0.455  13.423
  353   2HG   GLU  44          1HG       GLU  44   6.823  -1.097  12.692
  354    H    LEU  45           H        LEU  45   2.334  -0.088  11.225
  355    HA   LEU  45           HA       LEU  45   0.644   0.078  13.671
  356   1HB   LEU  45          2HB       LEU  45   0.253   2.067  12.645
  357   2HB   LEU  45          1HB       LEU  45   1.021   1.522  11.159
  358    HG   LEU  45           HG       LEU  45  -1.148   0.254  10.666
  359   1HD1  LEU  45          1HD1      LEU  45  -1.801   0.748  13.221
  360   2HD1  LEU  45          2HD1      LEU  45  -3.029   0.582  11.964
  361   3HD1  LEU  45          3HD1      LEU  45  -2.513   2.186  12.490
  362   1HD2  LEU  45          1HD2      LEU  45  -2.352   2.597  10.239
  363   2HD2  LEU  45          2HD2      LEU  45  -0.921   2.123   9.321
  364   3HD2  LEU  45          3HD2      LEU  45  -0.765   3.221  10.693
  365    H    GLY  46           H        GLY  46   1.357  -2.175  11.343
  366   1HA   GLY  46          2HA       GLY  46   0.215  -4.049  10.501
  367   2HA   GLY  46          1HA       GLY  46  -0.815  -3.894  11.928
  368    H    LEU  47           H        LEU  47  -0.329  -1.670   9.216
  369    HA   LEU  47           HA       LEU  47  -2.073  -0.339   8.230
  370   1HB   LEU  47          2HB       LEU  47  -3.105  -2.106   6.508
  371   2HB   LEU  47          1HB       LEU  47  -1.453  -1.533   6.383
  372    HG   LEU  47           HG       LEU  47  -1.664  -3.996   6.118
  373   1HD1  LEU  47          1HD1      LEU  47   0.408  -4.193   6.942
  374   2HD1  LEU  47          2HD1      LEU  47  -0.164  -4.008   8.600
  375   3HD1  LEU  47          3HD1      LEU  47   0.207  -2.582   7.631
  376   1HD2  LEU  47          1HD2      LEU  47  -2.949  -5.204   7.493
  377   2HD2  LEU  47          2HD2      LEU  47  -3.336  -3.749   8.404
  378   3HD2  LEU  47          3HD2      LEU  47  -1.952  -4.737   8.867
  379    H    ARG  48           H        ARG  48  -3.165  -0.958  10.731
  380    HA   ARG  48           HA       ARG  48  -5.735  -2.301  10.448
  381   1HB   ARG  48          2HB       ARG  48  -4.093  -0.982  12.489
  382   2HB   ARG  48          1HB       ARG  48  -5.818  -0.680  12.705
  383   1HG   ARG  48          2HG       ARG  48  -5.593  -3.412  12.035
  384   2HG   ARG  48          1HG       ARG  48  -4.328  -3.100  13.224
  385   1HD   ARG  48          2HD       ARG  48  -6.136  -3.531  14.639
  386   2HD   ARG  48          1HD       ARG  48  -6.306  -1.775  14.446
  387    HE   ARG  48           HE       ARG  48  -7.637  -3.219  12.310
  388   1HH1  ARG  48          1HH1      ARG  48  -8.644  -0.711  13.657
  389   2HH1  ARG  48          2HH1      ARG  48 -10.026  -1.305  14.517
  390   1HH2  ARG  48          1HH2      ARG  48  -9.088  -4.634  14.254
  391   2HH2  ARG  48          2HH2      ARG  48 -10.278  -3.527  14.854
  392    H    VAL  49           H        VAL  49  -5.543   0.940  11.804
  393    HA   VAL  49           HA       VAL  49  -7.970   1.858  10.662
  394    HB   VAL  49           HB       VAL  49  -6.611   2.772  12.609
  395   1HG1  VAL  49          1HG1      VAL  49  -5.166   4.647  10.894
  396   2HG1  VAL  49          2HG1      VAL  49  -4.634   2.982  10.662
  397   3HG1  VAL  49          3HG1      VAL  49  -4.582   3.710  12.268
  398   1HG2  VAL  49          1HG2      VAL  49  -6.977   5.270  11.438
  399   2HG2  VAL  49          2HG2      VAL  49  -8.208   4.350  12.306
  400   3HG2  VAL  49          3HG2      VAL  49  -8.092   4.231  10.549
  401    H    TYR  50           H        TYR  50  -4.832   1.500   9.256
  402    HA   TYR  50           HA       TYR  50  -5.055   3.519   7.189
  403   1HB   TYR  50          2HB       TYR  50  -2.927   2.569   7.956
  404   2HB   TYR  50          1HB       TYR  50  -3.440   0.959   7.446
  405    HD1  TYR  50           1HD      TYR  50  -2.293   4.271   6.320
  406    HD2  TYR  50           2HD      TYR  50  -3.578   0.366   5.076
  407    HE1  TYR  50           1HE      TYR  50  -1.435   4.716   4.036
  408    HE2  TYR  50           2HE      TYR  50  -2.721   0.811   2.792
  409    HH   TYR  50           HH       TYR  50  -1.755   2.280   1.447
  410    H    GLU  51           H        GLU  51  -5.436  -0.059   7.105
  411    HA   GLU  51           HA       GLU  51  -6.457  -0.097   4.421
  412   1HB   GLU  51          2HB       GLU  51  -5.417  -1.841   6.253
  413   2HB   GLU  51          1HB       GLU  51  -7.124  -2.270   6.299
  414   1HG   GLU  51          2HG       GLU  51  -6.269  -1.856   3.573
  415   2HG   GLU  51          1HG       GLU  51  -5.230  -3.039   4.365
  416    H    ALA  52           H        ALA  52  -7.840   0.983   7.287
  417    HA   ALA  52           HA       ALA  52 -10.552  -0.031   6.938
  418   1HB   ALA  52          1HB       ALA  52  -8.973   1.452   8.822
  419   2HB   ALA  52          2HB       ALA  52 -10.546   0.695   9.075
  420   3HB   ALA  52          3HB       ALA  52 -10.450   2.357   8.493
  421    H    GLN  53           H        GLN  53  -8.960   3.129   6.357
  422    HA   GLN  53           HA       GLN  53 -11.116   4.641   5.439
  423   1HB   GLN  53          2HB       GLN  53  -9.442   5.957   4.347
  424   2HB   GLN  53          1HB       GLN  53  -8.630   5.211   5.723
  425   1HG   GLN  53          2HG       GLN  53  -7.762   3.431   4.255
  426   2HG   GLN  53          1HG       GLN  53  -8.578   4.168   2.876
  427   1HE2  GLN  53          1HE2      GLN  53  -7.765   6.281   2.120
  428   2HE2  GLN  53          2HE2      GLN  53  -6.206   6.806   2.536
  429    H    MET  54           H        MET  54  -9.353   2.091   3.721
  430    HA   MET  54           HA       MET  54 -10.646   2.565   1.155
  431   1HB   MET  54          2HB       MET  54  -8.800   0.612   2.441
  432   2HB   MET  54          1HB       MET  54  -9.681   0.044   1.022
  433   1HG   MET  54          2HG       MET  54  -8.167   2.662   1.057
  434   2HG   MET  54          1HG       MET  54  -7.427   1.142   0.553
  435   1HE   MET  54          1HE       MET  54  -6.924   0.915  -1.345
  436   2HE   MET  54          2HE       MET  54  -7.147   2.374  -2.308
  437   3HE   MET  54          3HE       MET  54  -7.898   0.865  -2.822
  438    H    GLU  55           H        GLU  55 -11.512   0.904   4.075
  439    HA   GLU  55           HA       GLU  55 -13.608  -0.692   2.677
  440   1HB   GLU  55          2HB       GLU  55 -11.963  -1.644   4.376
  441   2HB   GLU  55          1HB       GLU  55 -12.797  -0.681   5.598
  442   1HG   GLU  55          2HG       GLU  55 -14.749  -1.932   5.451
  443   2HG   GLU  55          1HG       GLU  55 -14.419  -2.445   3.796
  444    H    ARG  56           H        ARG  56 -15.794  -0.710   3.820
  445    HA   ARG  56           HA       ARG  56 -17.038   1.797   3.874
  446   1HB   ARG  56          2HB       ARG  56 -17.568  -0.923   5.007
  447   2HB   ARG  56          1HB       ARG  56 -18.625   0.398   5.507
  448   1HG   ARG  56          2HG       ARG  56 -19.739   0.231   3.563
  449   2HG   ARG  56          1HG       ARG  56 -18.256   0.625   2.693
  450   1HD   ARG  56          2HD       ARG  56 -17.606  -1.743   2.662
  451   2HD   ARG  56          1HD       ARG  56 -19.054  -2.166   3.598
  452    HE   ARG  56           HE       ARG  56 -20.427  -1.452   1.693
  453   1HH1  ARG  56          1HH1      ARG  56 -18.067  -3.307   0.731
  454   2HH1  ARG  56          2HH1      ARG  56 -17.707  -2.541  -0.781
  455   1HH2  ARG  56          1HH2      ARG  56 -19.520   0.326  -0.060
  456   2HH2  ARG  56          2HH2      ARG  56 -18.529  -0.484  -1.228
  Start of MODEL   13
    1   1H    ALA   2          1H        ALA   2  -2.142 -26.806   3.870
    2   2H    ALA   2          2H        ALA   2  -3.800 -26.753   4.241
    3   3H    ALA   2          3H        ALA   2  -2.873 -25.330   4.272
    4    HA   ALA   2           HA       ALA   2  -2.421 -25.859   1.789
    5   1HB   ALA   2          1HB       ALA   2  -3.586 -27.624   0.970
    6   2HB   ALA   2          2HB       ALA   2  -5.082 -27.069   1.724
    7   3HB   ALA   2          3HB       ALA   2  -3.936 -28.042   2.647
    8    H    LYS   3           H        LYS   3  -5.203 -25.219   3.898
    9    HA   LYS   3           HA       LYS   3  -6.131 -23.076   2.040
   10   1HB   LYS   3          2HB       LYS   3  -7.285 -24.831   4.148
   11   2HB   LYS   3          1HB       LYS   3  -7.977 -23.212   4.021
   12   1HG   LYS   3          2HG       LYS   3  -9.289 -24.377   2.490
   13   2HG   LYS   3          1HG       LYS   3  -8.013 -23.757   1.440
   14   1HD   LYS   3          2HD       LYS   3  -6.809 -25.873   1.580
   15   2HD   LYS   3          1HD       LYS   3  -7.991 -26.499   2.732
   16   1HE   LYS   3          2HE       LYS   3  -9.024 -25.481   0.112
   17   2HE   LYS   3          1HE       LYS   3  -8.208 -27.058   0.132
   18   1HZ   LYS   3          1HZ       LYS   3  -9.622 -27.441   2.235
   19   2HZ   LYS   3          2HZ       LYS   3 -10.365 -27.607   0.717
   20   3HZ   LYS   3          3HZ       LYS   3 -10.598 -26.193   1.629
   21    H    VAL   4           H        VAL   4  -3.740 -22.445   3.335
   22    HA   VAL   4           HA       VAL   4  -4.617 -20.546   5.488
   23    HB   VAL   4           HB       VAL   4  -2.412 -20.902   6.454
   24   1HG1  VAL   4          1HG1      VAL   4  -2.870 -22.974   7.310
   25   2HG1  VAL   4          2HG1      VAL   4  -3.055 -23.705   5.715
   26   3HG1  VAL   4          3HG1      VAL   4  -4.375 -22.767   6.413
   27   1HG2  VAL   4          1HG2      VAL   4  -1.778 -21.654   3.765
   28   2HG2  VAL   4          2HG2      VAL   4  -1.397 -23.015   4.818
   29   3HG2  VAL   4          3HG2      VAL   4  -0.674 -21.437   5.123
   30    H    GLN   5           H        GLN   5  -4.714 -19.870   2.687
   31    HA   GLN   5           HA       GLN   5  -3.851 -18.297   1.131
   32   1HB   GLN   5          2HB       GLN   5  -3.324 -17.103   3.869
   33   2HB   GLN   5          1HB       GLN   5  -3.239 -16.179   2.368
   34   1HG   GLN   5          2HG       GLN   5  -5.627 -17.076   1.920
   35   2HG   GLN   5          1HG       GLN   5  -5.646 -17.476   3.638
   36   1HE2  GLN   5          1HE2      GLN   5  -6.220 -14.956   1.408
   37   2HE2  GLN   5          2HE2      GLN   5  -6.255 -13.667   2.512
   38    H    ALA   6           H        ALA   6  -1.685 -16.615   1.158
   39    HA   ALA   6           HA       ALA   6   0.652 -18.459   1.548
   40   1HB   ALA   6          1HB       ALA   6  -0.382 -16.892  -0.723
   41   2HB   ALA   6          2HB       ALA   6   0.661 -18.313  -0.724
   42   3HB   ALA   6          3HB       ALA   6   1.352 -16.712  -0.456
   43    H    TYR   7           H        TYR   7   0.847 -17.359   3.699
   44    HA   TYR   7           HA       TYR   7   1.626 -15.623   5.127
   45   1HB   TYR   7          2HB       TYR   7   3.457 -15.846   2.742
   46   2HB   TYR   7          1HB       TYR   7   3.831 -14.725   4.051
   47    HD1  TYR   7           1HD      TYR   7   4.584 -17.872   2.907
   48    HD2  TYR   7           2HD      TYR   7   3.255 -15.927   6.498
   49    HE1  TYR   7           1HE      TYR   7   5.487 -19.746   4.256
   50    HE2  TYR   7           2HE      TYR   7   4.159 -17.802   7.847
   51    HH   TYR   7           HH       TYR   7   6.042 -20.395   6.360
   52    H    VAL   8           H        VAL   8  -0.462 -14.377   4.429
   53    HA   VAL   8           HA       VAL   8  -1.479 -12.353   3.744
   54    HB   VAL   8           HB       VAL   8   1.396 -11.576   4.321
   55   1HG1  VAL   8          1HG1      VAL   8  -1.074  -9.860   3.932
   56   2HG1  VAL   8          2HG1      VAL   8   0.408  -9.817   2.975
   57   3HG1  VAL   8          3HG1      VAL   8   0.427  -9.277   4.655
   58   1HG2  VAL   8          1HG2      VAL   8   0.513 -12.360   6.330
   59   2HG2  VAL   8          2HG2      VAL   8  -1.129 -11.865   5.920
   60   3HG2  VAL   8          3HG2      VAL   8   0.061 -10.658   6.408
   61    H    SER   9           H        SER   9  -2.004 -12.616   1.550
   62    HA   SER   9           HA       SER   9  -0.373 -12.906  -0.675
   63   1HB   SER   9          2HB       SER   9  -2.570 -12.956  -1.294
   64   2HB   SER   9          1HB       SER   9  -3.036 -11.805  -0.047
   65    HG   SER   9           HG       SER   9  -2.830 -11.330  -2.582
   66    H    ASP  10           H        ASP  10   0.713 -11.452  -2.092
   67    HA   ASP  10           HA       ASP  10   1.907  -9.129  -0.874
   68   1HB   ASP  10          2HB       ASP  10   2.968  -8.938  -3.106
   69   2HB   ASP  10          1HB       ASP  10   3.011 -10.599  -2.515
   70    H    GLU  11           H        GLU  11  -1.144  -9.533  -2.182
   71    HA   GLU  11           HA       GLU  11  -1.720  -7.453  -3.904
   72   1HB   GLU  11          2HB       GLU  11  -3.068  -8.906  -1.724
   73   2HB   GLU  11          1HB       GLU  11  -3.789  -7.336  -2.085
   74   1HG   GLU  11          2HG       GLU  11  -3.106  -8.773  -4.523
   75   2HG   GLU  11          1HG       GLU  11  -4.200  -9.712  -3.506
   76    H    ILE  12           H        ILE  12  -0.779  -7.177  -0.524
   77    HA   ILE  12           HA       ILE  12  -1.591  -4.407  -0.188
   78    HB   ILE  12           HB       ILE  12   0.230  -6.356   1.233
   79   1HG1  ILE  12          2HG1      ILE  12  -2.326  -6.491   1.310
   80   2HG1  ILE  12          1HG1      ILE  12  -1.513  -6.401   2.872
   81   1HG2  ILE  12          1HG2      ILE  12   0.355  -4.626   3.058
   82   2HG2  ILE  12          2HG2      ILE  12  -0.329  -3.458   1.927
   83   3HG2  ILE  12          3HG2      ILE  12   1.243  -4.186   1.599
   84   1HD1  ILE  12          1HD1      ILE  12  -2.086  -3.757   1.765
   85   2HD1  ILE  12          2HD1      ILE  12  -2.463  -4.410   3.360
   86   3HD1  ILE  12          3HD1      ILE  12  -3.547  -4.716   2.003
   87    H    VAL  13           H        VAL  13   1.171  -6.000  -1.604
   88    HA   VAL  13           HA       VAL  13   3.084  -3.857  -1.341
   89    HB   VAL  13           HB       VAL  13   2.762  -6.115  -3.345
   90   1HG1  VAL  13          1HG1      VAL  13   4.814  -3.998  -2.981
   91   2HG1  VAL  13          2HG1      VAL  13   4.369  -4.897  -4.432
   92   3HG1  VAL  13          3HG1      VAL  13   5.424  -5.635  -3.227
   93   1HG2  VAL  13          1HG2      VAL  13   3.513  -6.012  -0.562
   94   2HG2  VAL  13          2HG2      VAL  13   4.898  -6.528  -1.525
   95   3HG2  VAL  13          3HG2      VAL  13   3.380  -7.421  -1.613
   96    H    TYR  14           H        TYR  14   0.563  -4.600  -3.718
   97    HA   TYR  14           HA       TYR  14   1.401  -2.648  -5.685
   98   1HB   TYR  14          2HB       TYR  14  -0.193  -4.744  -5.766
   99   2HB   TYR  14          1HB       TYR  14  -1.431  -3.580  -5.290
  100    HD1  TYR  14           1HD      TYR  14  -1.473  -1.335  -6.670
  101    HD2  TYR  14           2HD      TYR  14   0.325  -4.991  -8.034
  102    HE1  TYR  14           1HE      TYR  14  -1.622  -0.534  -9.012
  103    HE2  TYR  14           2HE      TYR  14   0.174  -4.190 -10.376
  104    HH   TYR  14           HH       TYR  14  -0.212  -1.122 -11.247
  105    H    LYS  15           H        LYS  15  -0.758  -2.567  -2.876
  106    HA   LYS  15           HA       LYS  15  -1.880   0.049  -3.456
  107   1HB   LYS  15          2HB       LYS  15  -1.652  -1.596  -0.915
  108   2HB   LYS  15          1HB       LYS  15  -2.705  -0.196  -1.119
  109   1HG   LYS  15          2HG       LYS  15  -3.334  -1.743  -3.319
  110   2HG   LYS  15          1HG       LYS  15  -3.063  -2.952  -2.065
  111   1HD   LYS  15          2HD       LYS  15  -4.822  -2.205  -0.765
  112   2HD   LYS  15          1HD       LYS  15  -4.692  -0.548  -1.357
  113   1HE   LYS  15          2HE       LYS  15  -6.252  -0.944  -2.951
  114   2HE   LYS  15          1HE       LYS  15  -5.361  -2.365  -3.530
  115   1HZ   LYS  15          1HZ       LYS  15  -7.099  -2.283  -1.120
  116   2HZ   LYS  15          2HZ       LYS  15  -6.237  -3.637  -1.676
  117   3HZ   LYS  15          3HZ       LYS  15  -7.512  -2.999  -2.601
  118    H    ILE  16           H        ILE  16   0.615  -1.092  -1.141
  119    HA   ILE  16           HA       ILE  16   1.345   1.233   0.149
  120    HB   ILE  16           HB       ILE  16   3.085  -0.906  -1.115
  121   1HG1  ILE  16          2HG1      ILE  16   1.282  -1.529   0.589
  122   2HG1  ILE  16          1HG1      ILE  16   2.928  -2.008   1.005
  123   1HG2  ILE  16          1HG2      ILE  16   4.587   0.861  -0.625
  124   2HG2  ILE  16          2HG2      ILE  16   4.666  -0.183   0.794
  125   3HG2  ILE  16          3HG2      ILE  16   3.717   1.304   0.844
  126   1HD1  ILE  16          1HD1      ILE  16   3.140  -0.351   2.637
  127   2HD1  ILE  16          2HD1      ILE  16   1.442  -0.795   2.802
  128   3HD1  ILE  16          3HD1      ILE  16   1.889   0.661   1.914
  129    H    ASN  17           H        ASN  17   2.348   0.292  -3.149
  130    HA   ASN  17           HA       ASN  17   4.060   2.489  -3.703
  131   1HB   ASN  17          2HB       ASN  17   2.241   0.755  -5.395
  132   2HB   ASN  17          1HB       ASN  17   3.382   1.904  -6.096
  133   1HD2  ASN  17          1HD2      ASN  17   5.740   1.579  -5.448
  134   2HD2  ASN  17          2HD2      ASN  17   6.274   0.000  -5.128
  135    H    LYS  18           H        LYS  18   0.536   2.221  -3.774
  136    HA   LYS  18           HA       LYS  18  -0.035   4.600  -5.259
  137   1HB   LYS  18          2HB       LYS  18  -1.550   3.171  -3.048
  138   2HB   LYS  18          1HB       LYS  18  -2.257   4.338  -4.165
  139   1HG   LYS  18          2HG       LYS  18  -1.569   2.876  -6.069
  140   2HG   LYS  18          1HG       LYS  18  -0.991   1.684  -4.906
  141   1HD   LYS  18          2HD       LYS  18  -3.205   1.001  -5.513
  142   2HD   LYS  18          1HD       LYS  18  -3.333   1.709  -3.902
  143   1HE   LYS  18          2HE       LYS  18  -4.847   3.191  -4.700
  144   2HE   LYS  18          1HE       LYS  18  -3.622   3.824  -5.817
  145   1HZ   LYS  18          1HZ       LYS  18  -4.143   1.609  -7.072
  146   2HZ   LYS  18          2HZ       LYS  18  -5.132   2.973  -7.295
  147   3HZ   LYS  18          3HZ       LYS  18  -5.627   1.722  -6.257
  148    H    ILE  19           H        ILE  19   0.256   4.061  -1.725
  149    HA   ILE  19           HA       ILE  19  -0.371   6.612  -0.766
  150    HB   ILE  19           HB       ILE  19   1.910   4.807   0.105
  151   1HG1  ILE  19          2HG1      ILE  19  -0.035   3.427  -0.004
  152   2HG1  ILE  19          1HG1      ILE  19   0.082   3.926   1.684
  153   1HG2  ILE  19          1HG2      ILE  19   0.268   6.920   1.523
  154   2HG2  ILE  19          2HG2      ILE  19   2.013   6.912   1.264
  155   3HG2  ILE  19          3HG2      ILE  19   1.280   5.752   2.372
  156   1HD1  ILE  19          1HD1      ILE  19  -2.234   4.144   0.795
  157   2HD1  ILE  19          2HD1      ILE  19  -1.643   5.292  -0.405
  158   3HD1  ILE  19          3HD1      ILE  19  -1.568   5.694   1.309
  159    H    VAL  20           H        VAL  20   2.945   5.509  -1.611
  160    HA   VAL  20           HA       VAL  20   4.363   7.881  -1.369
  161    HB   VAL  20           HB       VAL  20   4.431   5.505  -3.191
  162   1HG1  VAL  20          1HG1      VAL  20   6.694   6.545  -4.030
  163   2HG1  VAL  20          2HG1      VAL  20   5.914   8.080  -3.652
  164   3HG1  VAL  20          3HG1      VAL  20   5.189   6.991  -4.833
  165   1HG2  VAL  20          1HG2      VAL  20   5.883   6.619  -0.885
  166   2HG2  VAL  20          2HG2      VAL  20   6.911   5.865  -2.105
  167   3HG2  VAL  20          3HG2      VAL  20   5.617   4.938  -1.344
  168    H    GLU  21           H        GLU  21   3.229   6.842  -4.577
  169    HA   GLU  21           HA       GLU  21   3.415   9.143  -6.044
  170   1HB   GLU  21          2HB       GLU  21   1.684   6.787  -5.968
  171   2HB   GLU  21          1HB       GLU  21   0.897   8.171  -6.729
  172   1HG   GLU  21          2HG       GLU  21   3.636   7.999  -7.617
  173   2HG   GLU  21          1HG       GLU  21   2.823   6.457  -7.883
  174    H    ARG  22           H        ARG  22   0.809   8.454  -3.705
  175    HA   ARG  22           HA       ARG  22  -0.692  10.867  -4.221
  176   1HB   ARG  22          2HB       ARG  22  -1.015   8.520  -2.829
  177   2HB   ARG  22          1HB       ARG  22  -0.766   9.674  -1.518
  178   1HG   ARG  22          2HG       ARG  22  -2.739  10.749  -1.914
  179   2HG   ARG  22          1HG       ARG  22  -2.591  10.583  -3.664
  180   1HD   ARG  22          2HD       ARG  22  -4.055   8.858  -3.597
  181   2HD   ARG  22          1HD       ARG  22  -2.922   7.958  -2.568
  182    HE   ARG  22           HE       ARG  22  -4.241   8.566  -0.709
  183   1HH1  ARG  22          1HH2      ARG  22  -6.436   9.127  -2.806
  184   2HH1  ARG  22          2HH2      ARG  22  -6.973  10.690  -2.289
  185   1HH2  ARG  22          1HH1      ARG  22  -4.207  11.264  -0.276
  186   2HH2  ARG  22          2HH1      ARG  22  -5.710  11.901  -0.857
  187    H    ARG  23           H        ARG  23   1.917  10.031  -1.950
  188    HA   ARG  23           HA       ARG  23   1.930  12.204  -0.215
  189   1HB   ARG  23          2HB       ARG  23   3.671  10.166  -1.080
  190   2HB   ARG  23          1HB       ARG  23   4.587  11.664  -1.254
  191   1HG   ARG  23          2HG       ARG  23   3.601  12.183   1.141
  192   2HG   ARG  23          1HG       ARG  23   3.427  10.430   1.221
  193   1HD   ARG  23          2HD       ARG  23   5.974  10.651   0.232
  194   2HD   ARG  23          1HD       ARG  23   5.884  12.068   1.297
  195    HE   ARG  23           HE       ARG  23   5.792   9.283   2.165
  196   1HH1  ARG  23          1HH2      ARG  23   4.545  12.445   2.741
  197   2HH1  ARG  23          2HH2      ARG  23   4.458  12.240   4.459
  198   1HH2  ARG  23          1HH1      ARG  23   5.794   9.041   4.416
  199   2HH2  ARG  23          2HH1      ARG  23   5.166  10.314   5.406
  200    H    ARG  24           H        ARG  24   3.629  12.117  -3.381
  201    HA   ARG  24           HA       ARG  24   4.168  14.971  -3.347
  202   1HB   ARG  24          2HB       ARG  24   5.076  14.521  -5.553
  203   2HB   ARG  24          1HB       ARG  24   5.480  13.149  -4.522
  204   1HG   ARG  24          2HG       ARG  24   4.499  11.829  -6.064
  205   2HG   ARG  24          1HG       ARG  24   2.958  12.526  -5.565
  206   1HD   ARG  24          2HD       ARG  24   3.336  14.391  -7.219
  207   2HD   ARG  24          1HD       ARG  24   4.756  13.502  -7.807
  208    HE   ARG  24           HE       ARG  24   2.290  11.911  -7.642
  209   1HH1  ARG  24          1HH2      ARG  24   3.000  14.499  -9.568
  210   2HH1  ARG  24          2HH2      ARG  24   3.054  13.629 -11.065
  211   1HH2  ARG  24          1HH1      ARG  24   2.948  10.507  -9.557
  212   2HH2  ARG  24          2HH1      ARG  24   3.025  11.367 -11.059
  213    H    ALA  25           H        ALA  25   1.533  12.957  -4.461
  214    HA   ALA  25           HA       ALA  25   0.337  14.867  -6.275
  215   1HB   ALA  25          1HB       ALA  25  -0.035  12.233  -5.509
  216   2HB   ALA  25          2HB       ALA  25  -1.145  13.147  -6.531
  217   3HB   ALA  25          3HB       ALA  25  -1.433  13.033  -4.794
  218    H    GLU  26           H        GLU  26   0.459  14.484  -2.826
  219    HA   GLU  26           HA       GLU  26  -1.775  16.314  -2.333
  220   1HB   GLU  26          2HB       GLU  26  -1.758  14.524  -0.839
  221   2HB   GLU  26          1HB       GLU  26   0.002  14.440  -0.814
  222   1HG   GLU  26          2HG       GLU  26   0.127  15.823   0.957
  223   2HG   GLU  26          1HG       GLU  26  -0.965  16.980   0.205
  224    H    GLY  27           H        GLY  27   1.771  16.259  -2.316
  225   1HA   GLY  27          2HA       GLY  27   2.577  18.710  -2.744
  226   2HA   GLY  27          1HA       GLY  27   1.773  19.034  -1.209
  227    H    ALA  28           H        ALA  28   3.651  16.150  -2.060
  228    HA   ALA  28           HA       ALA  28   5.088  16.007   0.376
  229   1HB   ALA  28          1HB       ALA  28   6.250  15.111  -2.246
  230   2HB   ALA  28          2HB       ALA  28   4.750  14.384  -1.671
  231   3HB   ALA  28          3HB       ALA  28   6.215  14.263  -0.700
  232    H    LYS  29           H        LYS  29   7.794  15.806  -0.515
  233    HA   LYS  29           HA       LYS  29   8.465  18.673  -1.097
  234   1HB   LYS  29          2HB       LYS  29   8.836  17.130   1.255
  235   2HB   LYS  29          1HB       LYS  29  10.432  17.326   0.529
  236   1HG   LYS  29          2HG       LYS  29   8.654  19.723   0.652
  237   2HG   LYS  29          1HG       LYS  29   9.419  19.184   2.148
  238   1HD   LYS  29          2HD       LYS  29  11.462  19.890   1.482
  239   2HD   LYS  29          1HD       LYS  29  11.262  19.198  -0.129
  240   1HE   LYS  29          2HE       LYS  29  11.443  21.637  -0.320
  241   2HE   LYS  29          1HE       LYS  29   9.779  21.155  -0.711
  242   1HZ   LYS  29          1HZ       LYS  29   9.534  21.363   1.886
  243   2HZ   LYS  29          2HZ       LYS  29   9.351  22.716   0.874
  244   3HZ   LYS  29          3HZ       LYS  29  10.814  22.461   1.698
  245    H    SER  30           H        SER  30   9.538  15.275  -1.238
  246    HA   SER  30           HA       SER  30  10.841  15.727  -3.815
  247   1HB   SER  30          2HB       SER  30  12.476  16.706  -2.282
  248   2HB   SER  30          1HB       SER  30  12.452  15.252  -1.288
  249    HG   SER  30           HG       SER  30  14.008  14.641  -2.566
  250    H    THR  31           H        THR  31  12.519  13.548  -3.902
  251    HA   THR  31           HA       THR  31  10.613  11.311  -3.836
  252    HB   THR  31           HB       THR  31  13.037  10.316  -4.643
  253    HG1  THR  31           1HG      THR  31  13.032  12.932  -5.643
  254   1HG2  THR  31          1HG2      THR  31  10.612  10.877  -5.780
  255   2HG2  THR  31          2HG2      THR  31  11.987  10.205  -6.654
  256   3HG2  THR  31          3HG2      THR  31  11.680  11.942  -6.694
  257    H    ASP  32           H        ASP  32  12.119  12.622  -1.353
  258    HA   ASP  32           HA       ASP  32  13.840  10.697  -0.188
  259   1HB   ASP  32          2HB       ASP  32  13.146  11.809   1.928
  260   2HB   ASP  32          1HB       ASP  32  13.457  12.982   0.648
  261    H    VAL  33           H        VAL  33  10.427  10.563  -0.765
  262    HA   VAL  33           HA       VAL  33   9.956   8.461   1.266
  263    HB   VAL  33           HB       VAL  33   8.224   9.779  -0.852
  264   1HG1  VAL  33          1HG1      VAL  33   7.500   7.950   1.458
  265   2HG1  VAL  33          2HG1      VAL  33   7.367   7.561  -0.257
  266   3HG1  VAL  33          3HG1      VAL  33   6.339   8.809   0.446
  267   1HG2  VAL  33          1HG2      VAL  33   7.758  11.395   0.681
  268   2HG2  VAL  33          2HG2      VAL  33   9.254  10.873   1.455
  269   3HG2  VAL  33          3HG2      VAL  33   7.707  10.240   2.014
  270    H    SER  34           H        SER  34   8.749   6.453   0.412
  271    HA   SER  34           HA       SER  34   8.912   5.550  -2.275
  272   1HB   SER  34          2HB       SER  34  10.998   4.057  -1.871
  273   2HB   SER  34          1HB       SER  34  11.268   5.769  -2.184
  274    HG   SER  34           HG       SER  34  12.039   4.387  -0.099
  275    H    PHE  35           H        PHE  35   8.935   2.999  -2.289
  276    HA   PHE  35           HA       PHE  35   6.830   1.970  -0.783
  277   1HB   PHE  35          2HB       PHE  35   7.939   0.930  -2.751
  278   2HB   PHE  35          1HB       PHE  35   9.325   0.528  -1.737
  279    HD1  PHE  35           1HD      PHE  35   9.053  -1.055   0.185
  280    HD2  PHE  35           2HD      PHE  35   5.922  -0.360  -2.672
  281    HE1  PHE  35           1HE      PHE  35   7.909  -3.125   0.934
  282    HE2  PHE  35           2HE      PHE  35   4.778  -2.429  -1.923
  283    HZ   PHE  35           HZ       PHE  35   5.771  -3.812  -0.119
  284    H    SER  36           H        SER  36  10.239   1.108  -0.080
  285    HA   SER  36           HA       SER  36   9.988  -0.080   2.393
  286   1HB   SER  36          2HB       SER  36  12.242   1.236   2.817
  287   2HB   SER  36          1HB       SER  36  12.146   0.055   1.513
  288    HG   SER  36           HG       SER  36  12.593   2.699   1.386
  289    H    SER  37           H        SER  37  10.049   3.441   1.788
  290    HA   SER  37           HA       SER  37   9.831   4.190   4.574
  291   1HB   SER  37          2HB       SER  37   9.481   5.497   1.886
  292   2HB   SER  37          1HB       SER  37   9.043   6.375   3.348
  293    HG   SER  37           HG       SER  37  11.555   5.218   2.699
  294    H    ILE  38           H        ILE  38   7.427   4.170   1.901
  295    HA   ILE  38           HA       ILE  38   5.185   4.822   3.585
  296    HB   ILE  38           HB       ILE  38   5.572   3.586   0.850
  297   1HG1  ILE  38          2HG1      ILE  38   6.159   5.918   0.949
  298   2HG1  ILE  38          1HG1      ILE  38   4.568   5.826   0.191
  299   1HG2  ILE  38          1HG2      ILE  38   3.386   2.888   2.074
  300   2HG2  ILE  38          2HG2      ILE  38   3.253   3.567   0.455
  301   3HG2  ILE  38          3HG2      ILE  38   2.911   4.573   1.862
  302   1HD1  ILE  38          1HD1      ILE  38   3.733   6.058   2.698
  303   2HD1  ILE  38          2HD1      ILE  38   4.169   7.482   1.754
  304   3HD1  ILE  38          3HD1      ILE  38   5.314   6.809   2.915
  305    H    SER  39           H        SER  39   6.888   1.847   3.002
  306    HA   SER  39           HA       SER  39   4.690   0.055   3.664
  307   1HB   SER  39          2HB       SER  39   7.373  -0.054   2.729
  308   2HB   SER  39          1HB       SER  39   7.307  -1.026   4.195
  309    HG   SER  39           HG       SER  39   5.970  -2.386   3.245
  310    H    THR  40           H        THR  40   7.685   0.868   5.451
  311    HA   THR  40           HA       THR  40   7.089  -0.304   7.915
  312    HB   THR  40           HB       THR  40   8.455   2.360   7.434
  313    HG1  THR  40           1HG      THR  40   9.321  -0.315   7.113
  314   1HG2  THR  40          1HG2      THR  40   8.603   0.256   9.593
  315   2HG2  THR  40          2HG2      THR  40   8.298   1.984   9.769
  316   3HG2  THR  40          3HG2      THR  40   9.908   1.413   9.332
  317    H    MET  41           H        MET  41   6.408   3.128   7.047
  318    HA   MET  41           HA       MET  41   5.182   3.992   9.377
  319   1HB   MET  41          2HB       MET  41   4.218   5.670   8.016
  320   2HB   MET  41          1HB       MET  41   5.626   5.140   7.097
  321   1HG   MET  41          2HG       MET  41   4.192   3.643   5.764
  322   2HG   MET  41          1HG       MET  41   2.782   4.170   6.681
  323   1HE   MET  41          1HE       MET  41   1.666   4.706   4.327
  324   2HE   MET  41          2HE       MET  41   1.462   6.450   4.191
  325   3HE   MET  41          3HE       MET  41   1.240   5.664   5.751
  326    H    LEU  42           H        LEU  42   3.578   2.150   6.753
  327    HA   LEU  42           HA       LEU  42   0.984   2.100   8.009
  328   1HB   LEU  42          2HB       LEU  42   2.412   0.910   5.729
  329   2HB   LEU  42          1HB       LEU  42   1.154  -0.133   6.392
  330    HG   LEU  42           HG       LEU  42   0.362   2.694   6.120
  331   1HD1  LEU  42          1HD1      LEU  42  -0.021   2.392   3.632
  332   2HD1  LEU  42          2HD1      LEU  42   1.051   0.993   3.709
  333   3HD1  LEU  42          3HD1      LEU  42   1.669   2.599   4.097
  334   1HD2  LEU  42          1HD2      LEU  42  -1.267   0.798   4.708
  335   2HD2  LEU  42          2HD2      LEU  42  -1.632   1.648   6.209
  336   3HD2  LEU  42          3HD2      LEU  42  -0.799   0.095   6.255
  337    H    LEU  43           H        LEU  43   3.496  -0.450   7.743
  338    HA   LEU  43           HA       LEU  43   2.254  -2.381   9.387
  339   1HB   LEU  43          2HB       LEU  43   4.309  -2.563   7.908
  340   2HB   LEU  43          1HB       LEU  43   5.220  -1.792   9.209
  341    HG   LEU  43           HG       LEU  43   3.894  -3.733  10.593
  342   1HD1  LEU  43          1HD1      LEU  43   4.601  -5.741   8.894
  343   2HD1  LEU  43          2HD1      LEU  43   4.033  -4.532   7.743
  344   3HD1  LEU  43          3HD1      LEU  43   2.962  -5.103   9.022
  345   1HD2  LEU  43          1HD2      LEU  43   6.153  -3.651  11.041
  346   2HD2  LEU  43          2HD2      LEU  43   6.590  -3.479   9.341
  347   3HD2  LEU  43          3HD2      LEU  43   6.161  -5.063   9.986
  348    H    GLU  44           H        GLU  44   4.010   0.541  10.287
  349    HA   GLU  44           HA       GLU  44   4.545  -0.133  13.029
  350   1HB   GLU  44          2HB       GLU  44   4.683   2.121  11.221
  351   2HB   GLU  44          1HB       GLU  44   4.022   2.643  12.770
  352   1HG   GLU  44          2HG       GLU  44   6.065   1.001  13.575
  353   2HG   GLU  44          1HG       GLU  44   6.740   1.712  12.109
  354    H    LEU  45           H        LEU  45   1.706   0.834  11.291
  355    HA   LEU  45           HA       LEU  45   0.170   1.326  13.795
  356   1HB   LEU  45          2HB       LEU  45   0.013   2.006  10.900
  357   2HB   LEU  45          1HB       LEU  45  -1.525   1.799  11.739
  358    HG   LEU  45           HG       LEU  45  -0.010   3.307  13.519
  359   1HD1  LEU  45          1HD1      LEU  45   0.502   4.163  10.658
  360   2HD1  LEU  45          2HD1      LEU  45   1.703   3.779  11.890
  361   3HD1  LEU  45          3HD1      LEU  45   0.718   5.233  12.043
  362   1HD2  LEU  45          1HD2      LEU  45  -2.292   3.815  13.248
  363   2HD2  LEU  45          2HD2      LEU  45  -2.153   3.932  11.494
  364   3HD2  LEU  45          3HD2      LEU  45  -1.496   5.209  12.518
  365    H    GLY  46           H        GLY  46   0.947  -1.210  11.709
  366   1HA   GLY  46          2HA       GLY  46   0.117  -3.451  11.971
  367   2HA   GLY  46          1HA       GLY  46  -1.343  -2.796  12.717
  368    H    LEU  47           H        LEU  47  -0.893  -0.839  10.156
  369    HA   LEU  47           HA       LEU  47  -1.655  -0.794   7.911
  370   1HB   LEU  47          2HB       LEU  47  -0.832  -3.389   8.324
  371   2HB   LEU  47          1HB       LEU  47  -2.521  -3.609   7.864
  372    HG   LEU  47           HG       LEU  47  -0.741  -1.766   6.282
  373   1HD1  LEU  47          1HD1      LEU  47   0.305  -3.462   5.182
  374   2HD1  LEU  47          2HD1      LEU  47  -1.112  -4.509   5.247
  375   3HD1  LEU  47          3HD1      LEU  47  -0.041  -4.385   6.643
  376   1HD2  LEU  47          1HD2      LEU  47  -2.411  -1.914   4.676
  377   2HD2  LEU  47          2HD2      LEU  47  -3.374  -2.116   6.141
  378   3HD2  LEU  47          3HD2      LEU  47  -2.907  -3.526   5.191
  379    H    ARG  48           H        ARG  48  -3.545  -2.191  10.515
  380    HA   ARG  48           HA       ARG  48  -6.094  -2.145   9.125
  381   1HB   ARG  48          2HB       ARG  48  -6.956  -2.578  11.390
  382   2HB   ARG  48          1HB       ARG  48  -5.535  -3.575  11.078
  383   1HG   ARG  48          2HG       ARG  48  -4.850  -2.745  13.094
  384   2HG   ARG  48          1HG       ARG  48  -4.344  -1.369  12.116
  385   1HD   ARG  48          2HD       ARG  48  -5.659  -0.520  13.982
  386   2HD   ARG  48          1HD       ARG  48  -6.648  -0.364  12.516
  387    HE   ARG  48           HE       ARG  48  -7.575  -2.689  13.207
  388   1HH1  ARG  48          1HH2      ARG  48  -5.803  -2.518  15.749
  389   2HH1  ARG  48          2HH2      ARG  48  -7.001  -2.095  16.926
  390   1HH2  ARG  48          1HH1      ARG  48  -9.381  -1.193  14.572
  391   2HH2  ARG  48          2HH1      ARG  48  -9.024  -1.345  16.261
  392    H    VAL  49           H        VAL  49  -4.251   0.163  11.065
  393    HA   VAL  49           HA       VAL  49  -6.300   2.033  11.678
  394    HB   VAL  49           HB       VAL  49  -3.368   2.437  11.001
  395   1HG1  VAL  49          1HG1      VAL  49  -4.099   4.245  12.966
  396   2HG1  VAL  49          2HG1      VAL  49  -5.500   4.239  11.897
  397   3HG1  VAL  49          3HG1      VAL  49  -3.902   4.622  11.254
  398   1HG2  VAL  49          1HG2      VAL  49  -4.384   2.321  13.797
  399   2HG2  VAL  49          2HG2      VAL  49  -2.855   1.743  13.131
  400   3HG2  VAL  49          3HG2      VAL  49  -4.328   0.795  12.914
  401    H    TYR  50           H        TYR  50  -3.868   2.425   9.079
  402    HA   TYR  50           HA       TYR  50  -4.927   4.519   7.646
  403   1HB   TYR  50          2HB       TYR  50  -2.871   3.364   7.058
  404   2HB   TYR  50          1HB       TYR  50  -3.765   1.898   6.653
  405    HD1  TYR  50           1HD      TYR  50  -4.476   1.541   4.451
  406    HD2  TYR  50           2HD      TYR  50  -3.546   5.527   5.751
  407    HE1  TYR  50           1HE      TYR  50  -4.794   2.373   2.135
  408    HE2  TYR  50           2HE      TYR  50  -3.862   6.357   3.437
  409    HH   TYR  50           HH       TYR  50  -4.287   4.173   0.744
  410    H    GLU  51           H        GLU  51  -5.749   1.111   6.845
  411    HA   GLU  51           HA       GLU  51  -7.869   1.688   5.070
  412   1HB   GLU  51          2HB       GLU  51  -6.484  -0.469   5.956
  413   2HB   GLU  51          1HB       GLU  51  -8.009  -0.715   6.801
  414   1HG   GLU  51          2HG       GLU  51  -8.519   0.090   4.082
  415   2HG   GLU  51          1HG       GLU  51  -7.436  -1.301   4.099
  416    H    ALA  52           H        ALA  52  -7.852   1.276   8.604
  417    HA   ALA  52           HA       ALA  52 -10.720   1.287   8.936
  418   1HB   ALA  52          1HB       ALA  52  -8.452   2.037  10.810
  419   2HB   ALA  52          2HB       ALA  52  -9.079   0.406  10.565
  420   3HB   ALA  52          3HB       ALA  52 -10.098   1.641  11.305
  421    H    GLN  53           H        GLN  53  -8.228   3.839   9.172
  422    HA   GLN  53           HA       GLN  53  -9.852   5.983  10.027
  423   1HB   GLN  53          2HB       GLN  53  -7.321   5.574   8.524
  424   2HB   GLN  53          1HB       GLN  53  -8.049   7.175   8.389
  425   1HG   GLN  53          2HG       GLN  53  -8.119   6.216  11.133
  426   2HG   GLN  53          1HG       GLN  53  -6.471   6.241  10.506
  427   1HE2  GLN  53          1HE2      GLN  53  -8.457   8.158  12.234
  428   2HE2  GLN  53          2HE2      GLN  53  -7.985   9.689  11.674
  429    H    MET  54           H        MET  54  -9.890   4.289   7.014
  430    HA   MET  54           HA       MET  54 -11.051   6.489   5.451
  431   1HB   MET  54          2HB       MET  54 -10.672   3.514   4.989
  432   2HB   MET  54          1HB       MET  54 -11.250   4.639   3.760
  433   1HG   MET  54          2HG       MET  54  -8.843   5.640   5.042
  434   2HG   MET  54          1HG       MET  54  -8.574   4.042   4.345
  435   1HE   MET  54          1HE       MET  54  -8.855   3.341   2.106
  436   2HE   MET  54          2HE       MET  54  -9.255   4.304   0.687
  437   3HE   MET  54          3HE       MET  54 -10.518   3.883   1.841
  438    H    GLU  55           H        GLU  55 -12.206   3.919   7.505
  439    HA   GLU  55           HA       GLU  55 -15.011   4.742   6.890
  440   1HB   GLU  55          2HB       GLU  55 -15.596   2.302   6.874
  441   2HB   GLU  55          1HB       GLU  55 -14.516   2.759   5.556
  442   1HG   GLU  55          2HG       GLU  55 -12.676   1.707   6.514
  443   2HG   GLU  55          1HG       GLU  55 -13.329   1.830   8.149
  444    H    ARG  56           H        ARG  56 -16.522   3.815   8.631
  445    HA   ARG  56           HA       ARG  56 -17.071   3.849  10.939
  446   1HB   ARG  56          2HB       ARG  56 -14.586   2.103  10.863
  447   2HB   ARG  56          1HB       ARG  56 -15.809   2.085  12.135
  448   1HG   ARG  56          2HG       ARG  56 -17.488   1.270  10.641
  449   2HG   ARG  56          1HG       ARG  56 -16.480   1.583   9.228
  450   1HD   ARG  56          2HD       ARG  56 -14.842  -0.120  10.070
  451   2HD   ARG  56          1HD       ARG  56 -15.980  -0.501  11.381
  452    HE   ARG  56           HE       ARG  56 -17.527  -0.609   9.071
  453   1HH1  ARG  56          1HH2      ARG  56 -15.017  -2.313  10.656
  454   2HH1  ARG  56          2HH2      ARG  56 -15.084  -3.683   9.599
  455   1HH2  ARG  56          1HH1      ARG  56 -17.465  -2.284   7.501
  456   2HH2  ARG  56          2HH1      ARG  56 -16.471  -3.668   7.813
  Start of MODEL   14
    1   1H    ALA   2          1H        ALA   2  -0.520 -21.055 -21.221
    2   2H    ALA   2          2H        ALA   2  -0.453 -21.195 -19.530
    3   3H    ALA   2          3H        ALA   2   0.978 -21.000 -20.426
    4    HA   ALA   2           HA       ALA   2   0.275 -18.768 -21.095
    5   1HB   ALA   2          1HB       ALA   2  -1.889 -18.474 -19.252
    6   2HB   ALA   2          2HB       ALA   2  -2.188 -19.928 -20.204
    7   3HB   ALA   2          3HB       ALA   2  -1.946 -18.379 -21.011
    8    H    LYS   3           H        LYS   3  -0.906 -19.532 -17.812
    9    HA   LYS   3           HA       LYS   3   0.398 -17.548 -16.382
   10   1HB   LYS   3          2HB       LYS   3  -0.396 -20.391 -15.829
   11   2HB   LYS   3          1HB       LYS   3   0.466 -19.488 -14.581
   12   1HG   LYS   3          2HG       LYS   3  -1.708 -17.957 -15.829
   13   2HG   LYS   3          1HG       LYS   3  -2.262 -19.407 -14.990
   14   1HD   LYS   3          2HD       LYS   3  -1.927 -18.438 -12.988
   15   2HD   LYS   3          1HD       LYS   3  -0.252 -18.077 -13.406
   16   1HE   LYS   3          2HE       LYS   3  -1.741 -16.244 -14.914
   17   2HE   LYS   3          1HE       LYS   3  -2.535 -16.274 -13.328
   18   1HZ   LYS   3          1HZ       LYS   3  -0.700 -14.757 -13.221
   19   2HZ   LYS   3          2HZ       LYS   3   0.365 -15.914 -13.862
   20   3HZ   LYS   3          3HZ       LYS   3  -0.299 -16.132 -12.314
   21    H    VAL   4           H        VAL   4   2.515 -17.112 -15.850
   22    HA   VAL   4           HA       VAL   4   4.543 -19.276 -15.921
   23    HB   VAL   4           HB       VAL   4   4.349 -18.433 -18.233
   24   1HG1  VAL   4          1HG1      VAL   4   4.660 -16.126 -18.778
   25   2HG1  VAL   4          2HG1      VAL   4   5.182 -15.737 -17.139
   26   3HG1  VAL   4          3HG1      VAL   4   3.498 -16.154 -17.452
   27   1HG2  VAL   4          1HG2      VAL   4   6.811 -17.715 -16.639
   28   2HG2  VAL   4          2HG2      VAL   4   6.756 -17.469 -18.384
   29   3HG2  VAL   4          3HG2      VAL   4   6.563 -19.089 -17.717
   30    H    GLN   5           H        GLN   5   3.820 -15.822 -15.430
   31    HA   GLN   5           HA       GLN   5   6.215 -15.193 -13.959
   32   1HB   GLN   5          2HB       GLN   5   3.463 -14.024 -14.316
   33   2HB   GLN   5          1HB       GLN   5   4.583 -13.300 -13.162
   34   1HG   GLN   5          2HG       GLN   5   6.043 -13.789 -15.554
   35   2HG   GLN   5          1HG       GLN   5   4.532 -13.006 -16.016
   36   1HE2  GLN   5          1HE2      GLN   5   7.652 -12.274 -15.147
   37   2HE2  GLN   5          2HE2      GLN   5   7.404 -10.740 -14.464
   38    H    ALA   6           H        ALA   6   6.048 -14.493 -11.564
   39    HA   ALA   6           HA       ALA   6   4.465 -16.542 -10.045
   40   1HB   ALA   6          1HB       ALA   6   7.183 -16.235 -10.263
   41   2HB   ALA   6          2HB       ALA   6   6.380 -17.003  -8.893
   42   3HB   ALA   6          3HB       ALA   6   6.842 -15.303  -8.805
   43    H    TYR   7           H        TYR   7   3.258 -14.079 -10.664
   44    HA   TYR   7           HA       TYR   7   3.656 -12.140  -8.520
   45   1HB   TYR   7          2HB       TYR   7   2.083 -12.510 -10.972
   46   2HB   TYR   7          1HB       TYR   7   1.198 -11.659  -9.706
   47    HD1  TYR   7           1HD      TYR   7   4.699 -11.732 -11.075
   48    HD2  TYR   7           2HD      TYR   7   1.399  -9.343  -9.710
   49    HE1  TYR   7           1HE      TYR   7   5.992  -9.671 -11.555
   50    HE2  TYR   7           2HE      TYR   7   2.693  -7.283 -10.191
   51    HH   TYR   7           HH       TYR   7   5.467  -6.849 -10.336
   52    H    VAL   8           H        VAL   8   3.325 -14.386  -7.095
   53    HA   VAL   8           HA       VAL   8   0.474 -14.288  -6.160
   54    HB   VAL   8           HB       VAL   8   0.611 -16.663  -5.807
   55   1HG1  VAL   8          1HG1      VAL   8   0.253 -15.986  -8.149
   56   2HG1  VAL   8          2HG1      VAL   8   1.176 -17.487  -8.068
   57   3HG1  VAL   8          3HG1      VAL   8   1.996 -15.964  -8.414
   58   1HG2  VAL   8          1HG2      VAL   8   3.539 -16.473  -6.580
   59   2HG2  VAL   8          2HG2      VAL   8   2.679 -17.921  -6.054
   60   3HG2  VAL   8          3HG2      VAL   8   2.960 -16.601  -4.919
   61    H    SER   9           H        SER   9   3.058 -12.880  -5.272
   62    HA   SER   9           HA       SER   9   3.300 -13.998  -2.509
   63   1HB   SER   9          2HB       SER   9   5.326 -12.436  -2.532
   64   2HB   SER   9          1HB       SER   9   5.385 -13.778  -3.671
   65    HG   SER   9           HG       SER   9   4.232 -11.347  -4.462
   66    H    ASP  10           H        ASP  10   4.181 -11.652  -1.248
   67    HA   ASP  10           HA       ASP  10   1.776 -10.384  -0.455
   68   1HB   ASP  10          2HB       ASP  10   3.313  -8.836   0.681
   69   2HB   ASP  10          1HB       ASP  10   3.926 -10.487   0.800
   70    H    GLU  11           H        GLU  11   0.824  -9.875  -2.622
   71    HA   GLU  11           HA       GLU  11   1.967  -8.042  -4.484
   72   1HB   GLU  11          2HB       GLU  11  -0.265  -9.599  -4.285
   73   2HB   GLU  11          1HB       GLU  11  -0.965  -7.997  -4.048
   74   1HG   GLU  11          2HG       GLU  11   0.605  -7.411  -6.128
   75   2HG   GLU  11          1HG       GLU  11   0.394  -9.133  -6.452
   76    H    ILE  12           H        ILE  12   0.860  -7.495  -1.293
   77    HA   ILE  12           HA       ILE  12  -0.355  -4.969  -1.339
   78    HB   ILE  12           HB       ILE  12   1.598  -6.334   0.520
   79   1HG1  ILE  12          2HG1      ILE  12  -0.806  -7.127   0.166
   80   2HG1  ILE  12          1HG1      ILE  12  -0.354  -6.772   1.833
   81   1HG2  ILE  12          1HG2      ILE  12   2.038  -4.260   1.358
   82   2HG2  ILE  12          2HG2      ILE  12   0.432  -4.410   2.071
   83   3HG2  ILE  12          3HG2      ILE  12   0.645  -3.535   0.555
   84   1HD1  ILE  12          1HD1      ILE  12  -1.676  -4.731   0.033
   85   2HD1  ILE  12          2HD1      ILE  12  -1.469  -4.654   1.783
   86   3HD1  ILE  12          3HD1      ILE  12  -2.593  -5.815   1.078
   87    H    VAL  13           H        VAL  13   3.119  -5.755  -1.554
   88    HA   VAL  13           HA       VAL  13   4.308  -3.250  -1.320
   89    HB   VAL  13           HB       VAL  13   5.994  -4.185  -2.901
   90   1HG1  VAL  13          1HG1      VAL  13   6.677  -5.826  -1.427
   91   2HG1  VAL  13          2HG1      VAL  13   5.071  -6.542  -1.315
   92   3HG1  VAL  13          3HG1      VAL  13   5.437  -5.057  -0.437
   93   1HG2  VAL  13          1HG2      VAL  13   3.728  -6.114  -3.432
   94   2HG2  VAL  13          2HG2      VAL  13   5.405  -6.552  -3.755
   95   3HG2  VAL  13          3HG2      VAL  13   4.671  -5.189  -4.600
   96    H    TYR  14           H        TYR  14   2.625  -4.578  -4.171
   97    HA   TYR  14           HA       TYR  14   3.174  -2.305  -5.884
   98   1HB   TYR  14          2HB       TYR  14   2.397  -4.817  -6.295
   99   2HB   TYR  14          1HB       TYR  14   0.790  -4.095  -6.206
  100    HD1  TYR  14           1HD      TYR  14   4.013  -2.740  -7.549
  101    HD2  TYR  14           2HD      TYR  14  -0.022  -3.942  -8.402
  102    HE1  TYR  14           1HE      TYR  14   4.254  -1.905  -9.873
  103    HE2  TYR  14           2HE      TYR  14   0.220  -3.107 -10.724
  104    HH   TYR  14           HH       TYR  14   1.740  -2.440 -12.287
  105    H    LYS  15           H        LYS  15   0.665  -3.098  -3.543
  106    HA   LYS  15           HA       LYS  15  -1.222  -1.059  -4.383
  107   1HB   LYS  15          2HB       LYS  15  -0.923  -3.155  -2.406
  108   2HB   LYS  15          1HB       LYS  15  -1.557  -1.694  -1.649
  109   1HG   LYS  15          2HG       LYS  15  -3.560  -1.927  -2.665
  110   2HG   LYS  15          1HG       LYS  15  -2.807  -2.213  -4.234
  111   1HD   LYS  15          2HD       LYS  15  -2.560  -4.417  -2.262
  112   2HD   LYS  15          1HD       LYS  15  -4.184  -4.120  -2.887
  113   1HE   LYS  15          2HE       LYS  15  -2.190  -4.030  -5.018
  114   2HE   LYS  15          1HE       LYS  15  -2.199  -5.595  -4.181
  115   1HZ   LYS  15          1HZ       LYS  15  -4.566  -4.162  -5.266
  116   2HZ   LYS  15          2HZ       LYS  15  -4.635  -5.594  -4.353
  117   3HZ   LYS  15          3HZ       LYS  15  -3.892  -5.593  -5.880
  118    H    ILE  16           H        ILE  16   1.497  -1.177  -2.120
  119    HA   ILE  16           HA       ILE  16   0.938   1.327  -0.789
  120    HB   ILE  16           HB       ILE  16   3.546  -0.162  -1.234
  121   1HG1  ILE  16          2HG1      ILE  16   1.325  -0.494   0.800
  122   2HG1  ILE  16          1HG1      ILE  16   1.965  -1.712  -0.305
  123   1HG2  ILE  16          1HG2      ILE  16   4.327   0.969   0.729
  124   2HG2  ILE  16          2HG2      ILE  16   2.719   1.601   1.084
  125   3HG2  ILE  16          3HG2      ILE  16   3.620   2.210  -0.305
  126   1HD1  ILE  16          1HD1      ILE  16   4.231  -1.295   0.894
  127   2HD1  ILE  16          2HD1      ILE  16   3.006  -2.240   1.740
  128   3HD1  ILE  16          3HD1      ILE  16   3.253  -0.544   2.155
  129    H    ASN  17           H        ASN  17   2.271   0.514  -3.884
  130    HA   ASN  17           HA       ASN  17   3.988   2.731  -4.375
  131   1HB   ASN  17          2HB       ASN  17   2.866   0.522  -5.733
  132   2HB   ASN  17          1HB       ASN  17   2.433   1.940  -6.688
  133   1HD2  ASN  17          1HD2      ASN  17   4.804  -0.344  -6.479
  134   2HD2  ASN  17          2HD2      ASN  17   6.133   0.558  -7.028
  135    H    LYS  18           H        LYS  18   0.478   2.359  -4.982
  136    HA   LYS  18           HA       LYS  18   0.122   5.038  -6.016
  137   1HB   LYS  18          2HB       LYS  18  -2.259   4.436  -5.795
  138   2HB   LYS  18          1HB       LYS  18  -1.345   3.083  -6.461
  139   1HG   LYS  18          2HG       LYS  18  -1.202   2.804  -3.656
  140   2HG   LYS  18          1HG       LYS  18  -2.884   3.194  -4.020
  141   1HD   LYS  18          2HD       LYS  18  -1.302   1.042  -5.453
  142   2HD   LYS  18          1HD       LYS  18  -2.380   0.730  -4.091
  143   1HE   LYS  18          2HE       LYS  18  -4.075   0.579  -5.591
  144   2HE   LYS  18          1HE       LYS  18  -3.877   2.318  -5.888
  145   1HZ   LYS  18          1HZ       LYS  18  -3.516   0.591  -7.809
  146   2HZ   LYS  18          2HZ       LYS  18  -1.970   0.458  -7.116
  147   3HZ   LYS  18          3HZ       LYS  18  -2.526   1.962  -7.678
  148    H    ILE  19           H        ILE  19   0.226   3.658  -2.806
  149    HA   ILE  19           HA       ILE  19  -1.212   5.742  -1.417
  150    HB   ILE  19           HB       ILE  19   0.906   3.731  -0.595
  151   1HG1  ILE  19          2HG1      ILE  19  -1.333   2.925  -1.508
  152   2HG1  ILE  19          1HG1      ILE  19  -0.948   2.383   0.126
  153   1HG2  ILE  19          1HG2      ILE  19  -0.946   5.402   1.134
  154   2HG2  ILE  19          2HG2      ILE  19   0.797   5.632   0.989
  155   3HG2  ILE  19          3HG2      ILE  19   0.159   4.155   1.712
  156   1HD1  ILE  19          1HD1      ILE  19  -3.296   3.228  -0.105
  157   2HD1  ILE  19          2HD1      ILE  19  -2.642   4.817  -0.504
  158   3HD1  ILE  19          3HD1      ILE  19  -2.351   4.117   1.089
  159    H    VAL  20           H        VAL  20   2.295   5.132  -1.860
  160    HA   VAL  20           HA       VAL  20   3.125   7.576  -0.562
  161    HB   VAL  20           HB       VAL  20   4.613   5.964  -2.649
  162   1HG1  VAL  20          1HG1      VAL  20   5.324   8.180  -1.131
  163   2HG1  VAL  20          2HG1      VAL  20   6.447   7.059  -1.903
  164   3HG1  VAL  20          3HG1      VAL  20   5.990   6.827  -0.215
  165   1HG2  VAL  20          1HG2      VAL  20   4.219   4.164  -1.325
  166   2HG2  VAL  20          2HG2      VAL  20   3.570   5.160  -0.025
  167   3HG2  VAL  20          3HG2      VAL  20   5.312   4.934  -0.176
  168    H    GLU  21           H        GLU  21   3.123   6.649  -4.032
  169    HA   GLU  21           HA       GLU  21   3.897   9.030  -5.219
  170   1HB   GLU  21          2HB       GLU  21   3.278   6.859  -6.313
  171   2HB   GLU  21          1HB       GLU  21   1.579   7.267  -6.073
  172   1HG   GLU  21          2HG       GLU  21   1.693   9.115  -7.549
  173   2HG   GLU  21          1HG       GLU  21   3.457   9.143  -7.507
  174    H    ARG  22           H        ARG  22   0.808   8.328  -3.662
  175    HA   ARG  22           HA       ARG  22  -0.848  10.371  -4.610
  176   1HB   ARG  22          2HB       ARG  22  -0.855   8.492  -2.602
  177   2HB   ARG  22          1HB       ARG  22  -0.837   9.996  -1.682
  178   1HG   ARG  22          2HG       ARG  22  -2.734  10.772  -3.241
  179   2HG   ARG  22          1HG       ARG  22  -2.867   9.081  -3.723
  180   1HD   ARG  22          2HD       ARG  22  -2.964   8.607  -1.147
  181   2HD   ARG  22          1HD       ARG  22  -3.412  10.321  -1.032
  182    HE   ARG  22           HE       ARG  22  -5.102   8.227  -2.085
  183   1HH1  ARG  22          1HH1      ARG  22  -5.094  11.422  -1.293
  184   2HH1  ARG  22          2HH1      ARG  22  -6.131  11.956  -2.573
  185   1HH2  ARG  22          1HH2      ARG  22  -6.027   8.937  -4.276
  186   2HH2  ARG  22          2HH2      ARG  22  -6.660  10.550  -4.262
  187    H    ARG  23           H        ARG  23   1.593  10.611  -1.998
  188    HA   ARG  23           HA       ARG  23   1.231  13.234  -1.146
  189   1HB   ARG  23          2HB       ARG  23   3.779  11.702  -1.761
  190   2HB   ARG  23          1HB       ARG  23   3.726  13.172  -0.787
  191   1HG   ARG  23          2HG       ARG  23   1.727  11.297   0.133
  192   2HG   ARG  23          1HG       ARG  23   3.314  10.529   0.105
  193   1HD   ARG  23          2HD       ARG  23   4.185  11.958   1.709
  194   2HD   ARG  23          1HD       ARG  23   3.124  13.300   1.235
  195    HE   ARG  23           HE       ARG  23   1.732  10.955   2.338
  196   1HH1  ARG  23          1HH1      ARG  23   3.746  13.417   3.484
  197   2HH1  ARG  23          2HH1      ARG  23   2.629  14.005   4.669
  198   1HH2  ARG  23          1HH2      ARG  23   0.026  11.976   3.607
  199   2HH2  ARG  23          2HH2      ARG  23   0.522  13.190   4.738
  200    H    ARG  24           H        ARG  24   3.839  12.585  -3.491
  201    HA   ARG  24           HA       ARG  24   3.905  15.229  -4.536
  202   1HB   ARG  24          2HB       ARG  24   5.601  13.326  -4.700
  203   2HB   ARG  24          1HB       ARG  24   4.601  12.666  -5.996
  204   1HG   ARG  24          2HG       ARG  24   4.829  14.811  -7.233
  205   2HG   ARG  24          1HG       ARG  24   5.893  15.410  -5.960
  206   1HD   ARG  24          2HD       ARG  24   6.396  13.088  -7.846
  207   2HD   ARG  24          1HD       ARG  24   7.369  14.559  -7.641
  208    HE   ARG  24           HE       ARG  24   7.112  12.409  -5.574
  209   1HH1  ARG  24          1HH2      ARG  24   8.248  15.533  -6.304
  210   2HH1  ARG  24          2HH2      ARG  24   9.793  15.313  -5.552
  211   1HH2  ARG  24          1HH1      ARG  24   9.285  11.950  -4.881
  212   2HH2  ARG  24          2HH1      ARG  24  10.381  13.284  -4.748
  213    H    ALA  25           H        ALA  25   2.079  12.356  -5.562
  214    HA   ALA  25           HA       ALA  25   1.065  13.102  -8.032
  215   1HB   ALA  25          1HB       ALA  25  -1.005  11.866  -7.244
  216   2HB   ALA  25          2HB       ALA  25  -0.301  11.857  -5.627
  217   3HB   ALA  25          3HB       ALA  25   0.509  11.011  -6.946
  218    H    GLU  26           H        GLU  26   0.011  14.282  -4.837
  219    HA   GLU  26           HA       GLU  26  -2.043  16.004  -5.999
  220   1HB   GLU  26          2HB       GLU  26  -2.584  16.440  -3.733
  221   2HB   GLU  26          1HB       GLU  26  -1.999  14.778  -3.724
  222   1HG   GLU  26          2HG       GLU  26   0.315  16.302  -3.411
  223   2HG   GLU  26          1HG       GLU  26  -0.882  17.137  -2.421
  224    H    GLY  27           H        GLY  27   1.332  16.258  -5.183
  225   1HA   GLY  27          2HA       GLY  27   2.427  18.238  -6.351
  226   2HA   GLY  27          1HA       GLY  27   1.179  19.221  -5.586
  227    H    ALA  28           H        ALA  28   2.699  16.526  -3.927
  228    HA   ALA  28           HA       ALA  28   3.509  18.266  -1.728
  229   1HB   ALA  28          1HB       ALA  28   4.015  15.337  -2.349
  230   2HB   ALA  28          2HB       ALA  28   2.642  15.971  -1.444
  231   3HB   ALA  28          3HB       ALA  28   4.271  16.102  -0.781
  232    H    LYS  29           H        LYS  29   5.952  17.220  -0.943
  233    HA   LYS  29           HA       LYS  29   7.896  17.308  -3.136
  234   1HB   LYS  29          2HB       LYS  29   8.926  19.438  -2.138
  235   2HB   LYS  29          1HB       LYS  29   7.417  19.649  -3.026
  236   1HG   LYS  29          2HG       LYS  29   6.880  19.012  -0.251
  237   2HG   LYS  29          1HG       LYS  29   7.933  20.422  -0.370
  238   1HD   LYS  29          2HD       LYS  29   5.544  20.238  -2.174
  239   2HD   LYS  29          1HD       LYS  29   5.312  20.718  -0.492
  240   1HE   LYS  29          2HE       LYS  29   6.839  22.589  -0.744
  241   2HE   LYS  29          1HE       LYS  29   7.287  22.053  -2.376
  242   1HZ   LYS  29          1HZ       LYS  29   4.674  22.074  -2.640
  243   2HZ   LYS  29          2HZ       LYS  29   5.608  23.467  -2.919
  244   3HZ   LYS  29          3HZ       LYS  29   4.796  23.267  -1.440
  245    H    SER  30           H        SER  30  10.182  17.918  -1.772
  246    HA   SER  30           HA       SER  30  11.722  17.054  -0.199
  247   1HB   SER  30          2HB       SER  30   9.144  17.480   1.136
  248   2HB   SER  30          1HB       SER  30  10.133  16.262   1.933
  249    HG   SER  30           HG       SER  30  10.381  18.859   2.087
  250    H    THR  31           H        THR  31  12.660  15.028  -0.019
  251    HA   THR  31           HA       THR  31  11.145  12.708  -1.010
  252    HB   THR  31           HB       THR  31  13.492  13.282  -1.665
  253    HG1  THR  31           1HG      THR  31  14.194  11.184  -1.536
  254   1HG2  THR  31          1HG2      THR  31  15.249  12.656   0.092
  255   2HG2  THR  31          2HG2      THR  31  13.945  12.760   1.274
  256   3HG2  THR  31          3HG2      THR  31  14.402  14.182   0.337
  257    H    ASP  32           H        ASP  32  10.876  14.064   1.840
  258    HA   ASP  32           HA       ASP  32  11.725  12.297   3.865
  259   1HB   ASP  32          2HB       ASP  32   9.753  14.402   3.434
  260   2HB   ASP  32          1HB       ASP  32   9.169  13.194   4.579
  261    H    VAL  33           H        VAL  33   9.054  11.989   1.580
  262    HA   VAL  33           HA       VAL  33   8.063   9.540   2.944
  263    HB   VAL  33           HB       VAL  33   6.506  11.306   2.172
  264   1HG1  VAL  33          1HG1      VAL  33   8.234  11.436  -0.009
  265   2HG1  VAL  33          2HG1      VAL  33   6.686  12.270   0.136
  266   3HG1  VAL  33          3HG1      VAL  33   6.773  10.707  -0.675
  267   1HG2  VAL  33          1HG2      VAL  33   5.811   8.902   2.175
  268   2HG2  VAL  33          2HG2      VAL  33   6.303   8.790   0.486
  269   3HG2  VAL  33          3HG2      VAL  33   4.972   9.851   0.949
  270    H    SER  34           H        SER  34   7.940   7.517   1.778
  271    HA   SER  34           HA       SER  34   9.087   7.221  -0.887
  272   1HB   SER  34          2HB       SER  34  10.749   7.158   1.507
  273   2HB   SER  34          1HB       SER  34  10.854   5.645   0.611
  274    HG   SER  34           HG       SER  34  11.401   8.283  -0.249
  275    H    PHE  35           H        PHE  35   8.912   4.992  -1.623
  276    HA   PHE  35           HA       PHE  35   6.680   3.525  -0.829
  277   1HB   PHE  35          2HB       PHE  35   8.054   3.223  -2.883
  278   2HB   PHE  35          1HB       PHE  35   9.317   2.476  -1.906
  279    HD1  PHE  35           1HD      PHE  35   8.489   0.492  -0.343
  280    HD2  PHE  35           2HD      PHE  35   6.457   1.845  -3.878
  281    HE1  PHE  35           1HE      PHE  35   7.328  -1.693  -0.513
  282    HE2  PHE  35           2HE      PHE  35   5.296  -0.340  -4.048
  283    HZ   PHE  35           HZ       PHE  35   5.733  -2.109  -2.365
  284    H    SER  36           H        SER  36  10.057   2.971   0.234
  285    HA   SER  36           HA       SER  36   9.460   0.821   2.036
  286   1HB   SER  36          2HB       SER  36  11.686   1.413   1.094
  287   2HB   SER  36          1HB       SER  36  11.688   2.882   2.065
  288    HG   SER  36           HG       SER  36  12.804   1.059   3.017
  289    H    SER  37           H        SER  37   9.624   4.348   2.488
  290    HA   SER  37           HA       SER  37   9.355   4.331   5.351
  291   1HB   SER  37          2HB       SER  37  10.091   6.172   3.686
  292   2HB   SER  37          1HB       SER  37   8.369   6.475   3.465
  293    HG   SER  37           HG       SER  37   8.266   7.299   5.413
  294    H    ILE  38           H        ILE  38   6.951   4.723   2.727
  295    HA   ILE  38           HA       ILE  38   4.675   4.977   4.482
  296    HB   ILE  38           HB       ILE  38   5.027   4.158   1.582
  297   1HG1  ILE  38          2HG1      ILE  38   5.784   6.443   2.183
  298   2HG1  ILE  38          1HG1      ILE  38   4.355   6.487   1.150
  299   1HG2  ILE  38          1HG2      ILE  38   2.490   5.236   1.869
  300   2HG2  ILE  38          2HG2      ILE  38   2.657   4.231   3.309
  301   3HG2  ILE  38          3HG2      ILE  38   2.856   3.519   1.708
  302   1HD1  ILE  38          1HD1      ILE  38   3.439   7.821   2.731
  303   2HD1  ILE  38          2HD1      ILE  38   4.679   7.403   3.912
  304   3HD1  ILE  38          3HD1      ILE  38   3.276   6.356   3.699
  305    H    SER  39           H        SER  39   6.409   2.227   3.138
  306    HA   SER  39           HA       SER  39   4.331   0.261   3.649
  307   1HB   SER  39          2HB       SER  39   7.298   0.208   3.080
  308   2HB   SER  39          1HB       SER  39   6.378  -1.272   3.333
  309    HG   SER  39           HG       SER  39   6.515  -0.627   1.114
  310    H    THR  40           H        THR  40   7.527   0.715   5.213
  311    HA   THR  40           HA       THR  40   7.184  -0.973   7.410
  312    HB   THR  40           HB       THR  40   9.201   0.388   6.614
  313    HG1  THR  40           1HG      THR  40   9.787   0.764   8.966
  314   1HG2  THR  40          1HG2      THR  40   8.016   2.581   6.658
  315   2HG2  THR  40          2HG2      THR  40   9.500   2.595   7.608
  316   3HG2  THR  40          3HG2      THR  40   7.939   2.473   8.416
  317    H    MET  41           H        MET  41   6.217   2.475   7.187
  318    HA   MET  41           HA       MET  41   5.254   2.721   9.865
  319   1HB   MET  41          2HB       MET  41   4.259   4.748   9.032
  320   2HB   MET  41          1HB       MET  41   5.751   4.510   8.121
  321   1HG   MET  41          2HG       MET  41   4.569   3.689   6.216
  322   2HG   MET  41          1HG       MET  41   3.069   3.524   7.126
  323   1HE   MET  41          1HE       MET  41   1.599   5.641   5.124
  324   2HE   MET  41          2HE       MET  41   1.146   6.156   6.747
  325   3HE   MET  41          3HE       MET  41   1.530   4.464   6.444
  326    H    LEU  42           H        LEU  42   3.748   1.433   6.937
  327    HA   LEU  42           HA       LEU  42   1.035   1.388   7.912
  328   1HB   LEU  42          2HB       LEU  42   2.386   0.891   5.562
  329   2HB   LEU  42          1HB       LEU  42   1.885  -0.729   6.047
  330    HG   LEU  42           HG       LEU  42   0.029   1.663   5.875
  331   1HD1  LEU  42          1HD1      LEU  42  -0.801   0.714   3.824
  332   2HD1  LEU  42          2HD1      LEU  42   0.192  -0.730   4.024
  333   3HD1  LEU  42          3HD1      LEU  42   0.952   0.819   3.666
  334   1HD2  LEU  42          1HD2      LEU  42  -1.694  -0.217   5.985
  335   2HD2  LEU  42          2HD2      LEU  42  -0.799   0.080   7.475
  336   3HD2  LEU  42          3HD2      LEU  42  -0.368  -1.285   6.445
  337    H    LEU  43           H        LEU  43   3.285  -1.376   7.469
  338    HA   LEU  43           HA       LEU  43   1.753  -3.200   9.053
  339   1HB   LEU  43          2HB       LEU  43   3.456  -3.822   7.380
  340   2HB   LEU  43          1HB       LEU  43   4.715  -3.109   8.393
  341    HG   LEU  43           HG       LEU  43   3.195  -4.883  10.028
  342   1HD1  LEU  43          1HD1      LEU  43   2.480  -5.970   7.930
  343   2HD1  LEU  43          2HD1      LEU  43   3.579  -7.013   8.834
  344   3HD1  LEU  43          3HD1      LEU  43   4.164  -6.120   7.430
  345   1HD2  LEU  43          1HD2      LEU  43   5.367  -5.974  10.295
  346   2HD2  LEU  43          2HD2      LEU  43   5.594  -4.225  10.258
  347   3HD2  LEU  43          3HD2      LEU  43   5.968  -5.194   8.833
  348    H    GLU  44           H        GLU  44   4.456  -1.029   9.889
  349    HA   GLU  44           HA       GLU  44   4.976  -1.948  12.521
  350   1HB   GLU  44          2HB       GLU  44   5.110   0.710  11.092
  351   2HB   GLU  44          1HB       GLU  44   5.566   0.585  12.792
  352   1HG   GLU  44          2HG       GLU  44   6.748  -1.552  11.203
  353   2HG   GLU  44          1HG       GLU  44   7.213   0.040  10.604
  354    H    LEU  45           H        LEU  45   2.353  -0.076  11.188
  355    HA   LEU  45           HA       LEU  45   1.247   0.493  13.894
  356   1HB   LEU  45          2HB       LEU  45   0.958   2.451  12.762
  357   2HB   LEU  45          1HB       LEU  45   1.232   1.676  11.205
  358    HG   LEU  45           HG       LEU  45  -1.121   0.784  11.316
  359   1HD1  LEU  45          1HD1      LEU  45  -2.534   1.274  13.058
  360   2HD1  LEU  45          2HD1      LEU  45  -1.790   2.845  13.358
  361   3HD1  LEU  45          3HD1      LEU  45  -1.017   1.375  13.951
  362   1HD2  LEU  45          1HD2      LEU  45  -1.907   2.672  10.271
  363   2HD2  LEU  45          2HD2      LEU  45  -0.219   3.165  10.401
  364   3HD2  LEU  45          3HD2      LEU  45  -1.398   3.736  11.582
  365    H    GLY  46           H        GLY  46   1.013  -1.764  11.344
  366   1HA   GLY  46          2HA       GLY  46  -0.385  -3.666  11.204
  367   2HA   GLY  46          1HA       GLY  46  -1.266  -3.081  12.616
  368    H    LEU  47           H        LEU  47  -0.711  -1.081   9.786
  369    HA   LEU  47           HA       LEU  47  -2.337   0.122   8.535
  370   1HB   LEU  47          2HB       LEU  47  -3.338  -1.406   6.968
  371   2HB   LEU  47          1HB       LEU  47  -1.789  -2.099   7.438
  372    HG   LEU  47           HG       LEU  47  -4.153  -2.880   9.077
  373   1HD1  LEU  47          1HD1      LEU  47  -3.871  -3.397   6.164
  374   2HD1  LEU  47          2HD1      LEU  47  -5.323  -3.346   7.163
  375   3HD1  LEU  47          3HD1      LEU  47  -4.298  -4.781   7.170
  376   1HD2  LEU  47          1HD2      LEU  47  -2.384  -4.935   7.984
  377   2HD2  LEU  47          2HD2      LEU  47  -2.746  -4.553   9.669
  378   3HD2  LEU  47          3HD2      LEU  47  -1.489  -3.660   8.813
  379    H    ARG  48           H        ARG  48  -3.146  -0.378  11.402
  380    HA   ARG  48           HA       ARG  48  -5.980  -1.030  11.395
  381   1HB   ARG  48          2HB       ARG  48  -4.548  -1.376  13.340
  382   2HB   ARG  48          1HB       ARG  48  -4.138   0.340  13.381
  383   1HG   ARG  48          2HG       ARG  48  -6.834   0.521  13.454
  384   2HG   ARG  48          1HG       ARG  48  -6.622  -1.033  14.259
  385   1HD   ARG  48          2HD       ARG  48  -4.642   0.693  15.338
  386   2HD   ARG  48          1HD       ARG  48  -6.168   1.601  15.336
  387    HE   ARG  48           HE       ARG  48  -7.193  -0.220  16.616
  388   1HH1  ARG  48          1HH1      ARG  48  -4.553  -1.765  15.435
  389   2HH1  ARG  48          2HH1      ARG  48  -3.951  -2.348  16.950
  390   1HH2  ARG  48          1HH2      ARG  48  -6.102  -0.407  18.855
  391   2HH2  ARG  48          2HH2      ARG  48  -4.828  -1.580  18.887
  392    H    VAL  49           H        VAL  49  -5.013   1.940  12.958
  393    HA   VAL  49           HA       VAL  49  -7.184   3.508  12.246
  394    HB   VAL  49           HB       VAL  49  -5.575   5.420  12.603
  395   1HG1  VAL  49          1HG1      VAL  49  -4.773   3.480  14.680
  396   2HG1  VAL  49          2HG1      VAL  49  -6.510   3.563  14.386
  397   3HG1  VAL  49          3HG1      VAL  49  -5.622   5.016  14.844
  398   1HG2  VAL  49          1HG2      VAL  49  -3.293   3.972  13.424
  399   2HG2  VAL  49          2HG2      VAL  49  -3.419   5.061  12.042
  400   3HG2  VAL  49          3HG2      VAL  49  -3.717   3.336  11.835
  401    H    TYR  50           H        TYR  50  -4.450   2.620  10.238
  402    HA   TYR  50           HA       TYR  50  -4.547   4.596   8.222
  403   1HB   TYR  50          2HB       TYR  50  -2.797   2.978   8.257
  404   2HB   TYR  50          1HB       TYR  50  -3.938   1.634   8.261
  405    HD1  TYR  50           1HD      TYR  50  -3.424   0.460   6.268
  406    HD2  TYR  50           2HD      TYR  50  -3.997   4.716   6.158
  407    HE1  TYR  50           1HE      TYR  50  -3.363   0.404   3.790
  408    HE2  TYR  50           2HE      TYR  50  -3.937   4.660   3.680
  409    HH   TYR  50           HH       TYR  50  -4.127   1.742   1.902
  410    H    GLU  51           H        GLU  51  -6.239   1.417   8.211
  411    HA   GLU  51           HA       GLU  51  -7.815   1.968   5.909
  412   1HB   GLU  51          2HB       GLU  51  -7.219  -0.054   7.847
  413   2HB   GLU  51          1HB       GLU  51  -8.958   0.057   7.673
  414   1HG   GLU  51          2HG       GLU  51  -8.108  -1.512   6.034
  415   2HG   GLU  51          1HG       GLU  51  -8.664  -0.065   5.199
  416    H    ALA  52           H        ALA  52  -8.433   2.237   9.414
  417    HA   ALA  52           HA       ALA  52 -11.216   2.891   9.247
  418   1HB   ALA  52          1HB       ALA  52  -9.867   4.180  11.448
  419   2HB   ALA  52          2HB       ALA  52  -9.157   2.587  11.177
  420   3HB   ALA  52          3HB       ALA  52 -10.888   2.742  11.478
  421    H    GLN  53           H        GLN  53  -8.288   4.928   9.259
  422    HA   GLN  53           HA       GLN  53  -9.317   7.491   9.485
  423   1HB   GLN  53          2HB       GLN  53  -7.193   6.271   7.717
  424   2HB   GLN  53          1HB       GLN  53  -7.466   8.012   7.748
  425   1HG   GLN  53          2HG       GLN  53  -7.218   6.635  10.379
  426   2HG   GLN  53          1HG       GLN  53  -5.746   6.815   9.424
  427   1HE2  GLN  53          1HE2      GLN  53  -4.658   8.656  10.128
  428   2HE2  GLN  53          2HE2      GLN  53  -5.394  10.137  10.507
  429    H    MET  54           H        MET  54  -8.950   5.792   6.340
  430    HA   MET  54           HA       MET  54 -10.868   7.686   5.105
  431   1HB   MET  54          2HB       MET  54 -10.050   6.715   3.045
  432   2HB   MET  54          1HB       MET  54  -8.658   6.963   4.099
  433   1HG   MET  54          2HG       MET  54  -8.992   4.552   4.876
  434   2HG   MET  54          1HG       MET  54 -10.112   4.375   3.527
  435   1HE   MET  54          1HE       MET  54  -8.672   2.488   2.127
  436   2HE   MET  54          2HE       MET  54  -8.080   2.490   3.787
  437   3HE   MET  54          3HE       MET  54  -6.933   2.459   2.450
  438    H    GLU  55           H        GLU  55 -10.959   4.663   6.655
  439    HA   GLU  55           HA       GLU  55 -12.624   2.988   6.779
  440   1HB   GLU  55          2HB       GLU  55 -13.740   5.457   6.935
  441   2HB   GLU  55          1HB       GLU  55 -14.587   4.831   5.521
  442   1HG   GLU  55          2HG       GLU  55 -15.566   3.077   6.718
  443   2HG   GLU  55          1HG       GLU  55 -14.342   3.130   7.986
  444    H    ARG  56           H        ARG  56 -14.548   2.045   5.259
  445    HA   ARG  56           HA       ARG  56 -13.865   2.256   2.381
  446   1HB   ARG  56          2HB       ARG  56 -13.092   0.089   4.232
  447   2HB   ARG  56          1HB       ARG  56 -13.849  -0.467   2.739
  448   1HG   ARG  56          2HG       ARG  56 -11.738   1.646   2.553
  449   2HG   ARG  56          1HG       ARG  56 -11.231  -0.017   2.852
  450   1HD   ARG  56          2HD       ARG  56 -13.086  -0.345   0.834
  451   2HD   ARG  56          1HD       ARG  56 -12.305   1.184   0.388
  452    HE   ARG  56           HE       ARG  56 -10.208   0.032   0.221
  453   1HH1  ARG  56          1HH1      ARG  56 -12.334  -1.838   2.112
  454   2HH1  ARG  56          2HH1      ARG  56 -11.667  -3.363   1.630
  455   1HH2  ARG  56          1HH2      ARG  56  -9.520  -1.981  -0.717
  456   2HH2  ARG  56          2HH2      ARG  56 -10.075  -3.444   0.027
  Start of MODEL   15
    1   1H    ALA   2          1H        ALA   2  12.683 -25.765 -15.942
    2   2H    ALA   2          2H        ALA   2  11.009 -25.729 -16.231
    3   3H    ALA   2          3H        ALA   2  11.751 -27.159 -15.691
    4    HA   ALA   2           HA       ALA   2  11.982 -26.409 -13.533
    5   1HB   ALA   2          1HB       ALA   2  12.924 -24.222 -14.868
    6   2HB   ALA   2          2HB       ALA   2  12.679 -24.267 -13.122
    7   3HB   ALA   2          3HB       ALA   2  11.446 -23.565 -14.169
    8    H    LYS   3           H        LYS   3  10.001 -27.320 -12.945
    9    HA   LYS   3           HA       LYS   3   7.509 -25.806 -13.602
   10   1HB   LYS   3          2HB       LYS   3   7.955 -28.625 -12.566
   11   2HB   LYS   3          1HB       LYS   3   6.420 -27.956 -13.122
   12   1HG   LYS   3          2HG       LYS   3   6.940 -28.342 -15.282
   13   2HG   LYS   3          1HG       LYS   3   8.520 -27.579 -15.100
   14   1HD   LYS   3          2HD       LYS   3   8.222 -30.235 -13.816
   15   2HD   LYS   3          1HD       LYS   3   8.197 -30.231 -15.579
   16   1HE   LYS   3          2HE       LYS   3  10.338 -29.024 -15.640
   17   2HE   LYS   3          1HE       LYS   3  10.362 -28.956 -13.866
   18   1HZ   LYS   3          1HZ       LYS   3  10.529 -31.330 -15.619
   19   2HZ   LYS   3          2HZ       LYS   3  10.007 -31.470 -14.009
   20   3HZ   LYS   3          3HZ       LYS   3  11.562 -30.876 -14.353
   21    H    VAL   4           H        VAL   4   7.863 -24.209 -11.872
   22    HA   VAL   4           HA       VAL   4   7.236 -25.322  -9.160
   23    HB   VAL   4           HB       VAL   4   9.569 -24.768  -9.169
   24   1HG1  VAL   4          1HG1      VAL   4   9.732 -23.509 -11.212
   25   2HG1  VAL   4          2HG1      VAL   4  10.291 -22.452  -9.918
   26   3HG1  VAL   4          3HG1      VAL   4   8.672 -22.245 -10.587
   27   1HG2  VAL   4          1HG2      VAL   4   7.922 -23.696  -7.386
   28   2HG2  VAL   4          2HG2      VAL   4   8.449 -22.188  -8.131
   29   3HG2  VAL   4          3HG2      VAL   4   9.633 -23.268  -7.395
   30    H    GLN   5           H        GLN   5   4.983 -24.694  -9.742
   31    HA   GLN   5           HA       GLN   5   4.131 -22.110 -10.514
   32   1HB   GLN   5          2HB       GLN   5   2.995 -24.400  -8.933
   33   2HB   GLN   5          1HB       GLN   5   2.068 -22.906  -9.075
   34   1HG   GLN   5          2HG       GLN   5   3.254 -24.069 -11.562
   35   2HG   GLN   5          1HG       GLN   5   1.823 -24.844 -10.882
   36   1HE2  GLN   5          1HE2      GLN   5   0.251 -22.800  -9.990
   37   2HE2  GLN   5          2HE2      GLN   5  -0.111 -21.705 -11.236
   38    H    ALA   6           H        ALA   6   2.475 -21.112  -8.529
   39    HA   ALA   6           HA       ALA   6   3.629 -20.817  -5.932
   40   1HB   ALA   6          1HB       ALA   6   5.494 -19.687  -6.625
   41   2HB   ALA   6          2HB       ALA   6   4.394 -18.312  -6.721
   42   3HB   ALA   6          3HB       ALA   6   4.766 -19.246  -8.170
   43    H    TYR   7           H        TYR   7   1.344 -20.801  -5.449
   44    HA   TYR   7           HA       TYR   7  -0.377 -18.690  -6.554
   45   1HB   TYR   7          2HB       TYR   7  -0.568 -21.131  -4.902
   46   2HB   TYR   7          1HB       TYR   7  -1.732 -19.873  -4.483
   47    HD1  TYR   7           1HD      TYR   7  -3.655 -19.538  -5.798
   48    HD2  TYR   7           2HD      TYR   7  -0.354 -21.775  -7.395
   49    HE1  TYR   7           1HE      TYR   7  -5.019 -20.135  -7.782
   50    HE2  TYR   7           2HE      TYR   7  -1.716 -22.371  -9.380
   51    HH   TYR   7           HH       TYR   7  -4.770 -22.370  -9.577
   52    H    VAL   8           H        VAL   8   1.735 -17.399  -5.347
   53    HA   VAL   8           HA       VAL   8   0.482 -16.292  -2.857
   54    HB   VAL   8           HB       VAL   8   3.331 -17.115  -3.455
   55   1HG1  VAL   8          1HG1      VAL   8   2.327 -14.943  -1.737
   56   2HG1  VAL   8          2HG1      VAL   8   3.962 -15.245  -2.329
   57   3HG1  VAL   8          3HG1      VAL   8   3.370 -16.094  -0.900
   58   1HG2  VAL   8          1HG2      VAL   8   2.513 -17.843  -0.866
   59   2HG2  VAL   8          2HG2      VAL   8   2.652 -18.909  -2.263
   60   3HG2  VAL   8          3HG2      VAL   8   1.108 -18.141  -1.891
   61    H    SER   9           H        SER   9  -0.272 -14.370  -3.818
   62    HA   SER   9           HA       SER   9   1.787 -12.673  -5.192
   63   1HB   SER   9          2HB       SER   9  -1.011 -13.406  -5.728
   64   2HB   SER   9          1HB       SER   9  -0.701 -11.677  -5.858
   65    HG   SER   9           HG       SER   9   1.102 -13.493  -7.006
   66    H    ASP  10           H        ASP  10   2.500 -11.572  -3.288
   67    HA   ASP  10           HA       ASP  10   0.838 -10.530  -1.232
   68   1HB   ASP  10          2HB       ASP  10   2.867  -9.001  -0.926
   69   2HB   ASP  10          1HB       ASP  10   3.212 -10.731  -0.949
   70    H    GLU  11           H        GLU  11  -0.979  -9.694  -2.658
   71    HA   GLU  11           HA       GLU  11  -0.769  -7.565  -4.496
   72   1HB   GLU  11          2HB       GLU  11  -3.142  -7.165  -3.831
   73   2HB   GLU  11          1HB       GLU  11  -2.796  -8.879  -4.053
   74   1HG   GLU  11          2HG       GLU  11  -2.165  -8.579  -1.419
   75   2HG   GLU  11          1HG       GLU  11  -3.462  -7.394  -1.581
   76    H    ILE  12           H        ILE  12  -0.587  -7.535  -0.983
   77    HA   ILE  12           HA       ILE  12  -1.113  -4.823  -0.407
   78    HB   ILE  12           HB       ILE  12   0.753  -6.911   0.731
   79   1HG1  ILE  12          2HG1      ILE  12  -1.759  -7.148   0.891
   80   2HG1  ILE  12          1HG1      ILE  12  -0.940  -7.077   2.452
   81   1HG2  ILE  12          1HG2      ILE  12   1.838  -5.270   1.837
   82   2HG2  ILE  12          2HG2      ILE  12   0.330  -4.979   2.705
   83   3HG2  ILE  12          3HG2      ILE  12   0.709  -4.044   1.257
   84   1HD1  ILE  12          1HD1      ILE  12  -2.945  -5.296   1.386
   85   2HD1  ILE  12          2HD1      ILE  12  -1.466  -4.398   1.728
   86   3HD1  ILE  12          3HD1      ILE  12  -2.246  -5.332   3.005
   87    H    VAL  13           H        VAL  13   2.038  -6.328  -1.223
   88    HA   VAL  13           HA       VAL  13   3.785  -4.207  -1.106
   89    HB   VAL  13           HB       VAL  13   3.396  -6.341  -3.218
   90   1HG1  VAL  13          1HG1      VAL  13   5.038  -5.425  -4.451
   91   2HG1  VAL  13          2HG1      VAL  13   6.108  -5.428  -3.049
   92   3HG1  VAL  13          3HG1      VAL  13   5.069  -4.038  -3.363
   93   1HG2  VAL  13          1HG2      VAL  13   5.341  -6.066  -0.903
   94   2HG2  VAL  13          2HG2      VAL  13   5.210  -7.449  -1.989
   95   3HG2  VAL  13          3HG2      VAL  13   3.888  -7.065  -0.889
   96    H    TYR  14           H        TYR  14   1.611  -4.868  -3.880
   97    HA   TYR  14           HA       TYR  14   2.359  -2.468  -5.321
   98   1HB   TYR  14          2HB       TYR  14   1.078  -4.819  -5.858
   99   2HB   TYR  14          1HB       TYR  14  -0.292  -3.713  -5.771
  100    HD1  TYR  14           1HD      TYR  14  -0.626  -1.988  -7.422
  101    HD2  TYR  14           2HD      TYR  14   2.913  -4.421  -7.488
  102    HE1  TYR  14           1HE      TYR  14  -0.075  -1.126  -9.681
  103    HE2  TYR  14           2HE      TYR  14   3.462  -3.560  -9.747
  104    HH   TYR  14           HH       TYR  14   1.228  -1.810 -11.638
  105    H    LYS  15           H        LYS  15  -0.325  -3.309  -3.132
  106    HA   LYS  15           HA       LYS  15  -1.972  -1.052  -3.446
  107   1HB   LYS  15          2HB       LYS  15  -2.269  -3.165  -2.045
  108   2HB   LYS  15          1HB       LYS  15  -1.268  -2.386  -0.819
  109   1HG   LYS  15          2HG       LYS  15  -2.867  -0.448  -0.836
  110   2HG   LYS  15          1HG       LYS  15  -3.909  -1.379  -1.913
  111   1HD   LYS  15          2HD       LYS  15  -4.715  -1.714   0.336
  112   2HD   LYS  15          1HD       LYS  15  -3.926  -3.208  -0.170
  113   1HE   LYS  15          2HE       LYS  15  -3.191  -2.638   2.102
  114   2HE   LYS  15          1HE       LYS  15  -1.828  -2.419   0.986
  115   1HZ   LYS  15          1HZ       LYS  15  -1.931  -0.186   1.141
  116   2HZ   LYS  15          2HZ       LYS  15  -2.685  -0.503   2.630
  117   3HZ   LYS  15          3HZ       LYS  15  -3.623  -0.152   1.258
  118    H    ILE  16           H        ILE  16   1.103  -1.346  -1.729
  119    HA   ILE  16           HA       ILE  16   0.876   1.259  -0.413
  120    HB   ILE  16           HB       ILE  16   3.320  -0.461  -0.913
  121   1HG1  ILE  16          2HG1      ILE  16   1.101  -0.727   1.129
  122   2HG1  ILE  16          1HG1      ILE  16   1.677  -1.949  -0.002
  123   1HG2  ILE  16          1HG2      ILE  16   3.265   1.972   0.175
  124   2HG2  ILE  16          2HG2      ILE  16   4.308   0.706   0.824
  125   3HG2  ILE  16          3HG2      ILE  16   2.765   1.062   1.601
  126   1HD1  ILE  16          1HD1      ILE  16   2.617  -1.396   2.651
  127   2HD1  ILE  16          2HD1      ILE  16   3.925  -1.082   1.509
  128   3HD1  ILE  16          3HD1      ILE  16   3.145  -2.663   1.544
  129    H    ASN  17           H        ASN  17   2.574  -0.057  -3.257
  130    HA   ASN  17           HA       ASN  17   4.181   2.105  -4.002
  131   1HB   ASN  17          2HB       ASN  17   2.648  -0.052  -5.389
  132   2HB   ASN  17          1HB       ASN  17   3.350   1.218  -6.392
  133   1HD2  ASN  17          1HD2      ASN  17   5.330   0.492  -7.179
  134   2HD2  ASN  17          2HD2      ASN  17   6.485  -0.359  -6.273
  135    H    LYS  18           H        LYS  18   0.717   1.622  -4.785
  136    HA   LYS  18           HA       LYS  18   0.475   4.168  -6.171
  137   1HB   LYS  18          2HB       LYS  18  -1.892   3.540  -6.216
  138   2HB   LYS  18          1HB       LYS  18  -0.906   2.118  -6.555
  139   1HG   LYS  18          2HG       LYS  18  -1.021   1.853  -3.906
  140   2HG   LYS  18          1HG       LYS  18  -2.509   2.774  -4.122
  141   1HD   LYS  18          2HD       LYS  18  -2.810   0.978  -6.117
  142   2HD   LYS  18          1HD       LYS  18  -1.851   0.011  -4.997
  143   1HE   LYS  18          2HE       LYS  18  -3.480   0.542  -3.180
  144   2HE   LYS  18          1HE       LYS  18  -4.474   1.413  -4.366
  145   1HZ   LYS  18          1HZ       LYS  18  -4.143  -0.766  -5.729
  146   2HZ   LYS  18          2HZ       LYS  18  -5.347  -0.688  -4.533
  147   3HZ   LYS  18          3HZ       LYS  18  -3.870  -1.460  -4.205
  148    H    ILE  19           H        ILE  19   0.227   3.122  -2.848
  149    HA   ILE  19           HA       ILE  19  -1.335   5.402  -1.912
  150    HB   ILE  19           HB       ILE  19   0.306   3.192  -0.663
  151   1HG1  ILE  19          2HG1      ILE  19  -2.651   3.854  -0.506
  152   2HG1  ILE  19          1HG1      ILE  19  -1.958   2.733  -1.678
  153   1HG2  ILE  19          1HG2      ILE  19  -1.254   5.365   0.771
  154   2HG2  ILE  19          2HG2      ILE  19   0.503   5.207   0.764
  155   3HG2  ILE  19          3HG2      ILE  19  -0.491   3.970   1.533
  156   1HD1  ILE  19          1HD1      ILE  19  -0.863   1.779   0.623
  157   2HD1  ILE  19          2HD1      ILE  19  -2.376   1.182  -0.058
  158   3HD1  ILE  19          3HD1      ILE  19  -2.404   2.387   1.228
  159    H    VAL  20           H        VAL  20   2.113   4.589  -2.131
  160    HA   VAL  20           HA       VAL  20   3.143   6.733  -0.543
  161    HB   VAL  20           HB       VAL  20   4.372   5.444  -2.997
  162   1HG1  VAL  20          1HG1      VAL  20   5.312   7.339  -1.115
  163   2HG1  VAL  20          2HG1      VAL  20   6.253   6.490  -2.341
  164   3HG1  VAL  20          3HG1      VAL  20   6.101   5.813  -0.719
  165   1HG2  VAL  20          1HG2      VAL  20   3.446   4.247  -0.530
  166   2HG2  VAL  20          2HG2      VAL  20   5.200   4.114  -0.647
  167   3HG2  VAL  20          3HG2      VAL  20   4.180   3.466  -1.931
  168    H    GLU  21           H        GLU  21   2.652   6.501  -4.087
  169    HA   GLU  21           HA       GLU  21   3.592   8.942  -4.974
  170   1HB   GLU  21          2HB       GLU  21   2.036   6.906  -5.939
  171   2HB   GLU  21          1HB       GLU  21   0.880   8.238  -5.925
  172   1HG   GLU  21          2HG       GLU  21   3.246   9.355  -6.935
  173   2HG   GLU  21          1HG       GLU  21   3.118   7.779  -7.716
  174    H    ARG  22           H        ARG  22   0.393   8.382  -3.467
  175    HA   ARG  22           HA       ARG  22  -0.803  10.867  -3.641
  176   1HB   ARG  22          2HB       ARG  22  -0.648   8.695  -1.606
  177   2HB   ARG  22          1HB       ARG  22  -1.392  10.211  -1.093
  178   1HG   ARG  22          2HG       ARG  22  -3.267   9.262  -2.001
  179   2HG   ARG  22          1HG       ARG  22  -2.592   9.907  -3.498
  180   1HD   ARG  22          2HD       ARG  22  -1.620   7.783  -4.079
  181   2HD   ARG  22          1HD       ARG  22  -1.970   7.118  -2.471
  182    HE   ARG  22           HE       ARG  22  -4.417   7.436  -3.035
  183   1HH1  ARG  22          1HH1      ARG  22  -2.718   8.547  -5.666
  184   2HH1  ARG  22          2HH1      ARG  22  -3.499   7.540  -6.840
  185   1HH2  ARG  22          1HH2      ARG  22  -5.142   5.606  -4.477
  186   2HH2  ARG  22          2HH2      ARG  22  -4.871   5.876  -6.167
  187    H    ARG  23           H        ARG  23   1.726   9.938  -1.285
  188    HA   ARG  23           HA       ARG  23   1.905  12.168   0.333
  189   1HB   ARG  23          2HB       ARG  23   3.373  10.005   0.023
  190   2HB   ARG  23          1HB       ARG  23   4.379  11.060  -0.971
  191   1HG   ARG  23          2HG       ARG  23   5.217  12.112   0.841
  192   2HG   ARG  23          1HG       ARG  23   3.610  12.347   1.529
  193   1HD   ARG  23          2HD       ARG  23   4.873   9.610   1.601
  194   2HD   ARG  23          1HD       ARG  23   5.295  10.822   2.827
  195    HE   ARG  23           HE       ARG  23   2.463  10.019   2.268
  196   1HH1  ARG  23          1HH1      ARG  23   3.863  12.323   4.050
  197   2HH1  ARG  23          2HH1      ARG  23   3.433  11.710   5.612
  198   1HH2  ARG  23          1HH2      ARG  23   2.407   8.622   4.411
  199   2HH2  ARG  23          2HH2      ARG  23   2.609   9.615   5.817
  200    H    ARG  24           H        ARG  24   3.704  11.893  -2.766
  201    HA   ARG  24           HA       ARG  24   4.361  14.721  -2.804
  202   1HB   ARG  24          2HB       ARG  24   5.285  12.440  -3.986
  203   2HB   ARG  24          1HB       ARG  24   4.363  13.142  -5.316
  204   1HG   ARG  24          2HG       ARG  24   6.488  14.113  -5.581
  205   2HG   ARG  24          1HG       ARG  24   5.593  15.352  -4.700
  206   1HD   ARG  24          2HD       ARG  24   7.776  15.044  -3.631
  207   2HD   ARG  24          1HD       ARG  24   6.524  14.394  -2.553
  208    HE   ARG  24           HE       ARG  24   7.074  12.131  -3.433
  209   1HH1  ARG  24          1HH1      ARG  24   9.573  13.512  -2.216
  210   2HH1  ARG  24          2HH1      ARG  24  10.775  13.039  -3.370
  211   1HH2  ARG  24          1HH2      ARG  24   8.468  12.039  -5.758
  212   2HH2  ARG  24          2HH2      ARG  24  10.149  12.206  -5.377
  213    H    ALA  25           H        ALA  25   1.841  12.709  -4.286
  214    HA   ALA  25           HA       ALA  25   0.757  14.501  -6.160
  215   1HB   ALA  25          1HB       ALA  25   0.154  12.043  -5.115
  216   2HB   ALA  25          2HB       ALA  25  -0.910  12.933  -6.205
  217   3HB   ALA  25          3HB       ALA  25  -1.162  13.018  -4.462
  218    H    GLU  26           H        GLU  26   0.532  14.518  -2.640
  219    HA   GLU  26           HA       GLU  26  -1.451  16.694  -2.674
  220   1HB   GLU  26          2HB       GLU  26  -1.687  16.200  -0.376
  221   2HB   GLU  26          1HB       GLU  26  -1.322  14.633  -1.094
  222   1HG   GLU  26          2HG       GLU  26   1.190  15.702  -0.575
  223   2HG   GLU  26          1HG       GLU  26   0.235  16.201   0.820
  224    H    GLY  27           H        GLY  27   1.989  16.240  -2.394
  225   1HA   GLY  27          2HA       GLY  27   3.353  18.291  -2.826
  226   2HA   GLY  27          1HA       GLY  27   2.262  19.146  -1.733
  227    H    ALA  28           H        ALA  28   4.083  16.065  -1.536
  228    HA   ALA  28           HA       ALA  28   4.517  16.033   1.233
  229   1HB   ALA  28          1HB       ALA  28   5.066  14.322  -0.589
  230   2HB   ALA  28          2HB       ALA  28   6.260  14.473   0.699
  231   3HB   ALA  28          3HB       ALA  28   6.549  15.233  -0.866
  232    H    LYS  29           H        LYS  29   7.054  16.219   2.013
  233    HA   LYS  29           HA       LYS  29   8.114  18.869   1.114
  234   1HB   LYS  29          2HB       LYS  29   6.665  18.291   3.490
  235   2HB   LYS  29          1HB       LYS  29   8.344  18.544   3.967
  236   1HG   LYS  29          2HG       LYS  29   7.675  20.742   3.950
  237   2HG   LYS  29          1HG       LYS  29   8.093  20.591   2.243
  238   1HD   LYS  29          2HD       LYS  29   5.582  19.723   2.068
  239   2HD   LYS  29          1HD       LYS  29   5.397  20.687   3.535
  240   1HE   LYS  29          2HE       LYS  29   5.143  22.471   2.141
  241   2HE   LYS  29          1HE       LYS  29   6.887  22.336   1.838
  242   1HZ   LYS  29          1HZ       LYS  29   5.224  22.125  -0.135
  243   2HZ   LYS  29          2HZ       LYS  29   5.032  20.537   0.435
  244   3HZ   LYS  29          3HZ       LYS  29   6.564  21.090  -0.048
  245    H    SER  30           H        SER  30   8.688  15.970   3.130
  246    HA   SER  30           HA       SER  30  11.622  16.377   2.904
  247   1HB   SER  30          2HB       SER  30   9.698  14.986   4.651
  248   2HB   SER  30          1HB       SER  30  11.171  14.072   4.339
  249    HG   SER  30           HG       SER  30  11.216  15.602   6.154
  250    H    THR  31           H        THR  31  12.980  14.789   1.919
  251    HA   THR  31           HA       THR  31  11.804  13.339  -0.316
  252    HB   THR  31           HB       THR  31  14.590  13.385   0.891
  253    HG1  THR  31           1HG      THR  31  13.805  14.726  -1.436
  254   1HG2  THR  31          1HG2      THR  31  13.396  11.976  -1.389
  255   2HG2  THR  31          2HG2      THR  31  14.930  11.689  -0.567
  256   3HG2  THR  31          3HG2      THR  31  14.817  12.926  -1.818
  257    H    ASP  32           H        ASP  32  11.835  12.626   2.909
  258    HA   ASP  32           HA       ASP  32  12.800   9.971   3.141
  259   1HB   ASP  32          2HB       ASP  32  10.827  11.754   4.480
  260   2HB   ASP  32          1HB       ASP  32  10.700  10.033   4.846
  261    H    VAL  33           H        VAL  33  10.115  11.173   1.348
  262    HA   VAL  33           HA       VAL  33   8.255   9.050   1.440
  263    HB   VAL  33           HB       VAL  33   9.157  10.993  -0.692
  264   1HG1  VAL  33          1HG1      VAL  33   6.986  10.324  -1.856
  265   2HG1  VAL  33          2HG1      VAL  33   6.978   8.895  -0.823
  266   3HG1  VAL  33          3HG1      VAL  33   8.300   9.150  -1.963
  267   1HG2  VAL  33          1HG2      VAL  33   7.931  11.764   1.378
  268   2HG2  VAL  33          2HG2      VAL  33   6.568  10.764   0.874
  269   3HG2  VAL  33          3HG2      VAL  33   7.089  12.120  -0.129
  270    H    SER  34           H        SER  34   8.159   7.043   0.436
  271    HA   SER  34           HA       SER  34   9.620   6.120  -1.790
  272   1HB   SER  34          2HB       SER  34  11.680   6.486  -0.728
  273   2HB   SER  34          1HB       SER  34  11.042   6.070   0.860
  274    HG   SER  34           HG       SER  34  12.349   4.402   0.022
  275    H    PHE  35           H        PHE  35   8.887   4.038  -2.272
  276    HA   PHE  35           HA       PHE  35   6.706   2.843  -1.077
  277   1HB   PHE  35          2HB       PHE  35   7.721   2.148  -3.200
  278   2HB   PHE  35          1HB       PHE  35   9.128   1.520  -2.343
  279    HD1  PHE  35           1HD      PHE  35   8.492  -0.635  -3.626
  280    HD2  PHE  35           2HD      PHE  35   6.069   1.077  -0.517
  281    HE1  PHE  35           1HE      PHE  35   7.342  -2.812  -3.322
  282    HE2  PHE  35           2HE      PHE  35   4.923  -1.101  -0.212
  283    HZ   PHE  35           HZ       PHE  35   5.557  -3.044  -1.615
  284    H    SER  36           H        SER  36  10.127   2.210  -0.235
  285    HA   SER  36           HA       SER  36   9.565   0.294   1.839
  286   1HB   SER  36          2HB       SER  36  11.905   2.176   1.394
  287   2HB   SER  36          1HB       SER  36  11.928   0.754   2.432
  288    HG   SER  36           HG       SER  36  11.429  -0.487   0.555
  289    H    SER  37           H        SER  37   9.768   3.822   1.772
  290    HA   SER  37           HA       SER  37   9.806   4.187   4.651
  291   1HB   SER  37          2HB       SER  37  10.519   5.771   2.752
  292   2HB   SER  37          1HB       SER  37   8.805   6.109   2.538
  293    HG   SER  37           HG       SER  37  10.464   7.166   4.291
  294    H    ILE  38           H        ILE  38   7.221   4.656   2.198
  295    HA   ILE  38           HA       ILE  38   5.105   5.119   4.057
  296    HB   ILE  38           HB       ILE  38   5.181   3.949   1.257
  297   1HG1  ILE  38          2HG1      ILE  38   6.107   6.209   1.417
  298   2HG1  ILE  38          1HG1      ILE  38   4.527   6.278   0.634
  299   1HG2  ILE  38          1HG2      ILE  38   2.746   5.139   1.486
  300   2HG2  ILE  38          2HG2      ILE  38   2.953   4.521   3.125
  301   3HG2  ILE  38          3HG2      ILE  38   3.016   3.417   1.752
  302   1HD1  ILE  38          1HD1      ILE  38   5.387   7.389   3.220
  303   2HD1  ILE  38          2HD1      ILE  38   3.857   6.513   3.291
  304   3HD1  ILE  38          3HD1      ILE  38   4.048   7.870   2.178
  305    H    SER  39           H        SER  39   6.670   2.179   2.985
  306    HA   SER  39           HA       SER  39   4.561   0.351   3.810
  307   1HB   SER  39          2HB       SER  39   6.253  -1.317   3.309
  308   2HB   SER  39          1HB       SER  39   6.380  -0.038   2.104
  309    HG   SER  39           HG       SER  39   8.411  -0.667   3.033
  310    H    THR  40           H        THR  40   7.850   0.838   5.156
  311    HA   THR  40           HA       THR  40   7.542  -0.538   7.568
  312    HB   THR  40           HB       THR  40   9.641   0.401   6.705
  313    HG1  THR  40           1HG      THR  40  10.109   1.667   8.794
  314   1HG2  THR  40          1HG2      THR  40   8.591   2.519   5.859
  315   2HG2  THR  40          2HG2      THR  40  10.088   2.778   6.753
  316   3HG2  THR  40          3HG2      THR  40   8.534   3.097   7.524
  317    H    MET  41           H        MET  41   6.761   2.914   6.955
  318    HA   MET  41           HA       MET  41   5.923   3.507   9.628
  319   1HB   MET  41          2HB       MET  41   5.099   5.522   8.645
  320   2HB   MET  41          1HB       MET  41   6.483   5.054   7.659
  321   1HG   MET  41          2HG       MET  41   4.906   5.489   6.011
  322   2HG   MET  41          1HG       MET  41   4.657   3.763   6.258
  323   1HE   MET  41          1HE       MET  41   2.448   5.792   4.953
  324   2HE   MET  41          2HE       MET  41   1.068   4.920   5.618
  325   3HE   MET  41          3HE       MET  41   2.482   4.026   5.063
  326    H    LEU  42           H        LEU  42   4.204   2.092   6.865
  327    HA   LEU  42           HA       LEU  42   1.553   2.297   7.991
  328   1HB   LEU  42          2HB       LEU  42   1.627   1.940   5.687
  329   2HB   LEU  42          1HB       LEU  42   2.961   0.795   5.806
  330    HG   LEU  42           HG       LEU  42   1.395  -0.835   6.873
  331   1HD1  LEU  42          1HD1      LEU  42  -0.567   1.377   6.246
  332   2HD1  LEU  42          2HD1      LEU  42  -0.296   0.572   7.792
  333   3HD1  LEU  42          3HD1      LEU  42  -1.076  -0.295   6.469
  334   1HD2  LEU  42          1HD2      LEU  42   0.804  -1.650   4.819
  335   2HD2  LEU  42          2HD2      LEU  42   1.780  -0.305   4.230
  336   3HD2  LEU  42          3HD2      LEU  42   0.027  -0.143   4.335
  337    H    LEU  43           H        LEU  43   3.956  -0.358   7.881
  338    HA   LEU  43           HA       LEU  43   2.487  -2.338   9.234
  339   1HB   LEU  43          2HB       LEU  43   4.923  -2.174   8.159
  340   2HB   LEU  43          1HB       LEU  43   5.387  -1.956   9.848
  341    HG   LEU  43           HG       LEU  43   3.495  -4.032   9.861
  342   1HD1  LEU  43          1HD1      LEU  43   4.868  -3.903   7.318
  343   2HD1  LEU  43          2HD1      LEU  43   3.645  -5.054   7.856
  344   3HD1  LEU  43          3HD1      LEU  43   5.351  -5.360   8.186
  345   1HD2  LEU  43          1HD2      LEU  43   6.530  -4.182   9.936
  346   2HD2  LEU  43          2HD2      LEU  43   5.416  -5.380  10.597
  347   3HD2  LEU  43          3HD2      LEU  43   5.502  -3.770  11.309
  348    H    GLU  44           H        GLU  44   3.813   0.630  10.484
  349    HA   GLU  44           HA       GLU  44   3.987  -0.141  13.268
  350   1HB   GLU  44          2HB       GLU  44   4.216   2.214  11.571
  351   2HB   GLU  44          1HB       GLU  44   3.318   2.597  13.040
  352   1HG   GLU  44          2HG       GLU  44   5.338   1.097  14.077
  353   2HG   GLU  44          1HG       GLU  44   6.163   1.844  12.709
  354    H    LEU  45           H        LEU  45   1.508   0.878  11.065
  355    HA   LEU  45           HA       LEU  45  -0.571   0.959  13.198
  356   1HB   LEU  45          2HB       LEU  45  -0.402   1.770  10.282
  357   2HB   LEU  45          1HB       LEU  45  -1.888   1.876  11.224
  358    HG   LEU  45           HG       LEU  45   0.341   3.063  12.659
  359   1HD1  LEU  45          1HD1      LEU  45  -0.359   4.244   9.952
  360   2HD1  LEU  45          2HD1      LEU  45   1.182   3.496  10.370
  361   3HD1  LEU  45          3HD1      LEU  45   0.683   4.989  11.162
  362   1HD2  LEU  45          1HD2      LEU  45  -1.368   5.073  12.306
  363   2HD2  LEU  45          2HD2      LEU  45  -1.748   3.743  13.398
  364   3HD2  LEU  45          3HD2      LEU  45  -2.431   3.771  11.772
  365    H    GLY  46           H        GLY  46   0.796  -1.110  10.831
  366   1HA   GLY  46          2HA       GLY  46   0.122  -3.183   9.977
  367   2HA   GLY  46          1HA       GLY  46  -0.979  -3.270  11.356
  368    H    LEU  47           H        LEU  47  -1.067  -0.681   8.965
  369    HA   LEU  47           HA       LEU  47  -2.696  -0.138   7.340
  370   1HB   LEU  47          2HB       LEU  47  -3.685  -2.974   7.681
  371   2HB   LEU  47          1HB       LEU  47  -3.749  -1.966   6.238
  372    HG   LEU  47           HG       LEU  47  -1.019  -2.125   7.035
  373   1HD1  LEU  47          1HD1      LEU  47  -1.388  -4.853   6.396
  374   2HD1  LEU  47          2HD1      LEU  47  -2.524  -4.502   7.700
  375   3HD1  LEU  47          3HD1      LEU  47  -0.803  -4.186   7.919
  376   1HD2  LEU  47          1HD2      LEU  47  -1.052  -3.560   4.814
  377   2HD2  LEU  47          2HD2      LEU  47  -1.432  -1.839   4.761
  378   3HD2  LEU  47          3HD2      LEU  47  -2.732  -3.030   4.741
  379    H    ARG  48           H        ARG  48  -4.068  -2.241   9.916
  380    HA   ARG  48           HA       ARG  48  -6.716  -1.468   9.928
  381   1HB   ARG  48          2HB       ARG  48  -5.107  -2.926  11.513
  382   2HB   ARG  48          1HB       ARG  48  -5.287  -1.508  12.546
  383   1HG   ARG  48          2HG       ARG  48  -7.412  -2.051  13.071
  384   2HG   ARG  48          1HG       ARG  48  -7.830  -2.316  11.379
  385   1HD   ARG  48          2HD       ARG  48  -6.179  -4.349  12.884
  386   2HD   ARG  48          1HD       ARG  48  -7.953  -4.370  12.964
  387    HE   ARG  48           HE       ARG  48  -7.293  -4.080  10.242
  388   1HH1  ARG  48          1HH1      ARG  48  -5.043  -5.936  11.084
  389   2HH1  ARG  48          2HH1      ARG  48  -5.756  -7.488  10.805
  390   1HH2  ARG  48          1HH2      ARG  48  -8.994  -6.262  10.615
  391   2HH2  ARG  48          2HH2      ARG  48  -7.992  -7.673  10.539
  392    H    VAL  49           H        VAL  49  -4.471   0.113  12.229
  393    HA   VAL  49           HA       VAL  49  -6.080   2.363  12.754
  394    HB   VAL  49           HB       VAL  49  -3.052   2.230  12.636
  395   1HG1  VAL  49          1HG1      VAL  49  -3.768   4.457  13.121
  396   2HG1  VAL  49          2HG1      VAL  49  -3.354   3.737  14.676
  397   3HG1  VAL  49          3HG1      VAL  49  -5.043   3.886  14.197
  398   1HG2  VAL  49          1HG2      VAL  49  -3.999   1.704  15.244
  399   2HG2  VAL  49          2HG2      VAL  49  -3.196   0.572  14.157
  400   3HG2  VAL  49          3HG2      VAL  49  -4.956   0.684  14.170
  401    H    TYR  50           H        TYR  50  -3.711   1.838  10.156
  402    HA   TYR  50           HA       TYR  50  -3.638   4.502   9.127
  403   1HB   TYR  50          2HB       TYR  50  -2.004   2.916   8.434
  404   2HB   TYR  50          1HB       TYR  50  -3.230   1.731   7.988
  405    HD1  TYR  50           1HD      TYR  50  -1.288   4.596   6.899
  406    HD2  TYR  50           2HD      TYR  50  -4.717   2.170   5.997
  407    HE1  TYR  50           1HE      TYR  50  -1.310   5.486   4.584
  408    HE2  TYR  50           2HE      TYR  50  -4.739   3.061   3.683
  409    HH   TYR  50           HH       TYR  50  -2.608   5.685   2.704
  410    H    GLU  51           H        GLU  51  -5.723   1.718   8.274
  411    HA   GLU  51           HA       GLU  51  -7.211   3.031   6.228
  412   1HB   GLU  51          2HB       GLU  51  -6.907   0.528   7.257
  413   2HB   GLU  51          1HB       GLU  51  -8.491   0.953   7.898
  414   1HG   GLU  51          2HG       GLU  51  -8.292   1.784   5.145
  415   2HG   GLU  51          1HG       GLU  51  -7.879   0.076   5.285
  416    H    ALA  52           H        ALA  52  -7.392   3.141   9.716
  417    HA   ALA  52           HA       ALA  52 -10.128   3.951  10.021
  418   1HB   ALA  52          1HB       ALA  52  -8.168   5.088  11.892
  419   2HB   ALA  52          2HB       ALA  52  -7.939   3.363  11.609
  420   3HB   ALA  52          3HB       ALA  52  -9.488   3.962  12.203
  421    H    GLN  53           H        GLN  53  -7.143   5.774   9.390
  422    HA   GLN  53           HA       GLN  53  -8.476   8.362   9.598
  423   1HB   GLN  53          2HB       GLN  53  -6.232   9.174   8.956
  424   2HB   GLN  53          1HB       GLN  53  -6.120   7.967  10.237
  425   1HG   GLN  53          2HG       GLN  53  -5.138   6.411   8.873
  426   2HG   GLN  53          1HG       GLN  53  -6.049   6.929   7.455
  427   1HE2  GLN  53          1HE2      GLN  53  -3.845   6.848   6.351
  428   2HE2  GLN  53          2HE2      GLN  53  -2.823   8.195   6.499
  429    H    MET  54           H        MET  54  -8.776   6.028   7.339
  430    HA   MET  54           HA       MET  54  -8.441   7.717   4.931
  431   1HB   MET  54          2HB       MET  54  -9.035   4.850   5.590
  432   2HB   MET  54          1HB       MET  54  -9.435   5.452   3.981
  433   1HG   MET  54          2HG       MET  54  -6.817   6.390   4.687
  434   2HG   MET  54          1HG       MET  54  -6.886   4.648   4.953
  435   1HE   MET  54          1HE       MET  54  -8.183   3.213   3.591
  436   2HE   MET  54          2HE       MET  54  -7.708   2.969   1.912
  437   3HE   MET  54          3HE       MET  54  -9.185   3.855   2.282
  438    H    GLU  55           H        GLU  55 -11.130   5.560   5.879
  439    HA   GLU  55           HA       GLU  55 -13.088   7.728   5.902
  440   1HB   GLU  55          2HB       GLU  55 -14.240   6.802   3.825
  441   2HB   GLU  55          1HB       GLU  55 -12.709   7.626   3.527
  442   1HG   GLU  55          2HG       GLU  55 -11.908   5.759   2.568
  443   2HG   GLU  55          1HG       GLU  55 -12.106   4.905   4.098
  444    H    ARG  56           H        ARG  56 -15.335   6.811   6.168
  445    HA   ARG  56           HA       ARG  56 -15.355   4.607   8.034
  446   1HB   ARG  56          2HB       ARG  56 -17.392   6.295   6.583
  447   2HB   ARG  56          1HB       ARG  56 -17.907   4.950   7.603
  448   1HG   ARG  56          2HG       ARG  56 -16.013   6.279   9.158
  449   2HG   ARG  56          1HG       ARG  56 -16.914   7.580   8.382
  450   1HD   ARG  56          2HD       ARG  56 -18.935   5.844   9.111
  451   2HD   ARG  56          1HD       ARG  56 -17.795   5.700  10.466
  452    HE   ARG  56           HE       ARG  56 -18.762   8.354   9.461
  453   1HH1  ARG  56          1HH1      ARG  56 -19.875   6.608  11.858
  454   2HH1  ARG  56          2HH1      ARG  56 -19.230   7.521  13.182
  455   1HH2  ARG  56          1HH2      ARG  56 -17.047   9.348  11.202
  456   2HH2  ARG  56          2HH2      ARG  56 -17.629   9.072  12.810
  Start of MODEL   16
    1   1H    ALA   2          1H        ALA   2  10.161 -25.616  -8.633
    2   2H    ALA   2          2H        ALA   2   8.750 -26.474  -9.040
    3   3H    ALA   2          3H        ALA   2  10.275 -27.200  -9.233
    4    HA   ALA   2           HA       ALA   2   8.852 -27.829  -7.179
    5   1HB   ALA   2          1HB       ALA   2  11.116 -27.905  -5.941
    6   2HB   ALA   2          2HB       ALA   2  11.775 -27.072  -7.350
    7   3HB   ALA   2          3HB       ALA   2  11.051 -28.671  -7.527
    8    H    LYS   3           H        LYS   3   8.164 -25.014  -7.523
    9    HA   LYS   3           HA       LYS   3   9.144 -23.671  -5.067
   10   1HB   LYS   3          2HB       LYS   3   7.890 -22.984  -7.637
   11   2HB   LYS   3          1HB       LYS   3   7.240 -22.069  -6.277
   12   1HG   LYS   3          2HG       LYS   3   9.356 -21.174  -5.716
   13   2HG   LYS   3          1HG       LYS   3  10.215 -22.384  -6.672
   14   1HD   LYS   3          2HD       LYS   3  10.289 -20.398  -7.979
   15   2HD   LYS   3          1HD       LYS   3   9.025 -21.385  -8.714
   16   1HE   LYS   3          2HE       LYS   3   7.287 -20.070  -7.763
   17   2HE   LYS   3          1HE       LYS   3   8.391 -19.316  -6.594
   18   1HZ   LYS   3          1HZ       LYS   3   9.551 -18.224  -8.338
   19   2HZ   LYS   3          2HZ       LYS   3   7.898 -17.923  -8.593
   20   3HZ   LYS   3          3HZ       LYS   3   8.709 -19.080  -9.536
   21    H    VAL   4           H        VAL   4   8.103 -24.740  -3.331
   22    HA   VAL   4           HA       VAL   4   5.162 -25.135  -3.447
   23    HB   VAL   4           HB       VAL   4   6.634 -26.926  -2.629
   24   1HG1  VAL   4          1HG1      VAL   4   7.508 -26.022  -0.134
   25   2HG1  VAL   4          2HG1      VAL   4   7.845 -24.674  -1.222
   26   3HG1  VAL   4          3HG1      VAL   4   8.515 -26.271  -1.562
   27   1HG2  VAL   4          1HG2      VAL   4   4.967 -25.571  -0.486
   28   2HG2  VAL   4          2HG2      VAL   4   5.605 -27.209  -0.344
   29   3HG2  VAL   4          3HG2      VAL   4   4.436 -26.825  -1.607
   30    H    GLN   5           H        GLN   5   4.993 -22.631  -3.476
   31    HA   GLN   5           HA       GLN   5   5.260 -21.511  -0.709
   32   1HB   GLN   5          2HB       GLN   5   4.987 -20.146  -3.408
   33   2HB   GLN   5          1HB       GLN   5   5.323 -19.347  -1.873
   34   1HG   GLN   5          2HG       GLN   5   7.210 -21.478  -2.225
   35   2HG   GLN   5          1HG       GLN   5   7.196 -20.490  -3.685
   36   1HE2  GLN   5          1HE2      GLN   5   6.670 -17.935  -2.644
   37   2HE2  GLN   5          2HE2      GLN   5   7.932 -17.470  -1.608
   38    H    ALA   6           H        ALA   6   3.492 -19.493  -0.709
   39    HA   ALA   6           HA       ALA   6   0.888 -20.288  -1.816
   40   1HB   ALA   6          1HB       ALA   6   1.644 -21.571   0.426
   41   2HB   ALA   6          2HB       ALA   6  -0.037 -21.132   0.119
   42   3HB   ALA   6          3HB       ALA   6   0.965 -20.118   1.158
   43    H    TYR   7           H        TYR   7   1.374 -18.043  -2.633
   44    HA   TYR   7           HA       TYR   7   1.119 -15.691  -2.527
   45   1HB   TYR   7          2HB       TYR   7  -1.018 -17.100  -1.231
   46   2HB   TYR   7          1HB       TYR   7  -0.738 -15.589  -0.363
   47    HD1  TYR   7           1HD      TYR   7  -0.290 -16.412  -3.985
   48    HD2  TYR   7           2HD      TYR   7  -2.429 -14.111  -1.057
   49    HE1  TYR   7           1HE      TYR   7  -1.424 -15.157  -5.800
   50    HE2  TYR   7           2HE      TYR   7  -3.562 -12.855  -2.870
   51    HH   TYR   7           HH       TYR   7  -2.770 -13.454  -6.291
   52    H    VAL   8           H        VAL   8   3.433 -16.083  -1.356
   53    HA   VAL   8           HA       VAL   8   3.288 -14.941   1.411
   54    HB   VAL   8           HB       VAL   8   5.489 -16.435  -0.053
   55   1HG1  VAL   8          1HG1      VAL   8   5.215 -15.304   2.728
   56   2HG1  VAL   8          2HG1      VAL   8   6.565 -15.150   1.603
   57   3HG1  VAL   8          3HG1      VAL   8   6.267 -16.685   2.419
   58   1HG2  VAL   8          1HG2      VAL   8   4.794 -18.380   1.075
   59   2HG2  VAL   8          2HG2      VAL   8   3.266 -17.633   0.610
   60   3HG2  VAL   8          3HG2      VAL   8   3.860 -17.470   2.262
   61    H    SER   9           H        SER   9   3.849 -14.041  -1.771
   62    HA   SER   9           HA       SER   9   6.135 -12.281  -1.433
   63   1HB   SER   9          2HB       SER   9   5.532 -11.585  -3.676
   64   2HB   SER   9          1HB       SER   9   5.257 -13.322  -3.562
   65    HG   SER   9           HG       SER   9   3.421 -12.507  -4.430
   66    H    ASP  10           H        ASP  10   6.106 -10.020  -1.081
   67    HA   ASP  10           HA       ASP  10   4.114  -8.918   0.610
   68   1HB   ASP  10          2HB       ASP  10   6.186  -7.658  -1.213
   69   2HB   ASP  10          1HB       ASP  10   5.319  -6.781   0.048
   70    H    GLU  11           H        GLU  11   2.138  -9.540  -0.697
   71    HA   GLU  11           HA       GLU  11   1.513  -8.465  -3.253
   72   1HB   GLU  11          2HB       GLU  11   0.328 -10.011  -1.235
   73   2HB   GLU  11          1HB       GLU  11  -0.746  -8.624  -1.418
   74   1HG   GLU  11          2HG       GLU  11  -1.573 -10.087  -3.043
   75   2HG   GLU  11          1HG       GLU  11  -0.469  -9.086  -3.985
   76    H    ILE  12           H        ILE  12   1.479  -6.994  -0.059
   77    HA   ILE  12           HA       ILE  12  -0.250  -4.793  -0.501
   78    HB   ILE  12           HB       ILE  12   1.344  -3.721   1.232
   79   1HG1  ILE  12          2HG1      ILE  12   2.505  -6.396   1.708
   80   2HG1  ILE  12          1HG1      ILE  12   3.117  -5.578   0.271
   81   1HG2  ILE  12          1HG2      ILE  12  -0.646  -5.657   1.425
   82   2HG2  ILE  12          2HG2      ILE  12   0.019  -4.720   2.764
   83   3HG2  ILE  12          3HG2      ILE  12   0.672  -6.316   2.393
   84   1HD1  ILE  12          1HD1      ILE  12   2.884  -3.825   2.622
   85   2HD1  ILE  12          2HD1      ILE  12   4.224  -4.015   1.490
   86   3HD1  ILE  12          3HD1      ILE  12   4.034  -5.146   2.830
   87    H    VAL  13           H        VAL  13   3.082  -5.319  -1.558
   88    HA   VAL  13           HA       VAL  13   3.991  -2.771  -2.183
   89    HB   VAL  13           HB       VAL  13   4.092  -5.259  -3.922
   90   1HG1  VAL  13          1HG1      VAL  13   4.893  -3.129  -4.982
   91   2HG1  VAL  13          2HG1      VAL  13   6.168  -4.330  -4.778
   92   3HG1  VAL  13          3HG1      VAL  13   6.058  -2.964  -3.669
   93   1HG2  VAL  13          1HG2      VAL  13   4.943  -4.913  -1.275
   94   2HG2  VAL  13          2HG2      VAL  13   6.403  -4.697  -2.239
   95   3HG2  VAL  13          3HG2      VAL  13   5.464  -6.183  -2.382
   96    H    TYR  14           H        TYR  14   1.340  -4.513  -3.658
   97    HA   TYR  14           HA       TYR  14   1.148  -2.931  -6.077
   98   1HB   TYR  14          2HB       TYR  14  -0.046  -5.196  -4.848
   99   2HB   TYR  14          1HB       TYR  14  -1.351  -4.060  -5.194
  100    HD1  TYR  14           1HD      TYR  14   1.870  -4.819  -6.964
  101    HD2  TYR  14           2HD      TYR  14  -2.419  -4.704  -7.168
  102    HE1  TYR  14           1HE      TYR  14   1.968  -5.437  -9.364
  103    HE2  TYR  14           2HE      TYR  14  -2.321  -5.322  -9.568
  104    HH   TYR  14           HH       TYR  14   0.601  -5.271 -11.360
  105    H    LYS  15           H        LYS  15  -0.834  -2.944  -3.079
  106    HA   LYS  15           HA       LYS  15  -2.246  -0.517  -3.811
  107   1HB   LYS  15          2HB       LYS  15  -3.334  -0.857  -1.718
  108   2HB   LYS  15          1HB       LYS  15  -2.956  -2.476  -2.307
  109   1HG   LYS  15          2HG       LYS  15  -0.946  -2.543  -0.903
  110   2HG   LYS  15          1HG       LYS  15  -1.262  -0.900  -0.346
  111   1HD   LYS  15          2HD       LYS  15  -3.392  -2.993  -0.033
  112   2HD   LYS  15          1HD       LYS  15  -2.053  -2.942   1.113
  113   1HE   LYS  15          2HE       LYS  15  -2.778  -0.986   2.068
  114   2HE   LYS  15          1HE       LYS  15  -3.329  -0.323   0.515
  115   1HZ   LYS  15          1HZ       LYS  15  -5.039  -1.210   2.294
  116   2HZ   LYS  15          2HZ       LYS  15  -4.688  -2.697   1.552
  117   3HZ   LYS  15          3HZ       LYS  15  -5.309  -1.411   0.633
  118    H    ILE  16           H        ILE  16   0.481  -1.230  -1.609
  119    HA   ILE  16           HA       ILE  16   0.686   1.438  -0.537
  120    HB   ILE  16           HB       ILE  16   2.872  -0.633  -0.884
  121   1HG1  ILE  16          2HG1      ILE  16   0.604  -0.462   1.116
  122   2HG1  ILE  16          1HG1      ILE  16   1.015  -1.819   0.071
  123   1HG2  ILE  16          1HG2      ILE  16   3.647   1.514  -0.035
  124   2HG2  ILE  16          2HG2      ILE  16   3.629   0.355   1.294
  125   3HG2  ILE  16          3HG2      ILE  16   2.342   1.553   1.151
  126   1HD1  ILE  16          1HD1      ILE  16   1.775  -2.204   2.397
  127   2HD1  ILE  16          2HD1      ILE  16   2.764  -0.747   2.303
  128   3HD1  ILE  16          3HD1      ILE  16   3.133  -2.131   1.274
  129    H    ASN  17           H        ASN  17   1.417   0.168  -3.622
  130    HA   ASN  17           HA       ASN  17   3.717   1.746  -4.330
  131   1HB   ASN  17          2HB       ASN  17   1.831  -0.098  -5.499
  132   2HB   ASN  17          1HB       ASN  17   2.068   1.266  -6.593
  133   1HD2  ASN  17          1HD2      ASN  17   4.729   1.926  -6.258
  134   2HD2  ASN  17          2HD2      ASN  17   5.727   0.608  -6.644
  135    H    LYS  18           H        LYS  18   0.211   2.277  -4.808
  136    HA   LYS  18           HA       LYS  18   0.563   4.878  -6.053
  137   1HB   LYS  18          2HB       LYS  18  -1.898   4.929  -5.816
  138   2HB   LYS  18          1HB       LYS  18  -1.358   3.363  -6.416
  139   1HG   LYS  18          2HG       LYS  18  -1.323   3.299  -3.551
  140   2HG   LYS  18          1HG       LYS  18  -2.896   3.893  -4.084
  141   1HD   LYS  18          2HD       LYS  18  -1.542   1.340  -5.005
  142   2HD   LYS  18          1HD       LYS  18  -2.948   1.451  -3.947
  143   1HE   LYS  18          2HE       LYS  18  -4.179   2.627  -5.809
  144   2HE   LYS  18          1HE       LYS  18  -2.797   2.275  -6.866
  145   1HZ   LYS  18          1HZ       LYS  18  -3.008  -0.081  -6.212
  146   2HZ   LYS  18          2HZ       LYS  18  -4.371   0.490  -7.050
  147   3HZ   LYS  18          3HZ       LYS  18  -4.427   0.298  -5.363
  148    H    ILE  19           H        ILE  19   0.316   3.722  -2.766
  149    HA   ILE  19           HA       ILE  19  -0.597   6.077  -1.445
  150    HB   ILE  19           HB       ILE  19   1.356   3.906  -0.610
  151   1HG1  ILE  19          2HG1      ILE  19  -0.972   3.231  -1.383
  152   2HG1  ILE  19          1HG1      ILE  19  -0.571   2.771   0.273
  153   1HG2  ILE  19          1HG2      ILE  19  -0.042   6.106   0.895
  154   2HG2  ILE  19          2HG2      ILE  19   1.635   5.575   1.017
  155   3HG2  ILE  19          3HG2      ILE  19   0.345   4.586   1.703
  156   1HD1  ILE  19          1HD1      ILE  19  -2.851   3.803   0.041
  157   2HD1  ILE  19          2HD1      ILE  19  -2.070   5.300  -0.466
  158   3HD1  ILE  19          3HD1      ILE  19  -1.795   4.667   1.158
  159    H    VAL  20           H        VAL  20   2.739   4.994  -2.180
  160    HA   VAL  20           HA       VAL  20   4.112   7.225  -1.063
  161    HB   VAL  20           HB       VAL  20   4.653   5.259  -3.293
  162   1HG1  VAL  20          1HG1      VAL  20   6.013   7.759  -2.770
  163   2HG1  VAL  20          2HG1      VAL  20   6.329   6.571  -4.034
  164   3HG1  VAL  20          3HG1      VAL  20   7.091   6.399  -2.454
  165   1HG2  VAL  20          1HG2      VAL  20   4.571   4.561  -0.859
  166   2HG2  VAL  20          2HG2      VAL  20   5.958   5.613  -0.585
  167   3HG2  VAL  20          3HG2      VAL  20   6.101   4.230  -1.672
  168    H    GLU  21           H        GLU  21   3.833   6.667  -4.572
  169    HA   GLU  21           HA       GLU  21   4.413   9.173  -5.551
  170   1HB   GLU  21          2HB       GLU  21   2.466   7.026  -6.334
  171   2HB   GLU  21          1HB       GLU  21   2.518   8.516  -7.276
  172   1HG   GLU  21          2HG       GLU  21   5.206   7.811  -6.897
  173   2HG   GLU  21          1HG       GLU  21   4.386   6.294  -7.267
  174    H    ARG  22           H        ARG  22   1.213   8.141  -4.334
  175    HA   ARG  22           HA       ARG  22  -0.287  10.457  -4.865
  176   1HB   ARG  22          2HB       ARG  22  -1.225   8.399  -3.969
  177   2HB   ARG  22          1HB       ARG  22  -0.275   8.566  -2.491
  178   1HG   ARG  22          2HG       ARG  22  -1.468  10.692  -1.995
  179   2HG   ARG  22          1HG       ARG  22  -2.460  10.447  -3.432
  180   1HD   ARG  22          2HD       ARG  22  -2.872   8.059  -2.277
  181   2HD   ARG  22          1HD       ARG  22  -2.539   9.009  -0.816
  182    HE   ARG  22           HE       ARG  22  -4.265  10.593  -2.351
  183   1HH1  ARG  22          1HH2      ARG  22  -5.096   9.794   0.339
  184   2HH1  ARG  22          2HH2      ARG  22  -6.436   8.735   0.049
  185   1HH2  ARG  22          1HH1      ARG  22  -5.647   8.218  -3.288
  186   2HH2  ARG  22          2HH1      ARG  22  -6.748   7.845  -2.005
  187    H    ARG  23           H        ARG  23   1.761   9.773  -2.006
  188    HA   ARG  23           HA       ARG  23   1.351  12.014  -0.436
  189   1HB   ARG  23          2HB       ARG  23   3.895  10.578  -1.243
  190   2HB   ARG  23          1HB       ARG  23   3.843  11.765   0.060
  191   1HG   ARG  23          2HG       ARG  23   1.672  10.044   0.542
  192   2HG   ARG  23          1HG       ARG  23   3.013   8.989   0.095
  193   1HD   ARG  23          2HD       ARG  23   4.308   9.635   1.920
  194   2HD   ARG  23          1HD       ARG  23   3.523  11.223   2.041
  195    HE   ARG  23           HE       ARG  23   1.986   8.731   2.649
  196   1HH1  ARG  23          1HH2      ARG  23   1.456  11.908   2.803
  197   2HH1  ARG  23          2HH2      ARG  23   1.286  12.044   4.522
  198   1HH2  ARG  23          1HH1      ARG  23   2.520   8.866   5.159
  199   2HH2  ARG  23          2HH1      ARG  23   1.886  10.320   5.856
  200    H    ARG  24           H        ARG  24   3.723  11.863  -3.132
  201    HA   ARG  24           HA       ARG  24   4.341  14.671  -3.084
  202   1HB   ARG  24          2HB       ARG  24   5.542  12.605  -4.133
  203   2HB   ARG  24          1HB       ARG  24   4.474  12.879  -5.510
  204   1HG   ARG  24          2HG       ARG  24   5.428  15.419  -4.944
  205   2HG   ARG  24          1HG       ARG  24   6.833  14.392  -4.657
  206   1HD   ARG  24          2HD       ARG  24   5.135  14.265  -7.175
  207   2HD   ARG  24          1HD       ARG  24   6.668  15.148  -7.047
  208    HE   ARG  24           HE       ARG  24   6.525  12.230  -6.403
  209   1HH1  ARG  24          1HH2      ARG  24   9.075  13.858  -6.145
  210   2HH1  ARG  24          2HH2      ARG  24   9.881  13.467  -7.628
  211   1HH2  ARG  24          1HH1      ARG  24   7.037  12.185  -9.143
  212   2HH2  ARG  24          2HH1      ARG  24   8.726  12.520  -9.325
  213    H    ALA  25           H        ALA  25   2.266  12.784  -5.335
  214    HA   ALA  25           HA       ALA  25   1.252  14.841  -6.915
  215   1HB   ALA  25          1HB       ALA  25   0.779  12.266  -6.768
  216   2HB   ALA  25          2HB       ALA  25  -0.496  13.323  -7.372
  217   3HB   ALA  25          3HB       ALA  25  -0.547  12.743  -5.708
  218    H    GLU  26           H        GLU  26   0.611  14.144  -3.543
  219    HA   GLU  26           HA       GLU  26  -1.629  16.020  -3.352
  220   1HB   GLU  26          2HB       GLU  26  -0.041  14.354  -1.384
  221   2HB   GLU  26          1HB       GLU  26  -1.427  15.344  -0.922
  222   1HG   GLU  26          2HG       GLU  26  -1.919  13.591  -3.239
  223   2HG   GLU  26          1HG       GLU  26  -1.593  12.729  -1.736
  224    H    GLY  27           H        GLY  27   1.836  16.072  -2.975
  225   1HA   GLY  27          2HA       GLY  27   2.508  18.623  -3.051
  226   2HA   GLY  27          1HA       GLY  27   1.704  18.643  -1.482
  227    H    ALA  28           H        ALA  28   2.669  15.839  -0.931
  228    HA   ALA  28           HA       ALA  28   4.874  16.306   0.685
  229   1HB   ALA  28          1HB       ALA  28   3.381  14.175   0.022
  230   2HB   ALA  28          2HB       ALA  28   4.936  13.998   0.836
  231   3HB   ALA  28          3HB       ALA  28   4.825  13.782  -0.912
  232    H    LYS  29           H        LYS  29   7.140  16.341   0.376
  233    HA   LYS  29           HA       LYS  29   8.162  16.072  -2.417
  234   1HB   LYS  29          2HB       LYS  29   9.408  18.250  -1.975
  235   2HB   LYS  29          1HB       LYS  29   7.663  18.411  -2.161
  236   1HG   LYS  29          2HG       LYS  29   8.436  17.853   0.601
  237   2HG   LYS  29          1HG       LYS  29   9.155  19.344  -0.010
  238   1HD   LYS  29          2HD       LYS  29   6.876  20.040  -0.810
  239   2HD   LYS  29          1HD       LYS  29   6.212  18.621   0.002
  240   1HE   LYS  29          2HE       LYS  29   7.714  20.913   1.317
  241   2HE   LYS  29          1HE       LYS  29   6.000  20.505   1.526
  242   1HZ   LYS  29          1HZ       LYS  29   6.996  19.418   3.296
  243   2HZ   LYS  29          2HZ       LYS  29   8.380  18.997   2.406
  244   3HZ   LYS  29          3HZ       LYS  29   6.909  18.191   2.128
  245    H    SER  30           H        SER  30  10.764  16.979  -1.855
  246    HA   SER  30           HA       SER  30  12.806  16.224  -0.944
  247   1HB   SER  30          2HB       SER  30  12.796  16.244   1.373
  248   2HB   SER  30          1HB       SER  30  11.230  16.993   1.076
  249    HG   SER  30           HG       SER  30  10.889  15.331   2.493
  250    H    THR  31           H        THR  31  13.883  14.173  -0.124
  251    HA   THR  31           HA       THR  31  12.707  11.843  -1.491
  252    HB   THR  31           HB       THR  31  15.087  11.140  -0.176
  253    HG1  THR  31           1HG      THR  31  15.727  13.099   0.378
  254   1HG2  THR  31          1HG2      THR  31  16.060  11.608  -2.508
  255   2HG2  THR  31          2HG2      THR  31  14.438  12.147  -2.945
  256   3HG2  THR  31          3HG2      THR  31  14.703  10.483  -2.421
  257    H    ASP  32           H        ASP  32  11.274  12.728   0.882
  258    HA   ASP  32           HA       ASP  32  11.982  10.761   2.988
  259   1HB   ASP  32          2HB       ASP  32  11.410  13.142   3.484
  260   2HB   ASP  32          1HB       ASP  32   9.802  12.868   2.809
  261    H    VAL  33           H        VAL  33   9.819  11.136   0.310
  262    HA   VAL  33           HA       VAL  33   7.887   9.140   1.352
  263    HB   VAL  33           HB       VAL  33   8.110  10.935  -1.066
  264   1HG1  VAL  33          1HG1      VAL  33   5.576   9.703  -1.076
  265   2HG1  VAL  33          2HG1      VAL  33   6.737   8.390  -0.880
  266   3HG1  VAL  33          3HG1      VAL  33   6.865   9.483  -2.258
  267   1HG2  VAL  33          1HG2      VAL  33   5.611  11.117   0.217
  268   2HG2  VAL  33          2HG2      VAL  33   6.940  12.273   0.323
  269   3HG2  VAL  33          3HG2      VAL  33   6.794  10.984   1.519
  270    H    SER  34           H        SER  34   7.772   7.040   0.575
  271    HA   SER  34           HA       SER  34   8.830   6.041  -1.861
  272   1HB   SER  34          2HB       SER  34  11.002   6.684  -1.101
  273   2HB   SER  34          1HB       SER  34  10.688   6.092   0.527
  274    HG   SER  34           HG       SER  34  11.003   4.584  -1.857
  275    H    PHE  35           H        PHE  35   8.432   3.762  -2.016
  276    HA   PHE  35           HA       PHE  35   6.432   2.591  -0.500
  277   1HB   PHE  35          2HB       PHE  35   7.436   1.730  -2.614
  278   2HB   PHE  35          1HB       PHE  35   8.855   1.211  -1.703
  279    HD1  PHE  35           1HD      PHE  35   8.595  -1.160  -2.183
  280    HD2  PHE  35           2HD      PHE  35   5.432   1.071  -0.322
  281    HE1  PHE  35           1HE      PHE  35   7.445  -3.279  -1.592
  282    HE2  PHE  35           2HE      PHE  35   4.286  -1.045   0.268
  283    HZ   PHE  35           HZ       PHE  35   5.286  -3.218  -0.367
  284    H    SER  36           H        SER  36   9.933   1.966   0.007
  285    HA   SER  36           HA       SER  36   9.799   0.434   2.340
  286   1HB   SER  36          2HB       SER  36  11.691   2.215   0.977
  287   2HB   SER  36          1HB       SER  36  11.973   2.123   2.712
  288    HG   SER  36           HG       SER  36  13.062   0.466   1.564
  289    H    SER  37           H        SER  37   9.479   3.947   1.982
  290    HA   SER  37           HA       SER  37   9.402   4.447   4.866
  291   1HB   SER  37          2HB       SER  37   8.508   6.213   2.573
  292   2HB   SER  37          1HB       SER  37   9.079   6.725   4.158
  293    HG   SER  37           HG       SER  37  11.033   6.599   3.419
  294    H    ILE  38           H        ILE  38   6.992   4.563   2.210
  295    HA   ILE  38           HA       ILE  38   4.722   5.078   3.881
  296    HB   ILE  38           HB       ILE  38   5.170   3.866   1.148
  297   1HG1  ILE  38          2HG1      ILE  38   5.618   6.283   1.465
  298   2HG1  ILE  38          1HG1      ILE  38   4.224   6.023   0.414
  299   1HG2  ILE  38          1HG2      ILE  38   3.084   2.937   2.194
  300   2HG2  ILE  38          2HG2      ILE  38   2.774   3.931   0.771
  301   3HG2  ILE  38          3HG2      ILE  38   2.497   4.589   2.384
  302   1HD1  ILE  38          1HD1      ILE  38   3.152   7.455   1.810
  303   2HD1  ILE  38          2HD1      ILE  38   4.354   7.253   3.085
  304   3HD1  ILE  38          3HD1      ILE  38   3.055   6.073   2.902
  305    H    SER  39           H        SER  39   6.375   2.102   2.944
  306    HA   SER  39           HA       SER  39   4.303   0.298   3.903
  307   1HB   SER  39          2HB       SER  39   5.782  -1.319   3.138
  308   2HB   SER  39          1HB       SER  39   6.392   0.075   2.250
  309    HG   SER  39           HG       SER  39   7.726  -1.419   3.899
  310    H    THR  40           H        THR  40   7.453   1.390   5.206
  311    HA   THR  40           HA       THR  40   7.538  -0.029   7.614
  312    HB   THR  40           HB       THR  40   8.299   2.836   6.966
  313    HG1  THR  40           1HG      THR  40  10.149   1.969   6.298
  314   1HG2  THR  40          1HG2      THR  40   8.671   1.157   9.394
  315   2HG2  THR  40          2HG2      THR  40   8.540   2.909   9.246
  316   3HG2  THR  40          3HG2      THR  40  10.060   2.102   8.859
  317    H    MET  41           H        MET  41   6.091   3.229   7.166
  318    HA   MET  41           HA       MET  41   4.994   3.460   9.783
  319   1HB   MET  41          2HB       MET  41   3.569   5.187   8.674
  320   2HB   MET  41          1HB       MET  41   5.265   5.314   8.207
  321   1HG   MET  41          2HG       MET  41   4.238   5.425   6.126
  322   2HG   MET  41          1HG       MET  41   4.527   3.690   6.258
  323   1HE   MET  41          1HE       MET  41   1.791   4.323   4.195
  324   2HE   MET  41          2HE       MET  41   2.800   5.663   4.731
  325   3HE   MET  41          3HE       MET  41   1.068   5.695   5.045
  326    H    LEU  42           H        LEU  42   3.790   1.838   6.890
  327    HA   LEU  42           HA       LEU  42   1.064   1.492   7.758
  328   1HB   LEU  42          2HB       LEU  42   2.860   0.693   5.613
  329   2HB   LEU  42          1HB       LEU  42   1.777  -0.625   6.063
  330    HG   LEU  42           HG       LEU  42   0.765   2.184   5.598
  331   1HD1  LEU  42          1HD1      LEU  42   0.843   1.919   3.356
  332   2HD1  LEU  42          2HD1      LEU  42   0.231   0.268   3.463
  333   3HD1  LEU  42          3HD1      LEU  42   1.957   0.583   3.646
  334   1HD2  LEU  42          1HD2      LEU  42  -0.369  -0.250   6.534
  335   2HD2  LEU  42          2HD2      LEU  42  -1.012   0.023   4.915
  336   3HD2  LEU  42          3HD2      LEU  42  -1.211   1.255   6.161
  337    H    LEU  43           H        LEU  43   3.856  -0.768   7.802
  338    HA   LEU  43           HA       LEU  43   2.445  -2.847   9.208
  339   1HB   LEU  43          2HB       LEU  43   4.477  -3.095   7.776
  340   2HB   LEU  43          1HB       LEU  43   5.416  -2.276   9.027
  341    HG   LEU  43           HG       LEU  43   4.012  -4.236  10.421
  342   1HD1  LEU  43          1HD1      LEU  43   4.907  -6.275   9.003
  343   2HD1  LEU  43          2HD1      LEU  43   4.753  -5.147   7.656
  344   3HD1  LEU  43          3HD1      LEU  43   3.339  -5.561   8.624
  345   1HD2  LEU  43          1HD2      LEU  43   6.272  -5.319  10.568
  346   2HD2  LEU  43          2HD2      LEU  43   6.323  -3.580  10.853
  347   3HD2  LEU  43          3HD2      LEU  43   6.834  -4.233   9.297
  348    H    GLU  44           H        GLU  44   4.758  -0.347  10.345
  349    HA   GLU  44           HA       GLU  44   4.938  -1.127  13.050
  350   1HB   GLU  44          2HB       GLU  44   5.564   1.202  13.420
  351   2HB   GLU  44          1HB       GLU  44   6.190   0.706  11.849
  352   1HG   GLU  44          2HG       GLU  44   4.534   1.896  10.676
  353   2HG   GLU  44          1HG       GLU  44   3.483   2.011  12.087
  354    H    LEU  45           H        LEU  45   2.330   0.276  11.258
  355    HA   LEU  45           HA       LEU  45   0.758   0.824  13.727
  356   1HB   LEU  45          2HB       LEU  45   0.382   2.643  12.400
  357   2HB   LEU  45          1HB       LEU  45   0.956   1.811  10.960
  358    HG   LEU  45           HG       LEU  45  -1.224   0.619  10.818
  359   1HD1  LEU  45          1HD1      LEU  45  -2.421   2.566  12.739
  360   2HD1  LEU  45          2HD1      LEU  45  -1.546   1.199  13.421
  361   3HD1  LEU  45          3HD1      LEU  45  -2.922   0.921  12.353
  362   1HD2  LEU  45          1HD2      LEU  45  -2.328   3.273  10.839
  363   2HD2  LEU  45          2HD2      LEU  45  -1.816   2.312   9.451
  364   3HD2  LEU  45          3HD2      LEU  45  -0.658   3.359  10.275
  365    H    GLY  46           H        GLY  46   1.130  -1.475  11.148
  366   1HA   GLY  46          2HA       GLY  46   0.100  -3.607  11.000
  367   2HA   GLY  46          1HA       GLY  46  -0.995  -3.138  12.301
  368    H    LEU  47           H        LEU  47  -0.724  -0.860   9.733
  369    HA   LEU  47           HA       LEU  47  -2.327  -0.158   8.138
  370   1HB   LEU  47          2HB       LEU  47  -1.529  -2.130   7.011
  371   2HB   LEU  47          1HB       LEU  47  -2.463  -3.185   8.071
  372    HG   LEU  47           HG       LEU  47  -4.524  -2.533   7.085
  373   1HD1  LEU  47          1HD1      LEU  47  -3.019  -0.366   5.588
  374   2HD1  LEU  47          2HD1      LEU  47  -3.974  -0.087   7.045
  375   3HD1  LEU  47          3HD1      LEU  47  -4.761  -0.645   5.570
  376   1HD2  LEU  47          1HD2      LEU  47  -2.683  -3.823   5.635
  377   2HD2  LEU  47          2HD2      LEU  47  -2.855  -2.397   4.612
  378   3HD2  LEU  47          3HD2      LEU  47  -4.259  -3.404   4.964
  379    H    ARG  48           H        ARG  48  -3.165  -0.909  11.075
  380    HA   ARG  48           HA       ARG  48  -5.937  -1.750  10.879
  381   1HB   ARG  48          2HB       ARG  48  -4.656  -2.188  12.864
  382   2HB   ARG  48          1HB       ARG  48  -4.213  -0.488  13.024
  383   1HG   ARG  48          2HG       ARG  48  -6.143   0.017  14.086
  384   2HG   ARG  48          1HG       ARG  48  -7.109  -0.882  12.916
  385   1HD   ARG  48          2HD       ARG  48  -5.533  -2.145  15.190
  386   2HD   ARG  48          1HD       ARG  48  -7.291  -1.892  15.180
  387    HE   ARG  48           HE       ARG  48  -7.042  -3.227  12.873
  388   1HH1  ARG  48          1HH2      ARG  48  -4.279  -3.794  14.433
  389   2HH1  ARG  48          2HH2      ARG  48  -4.569  -5.451  14.842
  390   1HH2  ARG  48          1HH1      ARG  48  -7.936  -5.340  14.026
  391   2HH2  ARG  48          2HH1      ARG  48  -6.639  -6.327  14.613
  392    H    VAL  49           H        VAL  49  -5.278   1.136  12.727
  393    HA   VAL  49           HA       VAL  49  -7.528   2.596  12.141
  394    HB   VAL  49           HB       VAL  49  -6.225   4.542  12.781
  395   1HG1  VAL  49          1HG1      VAL  49  -4.670   2.436  14.191
  396   2HG1  VAL  49          2HG1      VAL  49  -6.427   2.313  14.285
  397   3HG1  VAL  49          3HG1      VAL  49  -5.613   3.771  14.852
  398   1HG2  VAL  49          1HG2      VAL  49  -3.951   2.872  11.729
  399   2HG2  VAL  49          2HG2      VAL  49  -3.648   4.144  12.913
  400   3HG2  VAL  49          3HG2      VAL  49  -4.359   4.544  11.348
  401    H    TYR  50           H        TYR  50  -4.651   2.322  10.087
  402    HA   TYR  50           HA       TYR  50  -5.157   4.354   8.201
  403   1HB   TYR  50          2HB       TYR  50  -3.124   3.017   8.276
  404   2HB   TYR  50          1HB       TYR  50  -4.033   1.552   7.904
  405    HD1  TYR  50           1HD      TYR  50  -2.305   4.400   6.548
  406    HD2  TYR  50           2HD      TYR  50  -5.295   1.444   5.673
  407    HE1  TYR  50           1HE      TYR  50  -2.043   4.855   4.124
  408    HE2  TYR  50           2HE      TYR  50  -5.034   1.899   3.250
  409    HH   TYR  50           HH       TYR  50  -3.882   4.449   1.972
  410    H    GLU  51           H        GLU  51  -6.127   0.900   7.872
  411    HA   GLU  51           HA       GLU  51  -7.792   1.292   5.600
  412   1HB   GLU  51          2HB       GLU  51  -6.745  -0.765   7.036
  413   2HB   GLU  51          1HB       GLU  51  -8.425  -0.836   7.556
  414   1HG   GLU  51          2HG       GLU  51  -8.276  -0.404   4.704
  415   2HG   GLU  51          1HG       GLU  51  -7.349  -1.834   5.155
  416    H    ALA  52           H        ALA  52  -8.368   1.696   9.046
  417    HA   ALA  52           HA       ALA  52 -11.264   1.672   8.923
  418   1HB   ALA  52          1HB       ALA  52  -9.203   1.768  10.834
  419   2HB   ALA  52          2HB       ALA  52 -10.935   1.724  11.162
  420   3HB   ALA  52          3HB       ALA  52 -10.097   3.273  11.051
  421    H    GLN  53           H        GLN  53  -8.886   4.345   9.179
  422    HA   GLN  53           HA       GLN  53 -10.967   6.160   8.068
  423   1HB   GLN  53          2HB       GLN  53  -9.618   7.898   9.404
  424   2HB   GLN  53          1HB       GLN  53 -10.553   6.735  10.345
  425   1HG   GLN  53          2HG       GLN  53  -8.674   5.576  11.042
  426   2HG   GLN  53          1HG       GLN  53  -7.741   6.023   9.615
  427   1HE2  GLN  53          1HE2      GLN  53  -6.674   8.120   9.608
  428   2HE2  GLN  53          2HE2      GLN  53  -6.520   9.045  11.023
  429    H    MET  54           H        MET  54  -9.394   4.793   6.247
  430    HA   MET  54           HA       MET  54  -6.903   6.065   5.579
  431   1HB   MET  54          2HB       MET  54  -7.214   4.839   3.471
  432   2HB   MET  54          1HB       MET  54  -7.700   3.822   4.830
  433   1HG   MET  54          2HG       MET  54 -10.044   4.346   4.447
  434   2HG   MET  54          1HG       MET  54  -9.615   5.495   3.180
  435   1HE   MET  54          1HE       MET  54  -9.635   5.010   0.868
  436   2HE   MET  54          2HE       MET  54 -11.180   4.413   1.467
  437   3HE   MET  54          3HE       MET  54 -10.292   3.485   0.261
  438    H    GLU  55           H        GLU  55 -10.260   6.859   4.912
  439    HA   GLU  55           HA       GLU  55 -11.222   8.614   3.642
  440   1HB   GLU  55          2HB       GLU  55  -8.759   9.675   5.018
  441   2HB   GLU  55          1HB       GLU  55  -9.770  10.748   4.051
  442   1HG   GLU  55          2HG       GLU  55 -11.753   9.913   5.405
  443   2HG   GLU  55          1HG       GLU  55 -10.588   9.140   6.481
  444    H    ARG  56           H        ARG  56 -10.247  10.602   2.083
  445    HA   ARG  56           HA       ARG  56  -8.034   9.826   0.373
  446   1HB   ARG  56          2HB       ARG  56  -9.593   9.308  -1.591
  447   2HB   ARG  56          1HB       ARG  56  -9.531   8.085  -0.322
  448   1HG   ARG  56          2HG       ARG  56 -11.561   9.113   0.710
  449   2HG   ARG  56          1HG       ARG  56 -11.653  10.224  -0.657
  450   1HD   ARG  56          2HD       ARG  56 -11.472   7.291  -1.251
  451   2HD   ARG  56          1HD       ARG  56 -13.026   7.946  -0.696
  452    HE   ARG  56           HE       ARG  56 -13.129   9.297  -2.668
  453   1HH1  ARG  56          1HH1      ARG  56 -10.966   6.791  -3.003
  454   2HH1  ARG  56          2HH1      ARG  56 -10.055   7.497  -4.298
  455   1HH2  ARG  56          1HH2      ARG  56 -11.597  10.593  -4.045
  456   2HH2  ARG  56          2HH2      ARG  56 -10.413   9.651  -4.887
  Start of MODEL   17
    1   1H    ALA   2          1H        ALA   2   3.531 -17.816 -17.842
    2   2H    ALA   2          2H        ALA   2   3.741 -19.201 -16.880
    3   3H    ALA   2          3H        ALA   2   5.067 -18.199 -17.237
    4    HA   ALA   2           HA       ALA   2   4.336 -16.496 -15.824
    5   1HB   ALA   2          1HB       ALA   2   1.768 -17.570 -15.048
    6   2HB   ALA   2          2HB       ALA   2   1.866 -17.477 -16.806
    7   3HB   ALA   2          3HB       ALA   2   2.124 -16.031 -15.831
    8    H    LYS   3           H        LYS   3   2.607 -19.500 -14.909
    9    HA   LYS   3           HA       LYS   3   2.882 -20.894 -13.019
   10   1HB   LYS   3          2HB       LYS   3   5.743 -19.913 -13.190
   11   2HB   LYS   3          1HB       LYS   3   5.177 -21.479 -12.607
   12   1HG   LYS   3          2HG       LYS   3   4.199 -21.811 -14.963
   13   2HG   LYS   3          1HG       LYS   3   5.206 -20.444 -15.442
   14   1HD   LYS   3          2HD       LYS   3   6.444 -22.699 -13.897
   15   2HD   LYS   3          1HD       LYS   3   6.155 -22.897 -15.626
   16   1HE   LYS   3          2HE       LYS   3   7.295 -20.467 -15.706
   17   2HE   LYS   3          1HE       LYS   3   8.064 -21.076 -14.227
   18   1HZ   LYS   3          1HZ       LYS   3   9.425 -22.038 -15.756
   19   2HZ   LYS   3          2HZ       LYS   3   8.231 -22.100 -16.963
   20   3HZ   LYS   3          3HZ       LYS   3   8.228 -23.239 -15.701
   21    H    VAL   4           H        VAL   4   4.026 -20.777 -10.672
   22    HA   VAL   4           HA       VAL   4   4.074 -19.652  -8.594
   23    HB   VAL   4           HB       VAL   4   4.599 -17.220 -10.318
   24   1HG1  VAL   4          1HG1      VAL   4   4.711 -16.413  -8.178
   25   2HG1  VAL   4          2HG1      VAL   4   6.328 -17.116  -8.237
   26   3HG1  VAL   4          3HG1      VAL   4   5.005 -18.007  -7.483
   27   1HG2  VAL   4          1HG2      VAL   4   7.063 -18.291  -9.669
   28   2HG2  VAL   4          2HG2      VAL   4   6.280 -18.435 -11.242
   29   3HG2  VAL   4          3HG2      VAL   4   6.113 -19.726 -10.053
   30    H    GLN   5           H        GLN   5   1.600 -20.061  -8.786
   31    HA   GLN   5           HA       GLN   5  -0.608 -19.259  -8.505
   32   1HB   GLN   5          2HB       GLN   5   0.947 -16.789  -7.672
   33   2HB   GLN   5          1HB       GLN   5  -0.685 -17.220  -7.160
   34   1HG   GLN   5          2HG       GLN   5   0.079 -19.066  -5.885
   35   2HG   GLN   5          1HG       GLN   5   1.660 -19.056  -6.669
   36   1HE2  GLN   5          1HE2      GLN   5   0.395 -18.401  -3.750
   37   2HE2  GLN   5          2HE2      GLN   5   1.352 -17.085  -3.272
   38    H    ALA   6           H        ALA   6  -2.078 -17.290  -9.157
   39    HA   ALA   6           HA       ALA   6  -1.105 -16.154 -11.761
   40   1HB   ALA   6          1HB       ALA   6  -2.612 -17.843 -12.376
   41   2HB   ALA   6          2HB       ALA   6  -3.665 -16.429 -12.295
   42   3HB   ALA   6          3HB       ALA   6  -3.629 -17.580 -10.960
   43    H    TYR   7           H        TYR   7  -0.617 -14.158 -10.571
   44    HA   TYR   7           HA       TYR   7  -1.159 -12.038  -9.663
   45   1HB   TYR   7          2HB       TYR   7  -2.631 -12.659 -11.961
   46   2HB   TYR   7          1HB       TYR   7  -3.827 -12.001 -10.845
   47    HD1  TYR   7           1HD      TYR   7  -4.172  -9.715 -11.031
   48    HD2  TYR   7           2HD      TYR   7  -0.240 -11.294 -11.735
   49    HE1  TYR   7           1HE      TYR   7  -3.332  -7.424 -11.475
   50    HE2  TYR   7           2HE      TYR   7   0.600  -9.002 -12.179
   51    HH   TYR   7           HH       TYR   7   0.091  -6.851 -12.305
   52    H    VAL   8           H        VAL   8  -1.388 -13.035  -7.461
   53    HA   VAL   8           HA       VAL   8  -3.887 -12.324  -6.208
   54    HB   VAL   8           HB       VAL   8  -4.423 -14.437  -7.526
   55   1HG1  VAL   8          1HG1      VAL   8  -3.311 -16.210  -5.517
   56   2HG1  VAL   8          2HG1      VAL   8  -2.033 -15.298  -6.322
   57   3HG1  VAL   8          3HG1      VAL   8  -3.149 -16.279  -7.272
   58   1HG2  VAL   8          1HG2      VAL   8  -5.637 -13.615  -5.433
   59   2HG2  VAL   8          2HG2      VAL   8  -4.674 -14.785  -4.529
   60   3HG2  VAL   8          3HG2      VAL   8  -5.791 -15.339  -5.776
   61    H    SER   9           H        SER   9  -1.110 -11.836  -5.696
   62    HA   SER   9           HA       SER   9  -0.583 -13.454  -3.231
   63   1HB   SER   9          2HB       SER   9   1.354 -11.595  -4.595
   64   2HB   SER   9          1HB       SER   9   1.695 -13.046  -3.656
   65    HG   SER   9           HG       SER   9   1.853 -13.217  -6.023
   66    H    ASP  10           H        ASP  10   1.138 -11.648  -1.965
   67    HA   ASP  10           HA       ASP  10  -0.618  -9.965  -0.508
   68   1HB   ASP  10          2HB       ASP  10   2.258 -10.519  -0.773
   69   2HB   ASP  10          1HB       ASP  10   1.910  -8.877  -0.227
   70    H    GLU  11           H        GLU  11  -1.766  -8.883  -2.358
   71    HA   GLU  11           HA       GLU  11  -0.481  -7.082  -4.172
   72   1HB   GLU  11          2HB       GLU  11  -3.154  -7.823  -3.250
   73   2HB   GLU  11          1HB       GLU  11  -3.047  -6.112  -3.664
   74   1HG   GLU  11          2HG       GLU  11  -2.219  -8.423  -5.444
   75   2HG   GLU  11          1HG       GLU  11  -3.660  -7.425  -5.648
   76    H    ILE  12           H        ILE  12  -0.880  -6.875  -0.793
   77    HA   ILE  12           HA       ILE  12  -1.419  -4.179  -0.244
   78    HB   ILE  12           HB       ILE  12   0.425  -6.245   0.970
   79   1HG1  ILE  12          2HG1      ILE  12  -2.080  -6.530   1.025
   80   2HG1  ILE  12          1HG1      ILE  12  -1.338  -6.430   2.622
   81   1HG2  ILE  12          1HG2      ILE  12   0.389  -4.692   3.000
   82   2HG2  ILE  12          2HG2      ILE  12  -0.158  -3.427   1.900
   83   3HG2  ILE  12          3HG2      ILE  12   1.417  -4.185   1.661
   84   1HD1  ILE  12          1HD1      ILE  12  -2.765  -4.745   3.078
   85   2HD1  ILE  12          2HD1      ILE  12  -3.294  -4.665   1.398
   86   3HD1  ILE  12          3HD1      ILE  12  -1.867  -3.769   1.916
   87    H    VAL  13           H        VAL  13   1.754  -5.651  -1.037
   88    HA   VAL  13           HA       VAL  13   3.468  -3.485  -0.808
   89    HB   VAL  13           HB       VAL  13   4.671  -4.559  -2.735
   90   1HG1  VAL  13          1HG1      VAL  13   3.447  -6.317  -0.596
   91   2HG1  VAL  13          2HG1      VAL  13   5.027  -5.534  -0.575
   92   3HG1  VAL  13          3HG1      VAL  13   4.721  -6.877  -1.678
   93   1HG2  VAL  13          1HG2      VAL  13   1.970  -5.840  -3.011
   94   2HG2  VAL  13          2HG2      VAL  13   3.402  -6.766  -3.456
   95   3HG2  VAL  13          3HG2      VAL  13   3.053  -5.240  -4.266
   96    H    TYR  14           H        TYR  14   1.263  -4.160  -3.532
   97    HA   TYR  14           HA       TYR  14   2.038  -1.836  -5.079
   98   1HB   TYR  14          2HB       TYR  14   0.809  -4.116  -5.640
   99   2HB   TYR  14          1HB       TYR  14  -0.640  -3.178  -5.271
  100    HD1  TYR  14           1HD      TYR  14  -0.620  -0.713  -6.351
  101    HD2  TYR  14           2HD      TYR  14   1.551  -4.105  -7.845
  102    HE1  TYR  14           1HE      TYR  14  -0.510   0.344  -8.593
  103    HE2  TYR  14           2HE      TYR  14   1.662  -3.048 -10.086
  104    HH   TYR  14           HH       TYR  14   1.459  -0.981 -11.152
  105    H    LYS  15           H        LYS  15  -0.569  -2.515  -2.751
  106    HA   LYS  15           HA       LYS  15  -2.116  -0.162  -3.109
  107   1HB   LYS  15          2HB       LYS  15  -1.987  -2.410  -1.425
  108   2HB   LYS  15          1HB       LYS  15  -1.902  -1.022  -0.340
  109   1HG   LYS  15          2HG       LYS  15  -3.910  -0.061  -1.425
  110   2HG   LYS  15          1HG       LYS  15  -4.007  -1.477  -2.473
  111   1HD   LYS  15          2HD       LYS  15  -5.306  -2.393  -0.864
  112   2HD   LYS  15          1HD       LYS  15  -3.817  -2.582   0.063
  113   1HE   LYS  15          2HE       LYS  15  -4.557   0.100   0.457
  114   2HE   LYS  15          1HE       LYS  15  -6.067  -0.821   0.587
  115   1HZ   LYS  15          1HZ       LYS  15  -4.535  -2.467   1.887
  116   2HZ   LYS  15          2HZ       LYS  15  -5.214  -1.124   2.678
  117   3HZ   LYS  15          3HZ       LYS  15  -3.598  -1.078   2.157
  118    H    ILE  16           H        ILE  16   0.904  -0.689  -1.349
  119    HA   ILE  16           HA       ILE  16   0.839   1.859   0.063
  120    HB   ILE  16           HB       ILE  16   3.167   0.028  -0.593
  121   1HG1  ILE  16          2HG1      ILE  16   1.040  -0.119   1.559
  122   2HG1  ILE  16          1HG1      ILE  16   1.467  -1.359   0.378
  123   1HG2  ILE  16          1HG2      ILE  16   2.830   1.557   1.960
  124   2HG2  ILE  16          2HG2      ILE  16   3.347   2.436   0.520
  125   3HG2  ILE  16          3HG2      ILE  16   4.310   1.087   1.123
  126   1HD1  ILE  16          1HD1      ILE  16   2.442  -1.936   2.542
  127   2HD1  ILE  16          2HD1      ILE  16   3.223  -0.356   2.638
  128   3HD1  ILE  16          3HD1      ILE  16   3.730  -1.518   1.410
  129    H    ASN  17           H        ASN  17   2.346   0.652  -2.928
  130    HA   ASN  17           HA       ASN  17   4.062   2.752  -3.597
  131   1HB   ASN  17          2HB       ASN  17   2.169   1.057  -5.244
  132   2HB   ASN  17          1HB       ASN  17   3.387   2.103  -5.974
  133   1HD2  ASN  17          1HD2      ASN  17   4.683   0.328  -6.792
  134   2HD2  ASN  17          2HD2      ASN  17   5.548  -0.702  -5.755
  135    H    LYS  18           H        LYS  18   0.524   2.646  -3.859
  136    HA   LYS  18           HA       LYS  18   0.293   5.170  -5.286
  137   1HB   LYS  18          2HB       LYS  18  -1.676   3.548  -3.639
  138   2HB   LYS  18          1HB       LYS  18  -2.106   4.826  -4.776
  139   1HG   LYS  18          2HG       LYS  18  -1.779   3.493  -6.588
  140   2HG   LYS  18          1HG       LYS  18  -0.333   2.753  -5.897
  141   1HD   LYS  18          2HD       LYS  18  -1.583   1.180  -4.659
  142   2HD   LYS  18          1HD       LYS  18  -3.074   2.109  -4.820
  143   1HE   LYS  18          2HE       LYS  18  -1.738   1.117  -7.319
  144   2HE   LYS  18          1HE       LYS  18  -2.690  -0.022  -6.346
  145   1HZ   LYS  18          1HZ       LYS  18  -4.533   1.517  -6.366
  146   2HZ   LYS  18          2HZ       LYS  18  -4.072   1.173  -7.964
  147   3HZ   LYS  18          3HZ       LYS  18  -3.631   2.649  -7.249
  148    H    ILE  19           H        ILE  19   0.624   4.250  -1.933
  149    HA   ILE  19           HA       ILE  19  -0.550   6.606  -0.742
  150    HB   ILE  19           HB       ILE  19   1.586   4.674   0.226
  151   1HG1  ILE  19          2HG1      ILE  19  -0.610   3.666  -0.506
  152   2HG1  ILE  19          1HG1      ILE  19  -0.250   3.429   1.204
  153   1HG2  ILE  19          1HG2      ILE  19   1.651   5.927   2.093
  154   2HG2  ILE  19          2HG2      ILE  19  -0.081   5.672   2.311
  155   3HG2  ILE  19          3HG2      ILE  19   0.497   7.060   1.388
  156   1HD1  ILE  19          1HD1      ILE  19  -2.604   4.470   0.233
  157   2HD1  ILE  19          2HD1      ILE  19  -1.694   5.928   0.629
  158   3HD1  ILE  19          3HD1      ILE  19  -1.997   4.713   1.872
  159    H    VAL  20           H        VAL  20   2.867   5.688  -1.351
  160    HA   VAL  20           HA       VAL  20   4.015   8.171  -0.510
  161    HB   VAL  20           HB       VAL  20   5.024   6.257  -2.631
  162   1HG1  VAL  20          1HG1      VAL  20   6.385   8.037  -0.590
  163   2HG1  VAL  20          2HG1      VAL  20   6.402   8.240  -2.343
  164   3HG1  VAL  20          3HG1      VAL  20   7.226   6.867  -1.606
  165   1HG2  VAL  20          1HG2      VAL  20   4.725   4.669  -1.029
  166   2HG2  VAL  20          2HG2      VAL  20   4.497   5.867   0.245
  167   3HG2  VAL  20          3HG2      VAL  20   6.125   5.421  -0.264
  168    H    GLU  21           H        GLU  21   3.071   6.994  -3.751
  169    HA   GLU  21           HA       GLU  21   3.904   9.267  -5.241
  170   1HB   GLU  21          2HB       GLU  21   2.730   6.797  -5.673
  171   2HB   GLU  21          1HB       GLU  21   1.461   7.923  -6.157
  172   1HG   GLU  21          2HG       GLU  21   4.298   8.309  -7.093
  173   2HG   GLU  21          1HG       GLU  21   3.208   7.214  -7.944
  174    H    ARG  22           H        ARG  22   0.877   8.600  -3.500
  175    HA   ARG  22           HA       ARG  22  -0.866  10.542  -4.407
  176   1HB   ARG  22          2HB       ARG  22  -0.297   9.118  -1.932
  177   2HB   ARG  22          1HB       ARG  22  -0.977  10.713  -1.607
  178   1HG   ARG  22          2HG       ARG  22  -2.705  10.092  -3.458
  179   2HG   ARG  22          1HG       ARG  22  -2.180   8.433  -3.162
  180   1HD   ARG  22          2HD       ARG  22  -2.805   8.587  -0.816
  181   2HD   ARG  22          1HD       ARG  22  -3.177  10.312  -0.992
  182    HE   ARG  22           HE       ARG  22  -4.783   9.314  -2.900
  183   1HH1  ARG  22          1HH2      ARG  22  -4.471   6.571  -1.667
  184   2HH1  ARG  22          2HH2      ARG  22  -5.839   6.508  -0.608
  185   1HH2  ARG  22          1HH1      ARG  22  -6.399   9.929  -0.697
  186   2HH2  ARG  22          2HH1      ARG  22  -6.932   8.410  -0.059
  187    H    ARG  23           H        ARG  23   1.762  11.105  -2.033
  188    HA   ARG  23           HA       ARG  23   1.440  13.789  -1.440
  189   1HB   ARG  23          2HB       ARG  23   3.447  11.835  -1.329
  190   2HB   ARG  23          1HB       ARG  23   4.185  13.175  -2.205
  191   1HG   ARG  23          2HG       ARG  23   4.623  13.782   0.003
  192   2HG   ARG  23          1HG       ARG  23   3.110  14.637  -0.298
  193   1HD   ARG  23          2HD       ARG  23   2.651  13.557   1.740
  194   2HD   ARG  23          1HD       ARG  23   2.019  12.381   0.571
  195    HE   ARG  23           HE       ARG  23   4.591  11.567   0.732
  196   1HH1  ARG  23          1HH2      ARG  23   1.943  11.134   2.640
  197   2HH1  ARG  23          2HH2      ARG  23   2.797  10.750   4.098
  198   1HH2  ARG  23          1HH1      ARG  23   5.893  11.676   2.839
  199   2HH2  ARG  23          2HH1      ARG  23   5.035  11.057   4.211
  200    H    ARG  24           H        ARG  24   3.049  12.486  -4.367
  201    HA   ARG  24           HA       ARG  24   3.424  15.102  -5.572
  202   1HB   ARG  24          2HB       ARG  24   3.393  12.342  -6.832
  203   2HB   ARG  24          1HB       ARG  24   4.205  13.775  -7.460
  204   1HG   ARG  24          2HG       ARG  24   6.008  13.421  -6.155
  205   2HG   ARG  24          1HG       ARG  24   5.003  13.237  -4.717
  206   1HD   ARG  24          2HD       ARG  24   5.438  11.015  -4.756
  207   2HD   ARG  24          1HD       ARG  24   4.602  10.909  -6.317
  208    HE   ARG  24           HE       ARG  24   7.445  11.812  -6.239
  209   1HH1  ARG  24          1HH1      ARG  24   5.443  11.071  -8.589
  210   2HH1  ARG  24          2HH1      ARG  24   6.208   9.619  -9.145
  211   1HH2  ARG  24          1HH2      ARG  24   8.243   9.308  -6.354
  212   2HH2  ARG  24          2HH2      ARG  24   7.795   8.622  -7.880
  213    H    ALA  25           H        ALA  25   1.141  12.415  -6.146
  214    HA   ALA  25           HA       ALA  25  -0.342  13.613  -8.250
  215   1HB   ALA  25          1HB       ALA  25  -2.044  12.104  -6.508
  216   2HB   ALA  25          2HB       ALA  25  -0.446  11.356  -6.494
  217   3HB   ALA  25          3HB       ALA  25  -1.303  11.581  -8.019
  218    H    GLU  26           H        GLU  26  -0.115  14.493  -4.930
  219    HA   GLU  26           HA       GLU  26  -2.538  16.197  -5.211
  220   1HB   GLU  26          2HB       GLU  26  -3.000  15.790  -2.917
  221   2HB   GLU  26          1HB       GLU  26  -2.505  14.223  -3.556
  222   1HG   GLU  26          2HG       GLU  26  -1.005  14.192  -1.860
  223   2HG   GLU  26          1HG       GLU  26  -0.097  15.364  -2.816
  224    H    GLY  27           H        GLY  27   0.813  16.302  -5.106
  225   1HA   GLY  27          2HA       GLY  27   1.408  18.874  -5.250
  226   2HA   GLY  27          1HA       GLY  27   0.870  18.857  -3.571
  227    H    ALA  28           H        ALA  28   3.031  16.937  -5.674
  228    HA   ALA  28           HA       ALA  28   4.686  15.713  -3.849
  229   1HB   ALA  28          1HB       ALA  28   6.075  15.467  -5.667
  230   2HB   ALA  28          2HB       ALA  28   6.034  17.186  -6.056
  231   3HB   ALA  28          3HB       ALA  28   4.686  16.146  -6.516
  232    H    LYS  29           H        LYS  29   6.290  16.323  -2.418
  233    HA   LYS  29           HA       LYS  29   7.739  18.798  -2.458
  234   1HB   LYS  29          2HB       LYS  29   5.276  19.449  -1.954
  235   2HB   LYS  29          1HB       LYS  29   5.551  18.717  -0.373
  236   1HG   LYS  29          2HG       LYS  29   7.716  20.518  -1.172
  237   2HG   LYS  29          1HG       LYS  29   6.157  21.335  -1.059
  238   1HD   LYS  29          2HD       LYS  29   6.046  19.844   1.193
  239   2HD   LYS  29          1HD       LYS  29   7.790  20.074   1.076
  240   1HE   LYS  29          2HE       LYS  29   7.305  22.571   0.748
  241   2HE   LYS  29          1HE       LYS  29   5.647  22.205   1.268
  242   1HZ   LYS  29          1HZ       LYS  29   8.159  21.964   2.776
  243   2HZ   LYS  29          2HZ       LYS  29   6.888  20.895   3.128
  244   3HZ   LYS  29          3HZ       LYS  29   6.659  22.571   3.281
  245    H    SER  30           H        SER  30   6.114  16.874   0.088
  246    HA   SER  30           HA       SER  30   8.796  16.356   1.305
  247   1HB   SER  30          2HB       SER  30   7.410  15.901   3.338
  248   2HB   SER  30          1HB       SER  30   7.138  17.519   2.697
  249    HG   SER  30           HG       SER  30   5.126  16.931   2.605
  250    H    THR  31           H        THR  31   7.942  14.886  -0.990
  251    HA   THR  31           HA       THR  31   7.091  12.234   0.084
  252    HB   THR  31           HB       THR  31   5.981  13.434  -1.878
  253    HG1  THR  31           1HG      THR  31   5.926  11.130  -1.502
  254   1HG2  THR  31          1HG2      THR  31   7.922  14.341  -2.978
  255   2HG2  THR  31          2HG2      THR  31   7.206  13.148  -4.063
  256   3HG2  THR  31          3HG2      THR  31   8.646  12.740  -3.131
  257    H    ASP  32           H        ASP  32   9.912  13.728  -0.065
  258    HA   ASP  32           HA       ASP  32  11.727  12.407  -1.703
  259   1HB   ASP  32          2HB       ASP  32  12.302  14.204  -0.161
  260   2HB   ASP  32          1HB       ASP  32  11.915  13.184   1.225
  261    H    VAL  33           H        VAL  33   9.911  11.103   0.983
  262    HA   VAL  33           HA       VAL  33  11.462   8.830   1.675
  263    HB   VAL  33           HB       VAL  33   9.365   8.002   2.554
  264   1HG1  VAL  33          1HG1      VAL  33   8.919  10.968   2.632
  265   2HG1  VAL  33          2HG1      VAL  33  10.402  10.308   3.323
  266   3HG1  VAL  33          3HG1      VAL  33   8.833   9.793   3.944
  267   1HG2  VAL  33          1HG2      VAL  33   7.219   9.159   1.853
  268   2HG2  VAL  33          2HG2      VAL  33   7.958   8.157   0.605
  269   3HG2  VAL  33          3HG2      VAL  33   8.136   9.910   0.547
  270    H    SER  34           H        SER  34   9.701   6.662   1.091
  271    HA   SER  34           HA       SER  34   9.304   6.400  -1.783
  272   1HB   SER  34          2HB       SER  34  11.881   6.330  -1.132
  273   2HB   SER  34          1HB       SER  34  11.496   4.667  -0.695
  274    HG   SER  34           HG       SER  34  11.569   4.252  -2.743
  275    H    PHE  35           H        PHE  35   9.684   3.579  -1.915
  276    HA   PHE  35           HA       PHE  35   7.272   2.624  -0.677
  277   1HB   PHE  35          2HB       PHE  35   8.492   1.840  -2.786
  278   2HB   PHE  35          1HB       PHE  35   9.605   0.995  -1.714
  279    HD1  PHE  35           1HD      PHE  35   6.672   0.962   0.083
  280    HD2  PHE  35           2HD      PHE  35   8.353  -0.764  -3.475
  281    HE1  PHE  35           1HE      PHE  35   5.076  -0.929   0.245
  282    HE2  PHE  35           2HE      PHE  35   6.756  -2.654  -3.311
  283    HZ   PHE  35           HZ       PHE  35   5.118  -2.736  -1.452
  284    H    SER  36           H        SER  36  10.557   1.301  -0.141
  285    HA   SER  36           HA       SER  36  10.122  -0.086   2.222
  286   1HB   SER  36          2HB       SER  36  12.324   1.106   0.769
  287   2HB   SER  36          1HB       SER  36  12.610   1.224   2.504
  288    HG   SER  36           HG       SER  36  12.538  -0.973   0.854
  289    H    SER  37           H        SER  37  10.519   3.412   1.829
  290    HA   SER  37           HA       SER  37  10.702   4.012   4.661
  291   1HB   SER  37          2HB       SER  37  10.674   5.349   2.082
  292   2HB   SER  37          1HB       SER  37   9.698   6.232   3.253
  293    HG   SER  37           HG       SER  37  11.606   5.870   4.689
  294    H    ILE  38           H        ILE  38   8.067   4.763   2.341
  295    HA   ILE  38           HA       ILE  38   6.101   5.232   4.389
  296    HB   ILE  38           HB       ILE  38   6.039   4.631   1.424
  297   1HG1  ILE  38          2HG1      ILE  38   7.010   6.799   2.288
  298   2HG1  ILE  38          1HG1      ILE  38   5.620   7.006   1.220
  299   1HG2  ILE  38          1HG2      ILE  38   3.628   5.818   1.997
  300   2HG2  ILE  38          2HG2      ILE  38   3.838   4.739   3.377
  301   3HG2  ILE  38          3HG2      ILE  38   3.858   4.088   1.737
  302   1HD1  ILE  38          1HD1      ILE  38   5.858   8.130   3.723
  303   2HD1  ILE  38          2HD1      ILE  38   4.892   6.692   4.051
  304   3HD1  ILE  38          3HD1      ILE  38   4.336   7.878   2.872
  305    H    SER  39           H        SER  39   7.501   2.345   3.292
  306    HA   SER  39           HA       SER  39   5.228   0.566   3.365
  307   1HB   SER  39          2HB       SER  39   8.134   0.498   3.104
  308   2HB   SER  39          1HB       SER  39   7.534  -0.862   4.050
  309    HG   SER  39           HG       SER  39   6.477  -1.594   2.347
  310    H    THR  40           H        THR  40   7.949   0.624   5.687
  311    HA   THR  40           HA       THR  40   6.865  -0.780   7.794
  312    HB   THR  40           HB       THR  40   8.313   1.846   8.181
  313    HG1  THR  40           1HG      THR  40   9.554   1.029   6.661
  314   1HG2  THR  40          1HG2      THR  40   8.375  -0.858   9.541
  315   2HG2  THR  40          2HG2      THR  40   7.823   0.670  10.226
  316   3HG2  THR  40          3HG2      THR  40   9.533   0.429   9.876
  317    H    MET  41           H        MET  41   6.011   2.499   6.808
  318    HA   MET  41           HA       MET  41   4.674   3.517   9.032
  319   1HB   MET  41          2HB       MET  41   4.953   4.090   6.346
  320   2HB   MET  41          1HB       MET  41   3.221   3.786   6.487
  321   1HG   MET  41          2HG       MET  41   4.335   5.430   8.663
  322   2HG   MET  41          1HG       MET  41   4.428   6.180   7.070
  323   1HE   MET  41          1HE       MET  41   0.941   6.175   5.708
  324   2HE   MET  41          2HE       MET  41   1.545   4.523   5.825
  325   3HE   MET  41          3HE       MET  41   2.648   5.829   5.399
  326    H    LEU  42           H        LEU  42   2.968   1.762   6.409
  327    HA   LEU  42           HA       LEU  42   0.532   1.351   7.752
  328   1HB   LEU  42          2HB       LEU  42   2.037   0.225   5.485
  329   2HB   LEU  42          1HB       LEU  42   0.864  -0.893   6.183
  330    HG   LEU  42           HG       LEU  42  -0.577   1.439   6.118
  331   1HD1  LEU  42          1HD1      LEU  42   0.913   2.779   4.886
  332   2HD1  LEU  42          2HD1      LEU  42  -0.170   2.150   3.644
  333   3HD1  LEU  42          3HD1      LEU  42   1.427   1.432   3.867
  334   1HD2  LEU  42          1HD2      LEU  42  -1.315   0.366   3.771
  335   2HD2  LEU  42          2HD2      LEU  42  -1.705  -0.404   5.308
  336   3HD2  LEU  42          3HD2      LEU  42  -0.323  -0.965   4.366
  337    H    LEU  43           H        LEU  43   3.228  -1.017   7.503
  338    HA   LEU  43           HA       LEU  43   2.182  -2.986   9.220
  339   1HB   LEU  43          2HB       LEU  43   4.192  -3.222   7.821
  340   2HB   LEU  43          1HB       LEU  43   5.044  -2.055   8.836
  341    HG   LEU  43           HG       LEU  43   4.117  -3.830  10.706
  342   1HD1  LEU  43          1HD1      LEU  43   3.464  -5.705   9.612
  343   2HD1  LEU  43          2HD1      LEU  43   5.182  -5.974   9.316
  344   3HD1  LEU  43          3HD1      LEU  43   4.191  -5.173   8.096
  345   1HD2  LEU  43          1HD2      LEU  43   6.558  -2.909   9.742
  346   2HD2  LEU  43          2HD2      LEU  43   6.688  -4.659   9.569
  347   3HD2  LEU  43          3HD2      LEU  43   6.338  -3.953  11.147
  348    H    GLU  44           H        GLU  44   4.002  -0.033  10.044
  349    HA   GLU  44           HA       GLU  44   4.331  -0.558  12.839
  350   1HB   GLU  44          2HB       GLU  44   4.132   1.902  11.093
  351   2HB   GLU  44          1HB       GLU  44   4.360   2.049  12.835
  352   1HG   GLU  44          2HG       GLU  44   6.152   0.416  11.017
  353   2HG   GLU  44          1HG       GLU  44   6.515   2.055  11.553
  354    H    LEU  45           H        LEU  45   1.613   0.296  10.906
  355    HA   LEU  45           HA       LEU  45  -0.020   1.107  13.260
  356   1HB   LEU  45          2HB       LEU  45  -0.030   1.425  10.299
  357   2HB   LEU  45          1HB       LEU  45  -1.606   1.366  11.087
  358    HG   LEU  45           HG       LEU  45  -0.366   3.064  12.766
  359   1HD1  LEU  45          1HD1      LEU  45   1.064   3.239  10.116
  360   2HD1  LEU  45          2HD1      LEU  45   1.750   3.235  11.740
  361   3HD1  LEU  45          3HD1      LEU  45   0.898   4.660  11.147
  362   1HD2  LEU  45          1HD2      LEU  45  -1.199   4.848  10.896
  363   2HD2  LEU  45          2HD2      LEU  45  -2.308   3.947  11.931
  364   3HD2  LEU  45          3HD2      LEU  45  -1.978   3.384  10.293
  365    H    GLY  46           H        GLY  46   0.787  -1.673  11.524
  366   1HA   GLY  46          2HA       GLY  46  -0.100  -3.854  11.712
  367   2HA   GLY  46          1HA       GLY  46  -1.361  -3.207  12.762
  368    H    LEU  47           H        LEU  47  -1.178  -1.354   9.980
  369    HA   LEU  47           HA       LEU  47  -2.379  -1.320   7.942
  370   1HB   LEU  47          2HB       LEU  47  -3.352  -4.097   8.652
  371   2HB   LEU  47          1HB       LEU  47  -3.188  -3.380   7.055
  372    HG   LEU  47           HG       LEU  47  -0.689  -3.475   8.648
  373   1HD1  LEU  47          1HD1      LEU  47  -2.047  -5.693   9.008
  374   2HD1  LEU  47          2HD1      LEU  47  -0.343  -5.782   8.557
  375   3HD1  LEU  47          3HD1      LEU  47  -1.594  -6.020   7.335
  376   1HD2  LEU  47          1HD2      LEU  47  -1.532  -3.186   5.952
  377   2HD2  LEU  47          2HD2      LEU  47  -0.615  -4.690   6.040
  378   3HD2  LEU  47          3HD2      LEU  47   0.120  -3.176   6.568
  379    H    ARG  48           H        ARG  48  -3.774  -1.986  11.029
  380    HA   ARG  48           HA       ARG  48  -6.566  -1.770  10.250
  381   1HB   ARG  48          2HB       ARG  48  -5.048  -1.475  12.862
  382   2HB   ARG  48          1HB       ARG  48  -6.808  -1.494  12.752
  383   1HG   ARG  48          2HG       ARG  48  -6.864  -3.732  12.027
  384   2HG   ARG  48          1HG       ARG  48  -5.172  -3.710  11.531
  385   1HD   ARG  48          2HD       ARG  48  -6.143  -3.532  14.408
  386   2HD   ARG  48          1HD       ARG  48  -5.439  -4.972  13.646
  387    HE   ARG  48           HE       ARG  48  -3.517  -3.149  13.109
  388   1HH1  ARG  48          1HH2      ARG  48  -4.688  -1.453  15.333
  389   2HH1  ARG  48          2HH2      ARG  48  -3.728  -1.951  16.686
  390   1HH2  ARG  48          1HH1      ARG  48  -2.540  -4.811  15.126
  391   2HH2  ARG  48          2HH1      ARG  48  -2.510  -3.853  16.568
  392    H    VAL  49           H        VAL  49  -4.955   0.418  12.540
  393    HA   VAL  49           HA       VAL  49  -6.526   2.671  12.188
  394    HB   VAL  49           HB       VAL  49  -3.507   2.615  12.486
  395   1HG1  VAL  49          1HG1      VAL  49  -3.653   4.773  13.195
  396   2HG1  VAL  49          2HG1      VAL  49  -5.174   4.491  14.042
  397   3HG1  VAL  49          3HG1      VAL  49  -5.174   4.777  12.302
  398   1HG2  VAL  49          1HG2      VAL  49  -5.560   1.426  14.102
  399   2HG2  VAL  49          2HG2      VAL  49  -4.858   2.779  14.988
  400   3HG2  VAL  49          3HG2      VAL  49  -3.824   1.476  14.403
  401    H    TYR  50           H        TYR  50  -3.818   1.616  10.142
  402    HA   TYR  50           HA       TYR  50  -3.340   3.786   8.500
  403   1HB   TYR  50          2HB       TYR  50  -2.164   1.765   8.122
  404   2HB   TYR  50          1HB       TYR  50  -3.652   0.828   7.973
  405    HD1  TYR  50           1HD      TYR  50  -3.956   0.033   5.807
  406    HD2  TYR  50           2HD      TYR  50  -2.366   3.980   6.384
  407    HE1  TYR  50           1HE      TYR  50  -3.934   0.383   3.351
  408    HE2  TYR  50           2HE      TYR  50  -2.342   4.330   3.928
  409    HH   TYR  50           HH       TYR  50  -3.337   1.737   1.695
  410    H    GLU  51           H        GLU  51  -5.893   1.346   7.791
  411    HA   GLU  51           HA       GLU  51  -7.122   2.779   5.697
  412   1HB   GLU  51          2HB       GLU  51  -7.318   0.388   7.242
  413   2HB   GLU  51          1HB       GLU  51  -8.909   1.112   7.159
  414   1HG   GLU  51          2HG       GLU  51  -8.640  -0.333   5.246
  415   2HG   GLU  51          1HG       GLU  51  -8.603   1.335   4.682
  416    H    ALA  52           H        ALA  52  -7.523   2.908   9.208
  417    HA   ALA  52           HA       ALA  52 -10.028   4.301   9.293
  418   1HB   ALA  52          1HB       ALA  52  -7.982   4.872  11.357
  419   2HB   ALA  52          2HB       ALA  52  -8.285   3.159  11.058
  420   3HB   ALA  52          3HB       ALA  52  -9.609   4.218  11.543
  421    H    GLN  53           H        GLN  53  -6.741   5.368   8.680
  422    HA   GLN  53           HA       GLN  53  -6.837   8.097   9.318
  423   1HB   GLN  53          2HB       GLN  53  -5.607   6.580   7.000
  424   2HB   GLN  53          1HB       GLN  53  -5.232   8.268   7.350
  425   1HG   GLN  53          2HG       GLN  53  -4.986   6.138   9.473
  426   2HG   GLN  53          1HG       GLN  53  -3.665   6.472   8.352
  427   1HE2  GLN  53          1HE2      GLN  53  -2.369   7.312  10.192
  428   2HE2  GLN  53          2HE2      GLN  53  -2.689   8.854  10.827
  429    H    MET  54           H        MET  54  -7.933   6.534   6.284
  430    HA   MET  54           HA       MET  54  -9.327   7.369   4.564
  431   1HB   MET  54          2HB       MET  54 -10.371   8.213   7.220
  432   2HB   MET  54          1HB       MET  54 -11.096   8.989   5.812
  433   1HG   MET  54          2HG       MET  54 -11.207   6.523   4.882
  434   2HG   MET  54          1HG       MET  54 -11.110   6.093   6.590
  435   1HE   MET  54          1HE       MET  54 -13.123   5.911   4.103
  436   2HE   MET  54          2HE       MET  54 -13.471   7.599   3.739
  437   3HE   MET  54          3HE       MET  54 -14.730   6.577   4.424
  438    H    GLU  55           H        GLU  55  -6.848   8.929   5.291
  439    HA   GLU  55           HA       GLU  55  -7.480  11.757   5.069
  440   1HB   GLU  55          2HB       GLU  55  -5.044  11.945   4.884
  441   2HB   GLU  55          1HB       GLU  55  -5.443  10.752   6.120
  442   1HG   GLU  55          2HG       GLU  55  -4.941   8.929   4.674
  443   2HG   GLU  55          1HG       GLU  55  -4.926   9.968   3.248
  444    H    ARG  56           H        ARG  56  -6.683  13.072   3.169
  445    HA   ARG  56           HA       ARG  56  -7.357  11.679   0.610
  446   1HB   ARG  56          2HB       ARG  56  -8.782  13.534   1.086
  447   2HB   ARG  56          1HB       ARG  56  -7.424  14.539   1.595
  448   1HG   ARG  56          2HG       ARG  56  -7.315  13.469  -1.179
  449   2HG   ARG  56          1HG       ARG  56  -8.514  14.723  -0.862
  450   1HD   ARG  56          2HD       ARG  56  -6.366  15.808   0.404
  451   2HD   ARG  56          1HD       ARG  56  -5.555  14.924  -0.903
  452    HE   ARG  56           HE       ARG  56  -7.758  16.901  -1.363
  453   1HH1  ARG  56          1HH2      ARG  56  -6.947  14.792  -3.468
  454   2HH1  ARG  56          2HH2      ARG  56  -5.909  15.741  -4.479
  455   1HH2  ARG  56          1HH1      ARG  56  -5.553  18.297  -2.163
  456   2HH2  ARG  56          2HH1      ARG  56  -5.119  17.728  -3.740
  Start of MODEL   18
    1   1H    ALA   2          1H        ALA   2 -12.884 -18.328  -6.343
    2   2H    ALA   2          2H        ALA   2 -12.903 -18.230  -4.647
    3   3H    ALA   2          3H        ALA   2 -11.466 -18.627  -5.461
    4    HA   ALA   2           HA       ALA   2 -11.429 -16.408  -6.484
    5   1HB   ALA   2          1HB       ALA   2 -14.085 -16.535  -5.999
    6   2HB   ALA   2          2HB       ALA   2 -13.242 -15.005  -6.240
    7   3HB   ALA   2          3HB       ALA   2 -13.588 -15.573  -4.607
    8    H    LYS   3           H        LYS   3 -10.047 -14.954  -5.415
    9    HA   LYS   3           HA       LYS   3  -8.721 -14.086  -3.657
   10   1HB   LYS   3          2HB       LYS   3 -11.389 -14.426  -2.736
   11   2HB   LYS   3          1HB       LYS   3 -10.329 -14.974  -1.437
   12   1HG   LYS   3          2HG       LYS   3  -9.099 -12.869  -1.494
   13   2HG   LYS   3          1HG       LYS   3 -10.043 -12.322  -2.880
   14   1HD   LYS   3          2HD       LYS   3 -12.091 -12.357  -1.539
   15   2HD   LYS   3          1HD       LYS   3 -11.198 -12.989  -0.156
   16   1HE   LYS   3          2HE       LYS   3 -10.495 -10.355  -1.487
   17   2HE   LYS   3          1HE       LYS   3 -11.589 -10.475  -0.096
   18   1HZ   LYS   3          1HZ       LYS   3  -8.721 -11.006  -0.249
   19   2HZ   LYS   3          2HZ       LYS   3  -9.641 -12.028   0.750
   20   3HZ   LYS   3          3HZ       LYS   3  -9.632 -10.350   1.022
   21    H    VAL   4           H        VAL   4  -6.861 -15.193  -3.205
   22    HA   VAL   4           HA       VAL   4  -7.069 -17.993  -2.170
   23    HB   VAL   4           HB       VAL   4  -4.829 -18.232  -3.101
   24   1HG1  VAL   4          1HG1      VAL   4  -5.501 -17.020  -5.476
   25   2HG1  VAL   4          2HG1      VAL   4  -7.072 -17.170  -4.687
   26   3HG1  VAL   4          3HG1      VAL   4  -6.081 -18.604  -4.959
   27   1HG2  VAL   4          1HG2      VAL   4  -4.153 -15.871  -2.423
   28   2HG2  VAL   4          2HG2      VAL   4  -4.981 -15.308  -3.876
   29   3HG2  VAL   4          3HG2      VAL   4  -3.591 -16.387  -4.013
   30    H    GLN   5           H        GLN   5  -6.716 -14.924  -0.994
   31    HA   GLN   5           HA       GLN   5  -5.823 -14.051   1.012
   32   1HB   GLN   5          2HB       GLN   5  -5.670 -17.007   1.683
   33   2HB   GLN   5          1HB       GLN   5  -5.804 -15.671   2.829
   34   1HG   GLN   5          2HG       GLN   5  -7.962 -15.131   1.328
   35   2HG   GLN   5          1HG       GLN   5  -7.887 -16.873   1.069
   36   1HE2  GLN   5          1HE2      GLN   5  -7.093 -17.902   3.484
   37   2HE2  GLN   5          2HE2      GLN   5  -8.174 -17.469   4.717
   38    H    ALA   6           H        ALA   6  -3.779 -14.029   2.348
   39    HA   ALA   6           HA       ALA   6  -1.483 -15.617   1.649
   40   1HB   ALA   6          1HB       ALA   6  -0.843 -13.015   0.577
   41   2HB   ALA   6          2HB       ALA   6  -2.286 -13.646  -0.218
   42   3HB   ALA   6          3HB       ALA   6  -0.791 -14.582  -0.232
   43    H    TYR   7           H        TYR   7  -2.342 -14.911   4.112
   44    HA   TYR   7           HA       TYR   7  -1.699 -13.852   6.124
   45   1HB   TYR   7          2HB       TYR   7   0.763 -13.741   4.368
   46   2HB   TYR   7          1HB       TYR   7   0.788 -13.268   6.065
   47    HD1  TYR   7           1HD      TYR   7   0.784 -14.893   7.812
   48    HD2  TYR   7           2HD      TYR   7   0.082 -16.088   3.746
   49    HE1  TYR   7           1HE      TYR   7   0.988 -17.274   8.475
   50    HE2  TYR   7           2HE      TYR   7   0.285 -18.469   4.410
   51    HH   TYR   7           HH       TYR   7   1.493 -19.734   6.363
   52    H    VAL   8           H        VAL   8  -2.889 -11.952   6.332
   53    HA   VAL   8           HA       VAL   8  -3.268  -9.621   6.365
   54    HB   VAL   8           HB       VAL   8  -0.453  -9.433   5.268
   55   1HG1  VAL   8          1HG1      VAL   8  -2.404  -7.609   6.419
   56   2HG1  VAL   8          2HG1      VAL   8  -0.875  -7.245   5.619
   57   3HG1  VAL   8          3HG1      VAL   8  -0.904  -7.608   7.344
   58   1HG2  VAL   8          1HG2      VAL   8  -1.320  -9.904   8.139
   59   2HG2  VAL   8          2HG2      VAL   8   0.333  -9.617   7.596
   60   3HG2  VAL   8          3HG2      VAL   8  -0.512 -11.089   7.114
   61    H    SER   9           H        SER   9  -1.042  -9.920   3.571
   62    HA   SER   9           HA       SER   9  -3.142  -9.719   1.584
   63   1HB   SER   9          2HB       SER   9  -2.067  -7.316   2.887
   64   2HB   SER   9          1HB       SER   9  -1.969  -7.251   1.130
   65    HG   SER   9           HG       SER   9  -4.242  -7.977   1.215
   66    H    ASP  10           H        ASP  10  -2.240 -10.492  -0.291
   67    HA   ASP  10           HA       ASP  10   0.590 -11.044  -0.465
   68   1HB   ASP  10          2HB       ASP  10  -1.394 -12.348  -1.405
   69   2HB   ASP  10          1HB       ASP  10  -1.491 -11.111  -2.660
   70    H    GLU  11           H        GLU  11  -1.428  -9.243  -2.806
   71    HA   GLU  11           HA       GLU  11   0.821  -7.812  -3.915
   72   1HB   GLU  11          2HB       GLU  11  -2.179  -7.753  -4.096
   73   2HB   GLU  11          1HB       GLU  11  -1.250  -6.452  -4.841
   74   1HG   GLU  11          2HG       GLU  11  -0.291  -7.846  -6.413
   75   2HG   GLU  11          1HG       GLU  11  -0.376  -9.262  -5.364
   76    H    ILE  12           H        ILE  12   1.708  -6.905  -1.848
   77    HA   ILE  12           HA       ILE  12   0.133  -4.801  -0.502
   78    HB   ILE  12           HB       ILE  12   2.897  -5.998  -0.209
   79   1HG1  ILE  12          2HG1      ILE  12   0.801  -7.234   0.548
   80   2HG1  ILE  12          1HG1      ILE  12   2.001  -6.945   1.809
   81   1HG2  ILE  12          1HG2      ILE  12   3.062  -4.608   1.871
   82   2HG2  ILE  12          2HG2      ILE  12   1.621  -3.733   1.354
   83   3HG2  ILE  12          3HG2      ILE  12   3.097  -3.650   0.392
   84   1HD1  ILE  12          1HD1      ILE  12  -0.495  -5.302   1.296
   85   2HD1  ILE  12          2HD1      ILE  12   0.738  -4.905   2.493
   86   3HD1  ILE  12          3HD1      ILE  12  -0.214  -6.379   2.664
   87    H    VAL  13           H        VAL  13   2.637  -5.066  -2.946
   88    HA   VAL  13           HA       VAL  13   3.584  -2.334  -2.803
   89    HB   VAL  13           HB       VAL  13   4.565  -2.956  -5.015
   90   1HG1  VAL  13          1HG1      VAL  13   4.852  -4.417  -2.502
   91   2HG1  VAL  13          2HG1      VAL  13   6.098  -3.829  -3.604
   92   3HG1  VAL  13          3HG1      VAL  13   5.330  -5.390  -3.894
   93   1HG2  VAL  13          1HG2      VAL  13   2.421  -4.958  -4.824
   94   2HG2  VAL  13          2HG2      VAL  13   3.981  -5.646  -5.274
   95   3HG2  VAL  13          3HG2      VAL  13   3.272  -4.358  -6.248
   96    H    TYR  14           H        TYR  14   0.901  -3.925  -4.446
   97    HA   TYR  14           HA       TYR  14   0.352  -1.796  -6.332
   98   1HB   TYR  14          2HB       TYR  14  -0.349  -4.298  -6.278
   99   2HB   TYR  14          1HB       TYR  14  -1.646  -3.761  -5.207
  100    HD1  TYR  14           1HD      TYR  14  -3.657  -3.633  -6.382
  101    HD2  TYR  14           2HD      TYR  14  -0.044  -2.255  -8.251
  102    HE1  TYR  14           1HE      TYR  14  -4.965  -2.868  -8.344
  103    HE2  TYR  14           2HE      TYR  14  -1.351  -1.489 -10.214
  104    HH   TYR  14           HH       TYR  14  -3.573  -0.890 -10.820
  105    H    LYS  15           H        LYS  15  -1.237  -2.750  -3.259
  106    HA   LYS  15           HA       LYS  15  -3.034  -0.523  -3.156
  107   1HB   LYS  15          2HB       LYS  15  -2.408  -2.852  -1.706
  108   2HB   LYS  15          1HB       LYS  15  -2.197  -1.526  -0.561
  109   1HG   LYS  15          2HG       LYS  15  -4.446  -1.640  -0.296
  110   2HG   LYS  15          1HG       LYS  15  -4.528  -0.819  -1.854
  111   1HD   LYS  15          2HD       LYS  15  -5.364  -2.653  -2.870
  112   2HD   LYS  15          1HD       LYS  15  -4.113  -3.684  -2.175
  113   1HE   LYS  15          2HE       LYS  15  -5.381  -3.855  -0.073
  114   2HE   LYS  15          1HE       LYS  15  -6.624  -2.768  -0.724
  115   1HZ   LYS  15          1HZ       LYS  15  -7.507  -4.734  -1.398
  116   2HZ   LYS  15          2HZ       LYS  15  -6.007  -5.530  -1.454
  117   3HZ   LYS  15          3HZ       LYS  15  -6.465  -4.485  -2.713
  118    H    ILE  16           H        ILE  16   0.067  -1.055  -1.419
  119    HA   ILE  16           HA       ILE  16   0.192   1.500  -0.167
  120    HB   ILE  16           HB       ILE  16   2.397  -0.338  -1.156
  121   1HG1  ILE  16          2HG1      ILE  16   0.695  -1.434   0.302
  122   2HG1  ILE  16          1HG1      ILE  16   2.275  -1.332   1.079
  123   1HG2  ILE  16          1HG2      ILE  16   2.323   2.011   0.722
  124   2HG2  ILE  16          2HG2      ILE  16   3.497   1.637  -0.539
  125   3HG2  ILE  16          3HG2      ILE  16   3.502   0.724   0.968
  126   1HD1  ILE  16          1HD1      ILE  16  -0.176   0.353   1.599
  127   2HD1  ILE  16          2HD1      ILE  16   1.432   0.879   2.101
  128   3HD1  ILE  16          3HD1      ILE  16   0.749  -0.615   2.746
  129    H    ASN  17           H        ASN  17   1.301   0.405  -3.362
  130    HA   ASN  17           HA       ASN  17   2.876   2.511  -4.241
  131   1HB   ASN  17          2HB       ASN  17   1.075   0.504  -5.372
  132   2HB   ASN  17          1HB       ASN  17   1.193   1.940  -6.387
  133   1HD2  ASN  17          1HD2      ASN  17   2.354  -0.721  -6.992
  134   2HD2  ASN  17          2HD2      ASN  17   4.031  -0.492  -7.113
  135    H    LYS  18           H        LYS  18  -0.552   2.612  -3.521
  136    HA   LYS  18           HA       LYS  18  -1.113   5.036  -5.029
  137   1HB   LYS  18          2HB       LYS  18  -2.477   3.552  -2.762
  138   2HB   LYS  18          1HB       LYS  18  -3.185   4.963  -3.549
  139   1HG   LYS  18          2HG       LYS  18  -3.833   3.751  -5.336
  140   2HG   LYS  18          1HG       LYS  18  -2.238   3.015  -5.496
  141   1HD   LYS  18          2HD       LYS  18  -2.867   1.137  -4.391
  142   2HD   LYS  18          1HD       LYS  18  -3.753   2.048  -3.168
  143   1HE   LYS  18          2HE       LYS  18  -5.501   0.936  -4.274
  144   2HE   LYS  18          1HE       LYS  18  -5.450   2.465  -5.172
  145   1HZ   LYS  18          1HZ       LYS  18  -4.251  -0.137  -5.910
  146   2HZ   LYS  18          2HZ       LYS  18  -3.693   1.316  -6.588
  147   3HZ   LYS  18          3HZ       LYS  18  -5.305   0.832  -6.819
  148    H    ILE  19           H        ILE  19  -1.047   4.512  -1.475
  149    HA   ILE  19           HA       ILE  19  -1.005   7.183  -0.659
  150    HB   ILE  19           HB       ILE  19   0.234   4.636   0.387
  151   1HG1  ILE  19          2HG1      ILE  19  -1.547   5.310   2.214
  152   2HG1  ILE  19          1HG1      ILE  19  -2.195   6.320   0.921
  153   1HG2  ILE  19          1HG2      ILE  19   1.691   6.369   1.236
  154   2HG2  ILE  19          2HG2      ILE  19   0.600   5.901   2.540
  155   3HG2  ILE  19          3HG2      ILE  19   0.317   7.394   1.645
  156   1HD1  ILE  19          1HD1      ILE  19  -2.784   4.506  -0.390
  157   2HD1  ILE  19          2HD1      ILE  19  -2.988   3.798   1.212
  158   3HD1  ILE  19          3HD1      ILE  19  -1.522   3.476   0.286
  159    H    VAL  20           H        VAL  20   1.871   5.136  -1.317
  160    HA   VAL  20           HA       VAL  20   3.877   7.071  -0.933
  161    HB   VAL  20           HB       VAL  20   5.017   5.651  -2.833
  162   1HG1  VAL  20          1HG1      VAL  20   4.111   4.869  -0.109
  163   2HG1  VAL  20          2HG1      VAL  20   5.746   5.098  -0.732
  164   3HG1  VAL  20          3HG1      VAL  20   4.855   3.624  -1.115
  165   1HG2  VAL  20          1HG2      VAL  20   3.742   4.140  -3.898
  166   2HG2  VAL  20          2HG2      VAL  20   2.325   4.749  -3.049
  167   3HG2  VAL  20          3HG2      VAL  20   3.265   3.429  -2.357
  168    H    GLU  21           H        GLU  21   2.688   6.150  -4.178
  169    HA   GLU  21           HA       GLU  21   3.769   8.276  -5.634
  170   1HB   GLU  21          2HB       GLU  21   2.392   6.146  -6.279
  171   2HB   GLU  21          1HB       GLU  21   0.999   7.223  -6.164
  172   1HG   GLU  21          2HG       GLU  21   1.584   7.474  -8.407
  173   2HG   GLU  21          1HG       GLU  21   2.467   8.810  -7.668
  174    H    ARG  22           H        ARG  22   0.616   8.189  -3.944
  175    HA   ARG  22           HA       ARG  22  -0.487  10.629  -4.707
  176   1HB   ARG  22          2HB       ARG  22  -1.512   8.965  -3.198
  177   2HB   ARG  22          1HB       ARG  22  -0.350   9.387  -1.939
  178   1HG   ARG  22          2HG       ARG  22  -2.431  10.570  -1.506
  179   2HG   ARG  22          1HG       ARG  22  -1.207  11.739  -2.004
  180   1HD   ARG  22          2HD       ARG  22  -2.575  10.684  -4.334
  181   2HD   ARG  22          1HD       ARG  22  -3.739  11.372  -3.184
  182    HE   ARG  22           HE       ARG  22  -1.342  13.012  -3.569
  183   1HH1  ARG  22          1HH2      ARG  22  -3.058  12.435  -6.143
  184   2HH1  ARG  22          2HH2      ARG  22  -3.994  13.891  -6.190
  185   1HH2  ARG  22          1HH1      ARG  22  -3.190  14.826  -2.949
  186   2HH2  ARG  22          2HH1      ARG  22  -4.069  15.244  -4.382
  187    H    ARG  23           H        ARG  23   1.806  10.147  -1.984
  188    HA   ARG  23           HA       ARG  23   2.090  12.780  -1.113
  189   1HB   ARG  23          2HB       ARG  23   4.293  10.735  -1.538
  190   2HB   ARG  23          1HB       ARG  23   4.308  12.049  -0.364
  191   1HG   ARG  23          2HG       ARG  23   2.580   9.574  -0.381
  192   2HG   ARG  23          1HG       ARG  23   3.652  10.151   0.893
  193   1HD   ARG  23          2HD       ARG  23   1.027  11.412   0.024
  194   2HD   ARG  23          1HD       ARG  23   1.387  10.659   1.589
  195    HE   ARG  23           HE       ARG  23   3.361  12.615   1.240
  196   1HH1  ARG  23          1HH2      ARG  23   0.638  13.657  -0.056
  197   2HH1  ARG  23          2HH2      ARG  23   0.130  14.713   1.218
  198   1HH2  ARG  23          1HH1      ARG  23   2.403  13.466   3.519
  199   2HH2  ARG  23          2HH1      ARG  23   1.128  14.604   3.242
  200    H    ARG  24           H        ARG  24   4.078  11.232  -3.678
  201    HA   ARG  24           HA       ARG  24   5.297  13.750  -4.468
  202   1HB   ARG  24          2HB       ARG  24   5.157  10.918  -5.485
  203   2HB   ARG  24          1HB       ARG  24   5.874  12.172  -6.498
  204   1HG   ARG  24          2HG       ARG  24   7.790  11.896  -5.346
  205   2HG   ARG  24          1HG       ARG  24   6.968  12.588  -3.946
  206   1HD   ARG  24          2HD       ARG  24   7.799  10.453  -3.218
  207   2HD   ARG  24          1HD       ARG  24   6.066  10.205  -3.514
  208    HE   ARG  24           HE       ARG  24   6.717   9.346  -5.795
  209   1HH1  ARG  24          1HH1      ARG  24   9.630  10.277  -5.436
  210   2HH1  ARG  24          2HH1      ARG  24  10.417   8.760  -5.155
  211   1HH2  ARG  24          1HH2      ARG  24   7.472   7.052  -4.495
  212   2HH2  ARG  24          2HH2      ARG  24   9.195   6.933  -4.625
  213    H    ALA  25           H        ALA  25   2.607  11.761  -5.687
  214    HA   ALA  25           HA       ALA  25   2.004  12.991  -8.108
  215   1HB   ALA  25          1HB       ALA  25   0.637  11.533  -5.986
  216   2HB   ALA  25          2HB       ALA  25   0.369  11.464  -7.730
  217   3HB   ALA  25          3HB       ALA  25  -0.445  12.693  -6.761
  218    H    GLU  26           H        GLU  26   1.361  14.201  -4.824
  219    HA   GLU  26           HA       GLU  26  -0.023  16.580  -5.778
  220   1HB   GLU  26          2HB       GLU  26  -0.262  17.037  -3.450
  221   2HB   GLU  26          1HB       GLU  26  -0.325  15.279  -3.580
  222   1HG   GLU  26          2HG       GLU  26   1.391  15.166  -2.129
  223   2HG   GLU  26          1HG       GLU  26   2.409  15.941  -3.340
  224    H    GLY  27           H        GLY  27   3.282  15.668  -5.166
  225   1HA   GLY  27          2HA       GLY  27   4.965  17.200  -6.236
  226   2HA   GLY  27          1HA       GLY  27   4.080  18.536  -5.497
  227    H    ALA  28           H        ALA  28   4.789  15.459  -3.902
  228    HA   ALA  28           HA       ALA  28   5.812  16.738  -1.538
  229   1HB   ALA  28          1HB       ALA  28   5.934  13.924  -2.662
  230   2HB   ALA  28          2HB       ALA  28   4.802  14.549  -1.463
  231   3HB   ALA  28          3HB       ALA  28   6.501  14.335  -1.043
  232    H    LYS  29           H        LYS  29   8.141  15.748  -0.771
  233    HA   LYS  29           HA       LYS  29  10.162  15.761  -2.909
  234   1HB   LYS  29          2HB       LYS  29  11.245  17.825  -1.928
  235   2HB   LYS  29          1HB       LYS  29   9.687  18.130  -2.699
  236   1HG   LYS  29          2HG       LYS  29   8.565  18.076  -0.524
  237   2HG   LYS  29          1HG       LYS  29  10.090  17.687   0.275
  238   1HD   LYS  29          2HD       LYS  29  11.043  19.831  -0.516
  239   2HD   LYS  29          1HD       LYS  29   9.503  20.226  -1.279
  240   1HE   LYS  29          2HE       LYS  29   8.705  21.016   0.686
  241   2HE   LYS  29          1HE       LYS  29   9.049  19.464   1.476
  242   1HZ   LYS  29          1HZ       LYS  29  11.428  20.159   1.519
  243   2HZ   LYS  29          2HZ       LYS  29  10.415  21.100   2.509
  244   3HZ   LYS  29          3HZ       LYS  29  10.944  21.703   1.010
  245    H    SER  30           H        SER  30  12.380  16.404  -1.310
  246    HA   SER  30           HA       SER  30  13.809  15.475   0.329
  247   1HB   SER  30          2HB       SER  30  11.111  15.682   1.437
  248   2HB   SER  30          1HB       SER  30  12.034  14.384   2.189
  249    HG   SER  30           HG       SER  30  12.405  17.126   2.251
  250    H    THR  31           H        THR  31  14.752  13.425   0.715
  251    HA   THR  31           HA       THR  31  13.642  11.194  -0.850
  252    HB   THR  31           HB       THR  31  16.066  11.910  -0.747
  253    HG1  THR  31           1HG      THR  31  16.128   9.930  -1.426
  254   1HG2  THR  31          1HG2      THR  31  17.005  12.213   1.270
  255   2HG2  THR  31          2HG2      THR  31  16.817  10.490   1.596
  256   3HG2  THR  31          3HG2      THR  31  15.543  11.620   2.058
  257    H    ASP  32           H        ASP  32  12.662  12.283   1.991
  258    HA   ASP  32           HA       ASP  32  12.960  10.010   3.771
  259   1HB   ASP  32          2HB       ASP  32  11.883  12.672   3.740
  260   2HB   ASP  32          1HB       ASP  32  10.654  11.577   4.374
  261    H    VAL  33           H        VAL  33  10.800  10.806   1.154
  262    HA   VAL  33           HA       VAL  33   8.757   8.838   1.981
  263    HB   VAL  33           HB       VAL  33   9.154  10.787  -0.295
  264   1HG1  VAL  33          1HG1      VAL  33   7.979   9.250  -1.528
  265   2HG1  VAL  33          2HG1      VAL  33   6.613   9.957  -0.664
  266   3HG1  VAL  33          3HG1      VAL  33   7.327   8.447  -0.099
  267   1HG2  VAL  33          1HG2      VAL  33   6.729  11.283   0.844
  268   2HG2  VAL  33          2HG2      VAL  33   8.228  12.047   1.372
  269   3HG2  VAL  33          3HG2      VAL  33   7.609  10.635   2.229
  270    H    SER  34           H        SER  34   8.530   6.806   1.041
  271    HA   SER  34           HA       SER  34   9.716   6.006  -1.459
  272   1HB   SER  34          2HB       SER  34  11.737   5.102  -0.777
  273   2HB   SER  34          1HB       SER  34  11.602   6.399   0.408
  274    HG   SER  34           HG       SER  34  11.450   3.678   0.723
  275    H    PHE  35           H        PHE  35   8.970   3.922  -2.024
  276    HA   PHE  35           HA       PHE  35   6.684   2.818  -0.938
  277   1HB   PHE  35          2HB       PHE  35   7.628   2.072  -3.030
  278   2HB   PHE  35          1HB       PHE  35   9.090   1.499  -2.229
  279    HD1  PHE  35           1HD      PHE  35   9.241  -0.794  -1.885
  280    HD2  PHE  35           2HD      PHE  35   5.372   1.072  -1.876
  281    HE1  PHE  35           1HE      PHE  35   8.176  -3.004  -1.515
  282    HE2  PHE  35           2HE      PHE  35   4.308  -1.136  -1.507
  283    HZ   PHE  35           HZ       PHE  35   5.708  -3.174  -1.326
  284    H    SER  36           H        SER  36  10.024   2.232   0.129
  285    HA   SER  36           HA       SER  36   9.301   0.198   2.083
  286   1HB   SER  36          2HB       SER  36  11.515  -0.014   1.546
  287   2HB   SER  36          1HB       SER  36  11.669   1.688   1.123
  288    HG   SER  36           HG       SER  36  12.806   1.487   2.970
  289    H    SER  37           H        SER  37  10.113   3.673   2.242
  290    HA   SER  37           HA       SER  37   9.932   3.963   5.079
  291   1HB   SER  37          2HB       SER  37  10.883   5.534   3.311
  292   2HB   SER  37          1HB       SER  37   9.224   6.000   2.948
  293    HG   SER  37           HG       SER  37  10.197   7.382   4.495
  294    H    ILE  38           H        ILE  38   7.490   4.704   2.553
  295    HA   ILE  38           HA       ILE  38   5.355   5.425   4.252
  296    HB   ILE  38           HB       ILE  38   5.581   4.107   1.542
  297   1HG1  ILE  38          2HG1      ILE  38   6.258   6.523   1.957
  298   2HG1  ILE  38          1HG1      ILE  38   5.017   6.299   0.726
  299   1HG2  ILE  38          1HG2      ILE  38   3.429   3.442   1.763
  300   2HG2  ILE  38          2HG2      ILE  38   3.025   5.155   1.668
  301   3HG2  ILE  38          3HG2      ILE  38   3.206   4.380   3.240
  302   1HD1  ILE  38          1HD1      ILE  38   3.816   6.536   3.350
  303   2HD1  ILE  38          2HD1      ILE  38   3.532   7.507   1.907
  304   3HD1  ILE  38          3HD1      ILE  38   4.844   7.928   3.007
  305    H    SER  39           H        SER  39   6.430   2.194   3.215
  306    HA   SER  39           HA       SER  39   4.215   0.736   4.325
  307   1HB   SER  39          2HB       SER  39   7.114  -0.068   3.911
  308   2HB   SER  39          1HB       SER  39   5.746  -1.169   4.052
  309    HG   SER  39           HG       SER  39   6.516   0.505   1.957
  310    H    THR  40           H        THR  40   7.256   1.939   5.661
  311    HA   THR  40           HA       THR  40   7.459   0.541   8.077
  312    HB   THR  40           HB       THR  40   7.857   3.525   7.764
  313    HG1  THR  40           1HG      THR  40   9.078   1.369   6.505
  314   1HG2  THR  40          1HG2      THR  40  10.057   2.337   8.982
  315   2HG2  THR  40          2HG2      THR  40   8.682   1.455   9.645
  316   3HG2  THR  40          3HG2      THR  40   8.763   3.210   9.805
  317    H    MET  41           H        MET  41   6.018   3.824   7.943
  318    HA   MET  41           HA       MET  41   4.745   3.760  10.444
  319   1HB   MET  41          2HB       MET  41   3.283   5.516   9.423
  320   2HB   MET  41          1HB       MET  41   4.990   5.751   9.041
  321   1HG   MET  41          2HG       MET  41   4.177   5.932   6.907
  322   2HG   MET  41          1HG       MET  41   4.282   4.173   6.969
  323   1HE   MET  41          1HE       MET  41   2.294   4.163   4.918
  324   2HE   MET  41          2HE       MET  41   2.694   5.871   5.077
  325   3HE   MET  41          3HE       MET  41   1.005   5.369   5.047
  326    H    LEU  42           H        LEU  42   3.611   2.459   7.347
  327    HA   LEU  42           HA       LEU  42   0.918   1.878   8.184
  328   1HB   LEU  42          2HB       LEU  42   2.354   1.873   5.865
  329   2HB   LEU  42          1HB       LEU  42   2.241   0.144   6.183
  330    HG   LEU  42           HG       LEU  42  -0.242   1.773   6.491
  331   1HD1  LEU  42          1HD1      LEU  42   0.156   2.642   4.394
  332   2HD1  LEU  42          2HD1      LEU  42  -0.492   1.075   3.908
  333   3HD1  LEU  42          3HD1      LEU  42   1.251   1.333   3.947
  334   1HD2  LEU  42          1HD2      LEU  42  -1.248  -0.271   6.282
  335   2HD2  LEU  42          2HD2      LEU  42   0.354  -0.878   6.700
  336   3HD2  LEU  42          3HD2      LEU  42  -0.142  -0.793   5.012
  337    H    LEU  43           H        LEU  43   3.607  -0.444   7.619
  338    HA   LEU  43           HA       LEU  43   2.243  -2.539   9.071
  339   1HB   LEU  43          2HB       LEU  43   4.108  -2.544   7.210
  340   2HB   LEU  43          1HB       LEU  43   5.202  -2.500   8.596
  341    HG   LEU  43           HG       LEU  43   3.257  -4.384   9.295
  342   1HD1  LEU  43          1HD1      LEU  43   2.496  -5.371   7.417
  343   2HD1  LEU  43          2HD1      LEU  43   4.150  -5.650   6.871
  344   3HD1  LEU  43          3HD1      LEU  43   3.325  -4.147   6.457
  345   1HD2  LEU  43          1HD2      LEU  43   6.049  -4.714   8.143
  346   2HD2  LEU  43          2HD2      LEU  43   5.159  -5.991   8.972
  347   3HD2  LEU  43          3HD2      LEU  43   5.628  -4.534   9.847
  348    H    GLU  44           H        GLU  44   3.641   0.229  10.281
  349    HA   GLU  44           HA       GLU  44   5.084  -0.913  12.547
  350   1HB   GLU  44          2HB       GLU  44   4.275   1.728  11.453
  351   2HB   GLU  44          1HB       GLU  44   4.470   1.667  13.205
  352   1HG   GLU  44          2HG       GLU  44   6.722   0.642  12.874
  353   2HG   GLU  44          1HG       GLU  44   6.533   0.860  11.137
  354    H    LEU  45           H        LEU  45   1.870   0.386  11.865
  355    HA   LEU  45           HA       LEU  45   1.007  -0.323  14.623
  356   1HB   LEU  45          2HB       LEU  45  -0.395   1.466  14.420
  357   2HB   LEU  45          1HB       LEU  45   0.715   1.923  13.142
  358    HG   LEU  45           HG       LEU  45  -1.508   2.172  12.295
  359   1HD1  LEU  45          1HD1      LEU  45  -0.419   1.426  10.457
  360   2HD1  LEU  45          2HD1      LEU  45  -1.460   0.023  10.659
  361   3HD1  LEU  45          3HD1      LEU  45   0.187  -0.008  11.271
  362   1HD2  LEU  45          1HD2      LEU  45  -3.251   0.813  12.782
  363   2HD2  LEU  45          2HD2      LEU  45  -2.202   0.178  14.048
  364   3HD2  LEU  45          3HD2      LEU  45  -2.314  -0.651  12.497
  365    H    GLY  46           H        GLY  46   1.088  -1.706  11.549
  366   1HA   GLY  46          2HA       GLY  46   0.228  -3.939  11.181
  367   2HA   GLY  46          1HA       GLY  46  -1.051  -3.612  12.348
  368    H    LEU  47           H        LEU  47  -0.167  -1.378   9.753
  369    HA   LEU  47           HA       LEU  47  -1.602  -0.423   8.112
  370   1HB   LEU  47          2HB       LEU  47  -0.688  -2.394   7.031
  371   2HB   LEU  47          1HB       LEU  47  -1.881  -3.427   7.816
  372    HG   LEU  47           HG       LEU  47  -3.112  -1.218   6.349
  373   1HD1  LEU  47          1HD1      LEU  47  -0.939  -2.681   5.085
  374   2HD1  LEU  47          2HD1      LEU  47  -1.868  -1.314   4.469
  375   3HD1  LEU  47          3HD1      LEU  47  -2.468  -2.960   4.250
  376   1HD2  LEU  47          1HD2      LEU  47  -4.746  -2.775   6.184
  377   2HD2  LEU  47          2HD2      LEU  47  -3.746  -3.785   7.228
  378   3HD2  LEU  47          3HD2      LEU  47  -3.644  -3.957   5.476
  379    H    ARG  48           H        ARG  48  -2.908  -1.075  10.830
  380    HA   ARG  48           HA       ARG  48  -5.611  -1.960  10.226
  381   1HB   ARG  48          2HB       ARG  48  -3.982  -1.612  12.453
  382   2HB   ARG  48          1HB       ARG  48  -5.214  -0.368  12.652
  383   1HG   ARG  48          2HG       ARG  48  -6.961  -1.919  12.728
  384   2HG   ARG  48          1HG       ARG  48  -6.030  -3.156  11.883
  385   1HD   ARG  48          2HD       ARG  48  -6.271  -3.677  14.316
  386   2HD   ARG  48          1HD       ARG  48  -4.571  -3.416  13.873
  387    HE   ARG  48           HE       ARG  48  -5.723  -0.900  14.570
  388   1HH1  ARG  48          1HH2      ARG  48  -6.771  -2.849  16.705
  389   2HH1  ARG  48          2HH2      ARG  48  -5.560  -2.665  17.929
  390   1HH2  ARG  48          1HH1      ARG  48  -3.288  -1.109  15.820
  391   2HH2  ARG  48          2HH1      ARG  48  -3.587  -1.679  17.429
  392    H    VAL  49           H        VAL  49  -4.747   1.166  11.721
  393    HA   VAL  49           HA       VAL  49  -7.051   2.564  10.917
  394    HB   VAL  49           HB       VAL  49  -5.247   3.212  12.570
  395   1HG1  VAL  49          1HG1      VAL  49  -3.370   2.752  10.939
  396   2HG1  VAL  49          2HG1      VAL  49  -3.254   4.308  11.760
  397   3HG1  VAL  49          3HG1      VAL  49  -3.827   4.232  10.095
  398   1HG2  VAL  49          1HG2      VAL  49  -5.926   5.394  12.458
  399   2HG2  VAL  49          2HG2      VAL  49  -7.000   4.772  11.204
  400   3HG2  VAL  49          3HG2      VAL  49  -5.481   5.550  10.758
  401    H    TYR  50           H        TYR  50  -3.967   2.142   9.192
  402    HA   TYR  50           HA       TYR  50  -4.222   3.927   7.071
  403   1HB   TYR  50          2HB       TYR  50  -2.279   2.568   7.280
  404   2HB   TYR  50          1HB       TYR  50  -3.226   1.079   7.279
  405    HD1  TYR  50           1HD      TYR  50  -1.619   3.625   5.235
  406    HD2  TYR  50           2HD      TYR  50  -4.358   0.318   5.175
  407    HE1  TYR  50           1HE      TYR  50  -1.383   3.475   2.771
  408    HE2  TYR  50           2HE      TYR  50  -4.123   0.167   2.711
  409    HH   TYR  50           HH       TYR  50  -1.680   1.561   1.013
  410    H    GLU  51           H        GLU  51  -5.491   0.559   7.082
  411    HA   GLU  51           HA       GLU  51  -6.894   0.730   4.627
  412   1HB   GLU  51          2HB       GLU  51  -6.265  -1.141   6.487
  413   2HB   GLU  51          1HB       GLU  51  -7.971  -0.909   6.851
  414   1HG   GLU  51          2HG       GLU  51  -7.529  -1.041   3.988
  415   2HG   GLU  51          1HG       GLU  51  -6.900  -2.476   4.793
  416    H    ALA  52           H        ALA  52  -7.794   1.661   7.919
  417    HA   ALA  52           HA       ALA  52 -10.605   2.141   7.257
  418   1HB   ALA  52          1HB       ALA  52 -10.743   2.180   9.521
  419   2HB   ALA  52          2HB       ALA  52  -9.514   3.440   9.640
  420   3HB   ALA  52          3HB       ALA  52  -9.034   1.747   9.528
  421    H    GLN  53           H        GLN  53  -7.995   4.346   8.363
  422    HA   GLN  53           HA       GLN  53  -9.382   6.732   7.571
  423   1HB   GLN  53          2HB       GLN  53  -6.598   5.950   8.391
  424   2HB   GLN  53          1HB       GLN  53  -6.907   7.592   7.824
  425   1HG   GLN  53          2HG       GLN  53  -9.002   6.998   9.617
  426   2HG   GLN  53          1HG       GLN  53  -7.528   6.416  10.391
  427   1HE2  GLN  53          1HE2      GLN  53  -8.737   9.327   8.627
  428   2HE2  GLN  53          2HE2      GLN  53  -7.842  10.435   9.550
  429    H    MET  54           H        MET  54  -7.244   4.527   5.868
  430    HA   MET  54           HA       MET  54  -6.412   4.573   3.654
  431   1HB   MET  54          2HB       MET  54  -9.081   5.987   3.590
  432   2HB   MET  54          1HB       MET  54  -8.174   5.670   2.113
  433   1HG   MET  54          2HG       MET  54  -8.035   3.220   3.173
  434   2HG   MET  54          1HG       MET  54  -9.521   3.749   3.960
  435   1HE   MET  54          1HE       MET  54  -9.426   1.369   2.366
  436   2HE   MET  54          2HE       MET  54 -10.565   1.408   1.023
  437   3HE   MET  54          3HE       MET  54 -11.095   1.894   2.632
  438    H    GLU  55           H        GLU  55  -5.701   6.848   5.535
  439    HA   GLU  55           HA       GLU  55  -4.629   8.953   5.419
  440   1HB   GLU  55          2HB       GLU  55  -4.112   7.753   2.680
  441   2HB   GLU  55          1HB       GLU  55  -3.228   9.126   3.345
  442   1HG   GLU  55          2HG       GLU  55  -3.225   7.105   5.339
  443   2HG   GLU  55          1HG       GLU  55  -2.792   6.325   3.817
  444    H    ARG  56           H        ARG  56  -4.401  10.922   3.643
  445    HA   ARG  56           HA       ARG  56  -7.018  11.319   2.273
  446   1HB   ARG  56          2HB       ARG  56  -7.123  12.104   4.661
  447   2HB   ARG  56          1HB       ARG  56  -5.818  13.233   4.298
  448   1HG   ARG  56          2HG       ARG  56  -7.277  14.146   2.430
  449   2HG   ARG  56          1HG       ARG  56  -8.594  13.179   3.094
  450   1HD   ARG  56          2HD       ARG  56  -8.362  14.340   5.267
  451   2HD   ARG  56          1HD       ARG  56  -7.047  15.324   4.593
  452    HE   ARG  56           HE       ARG  56  -9.753  15.311   3.319
  453   1HH1  ARG  56          1HH2      ARG  56  -8.410  17.105   5.678
  454   2HH1  ARG  56          2HH2      ARG  56  -8.304  18.594   4.798
  455   1HH2  ARG  56          1HH1      ARG  56  -9.019  17.141   1.732
  456   2HH2  ARG  56          2HH1      ARG  56  -8.649  18.614   2.564
  Start of MODEL   19
    1   1H    ALA   2          1H        ALA   2   9.801 -13.135 -16.844
    2   2H    ALA   2          2H        ALA   2   9.008 -14.141 -15.728
    3   3H    ALA   2          3H        ALA   2  10.610 -14.473 -16.187
    4    HA   ALA   2           HA       ALA   2  11.496 -12.871 -14.846
    5   1HB   ALA   2          1HB       ALA   2   8.843 -11.416 -15.024
    6   2HB   ALA   2          2HB       ALA   2  10.124 -11.223 -16.220
    7   3HB   ALA   2          3HB       ALA   2  10.403 -10.746 -14.546
    8    H    LYS   3           H        LYS   3  10.184 -11.607 -12.666
    9    HA   LYS   3           HA       LYS   3   8.526 -13.681 -11.344
   10   1HB   LYS   3          2HB       LYS   3  11.250 -13.806 -11.180
   11   2HB   LYS   3          1HB       LYS   3  10.882 -12.790  -9.788
   12   1HG   LYS   3          2HG       LYS   3  10.696 -14.908  -8.843
   13   2HG   LYS   3          1HG       LYS   3   9.027 -14.612  -9.331
   14   1HD   LYS   3          2HD       LYS   3   9.074 -16.278 -10.856
   15   2HD   LYS   3          1HD       LYS   3  10.632 -15.751 -11.493
   16   1HE   LYS   3          2HE       LYS   3  10.878 -16.905  -8.812
   17   2HE   LYS   3          1HE       LYS   3  10.220 -18.055  -9.992
   18   1HZ   LYS   3          1HZ       LYS   3  12.631 -16.362 -10.392
   19   2HZ   LYS   3          2HZ       LYS   3  11.992 -17.460 -11.521
   20   3HZ   LYS   3          3HZ       LYS   3  12.649 -18.023 -10.059
   21    H    VAL   4           H        VAL   4   7.073 -11.714 -11.553
   22    HA   VAL   4           HA       VAL   4   7.748  -9.436  -9.777
   23    HB   VAL   4           HB       VAL   4   6.799  -9.045 -12.004
   24   1HG1  VAL   4          1HG1      VAL   4   5.401 -10.645 -12.777
   25   2HG1  VAL   4          2HG1      VAL   4   4.145  -9.859 -11.819
   26   3HG1  VAL   4          3HG1      VAL   4   5.043 -11.220 -11.148
   27   1HG2  VAL   4          1HG2      VAL   4   4.397  -8.423 -10.416
   28   2HG2  VAL   4          2HG2      VAL   4   5.494  -7.335 -11.265
   29   3HG2  VAL   4          3HG2      VAL   4   5.906  -7.922  -9.653
   30    H    GLN   5           H        GLN   5   6.308  -8.822  -8.024
   31    HA   GLN   5           HA       GLN   5   5.115  -9.374  -6.051
   32   1HB   GLN   5          2HB       GLN   5   3.536 -10.694  -8.281
   33   2HB   GLN   5          1HB       GLN   5   2.910 -10.433  -6.654
   34   1HG   GLN   5          2HG       GLN   5   3.321  -7.995  -6.908
   35   2HG   GLN   5          1HG       GLN   5   3.863  -8.281  -8.562
   36   1HE2  GLN   5          1HE2      GLN   5   2.246  -8.875 -10.167
   37   2HE2  GLN   5          2HE2      GLN   5   0.585  -8.722  -9.854
   38    H    ALA   6           H        ALA   6   3.711 -11.643  -5.299
   39    HA   ALA   6           HA       ALA   6   4.896 -14.164  -5.872
   40   1HB   ALA   6          1HB       ALA   6   6.275 -12.394  -3.866
   41   2HB   ALA   6          2HB       ALA   6   6.987 -13.400  -5.128
   42   3HB   ALA   6          3HB       ALA   6   6.332 -14.143  -3.670
   43    H    TYR   7           H        TYR   7   3.217 -15.423  -5.182
   44    HA   TYR   7           HA       TYR   7   1.141 -14.793  -3.448
   45   1HB   TYR   7          2HB       TYR   7   0.818 -17.206  -3.315
   46   2HB   TYR   7          1HB       TYR   7   1.426 -16.810  -4.924
   47    HD1  TYR   7           1HD      TYR   7   3.692 -17.388  -5.601
   48    HD2  TYR   7           2HD      TYR   7   2.264 -18.290  -1.651
   49    HE1  TYR   7           1HE      TYR   7   5.641 -18.877  -5.235
   50    HE2  TYR   7           2HE      TYR   7   4.212 -19.779  -1.286
   51    HH   TYR   7           HH       TYR   7   5.809 -21.101  -2.725
   52    H    VAL   8           H        VAL   8   0.762 -15.173  -1.181
   53    HA   VAL   8           HA       VAL   8   1.377 -15.133   1.102
   54    HB   VAL   8           HB       VAL   8   3.382 -17.024  -0.159
   55   1HG1  VAL   8          1HG1      VAL   8   3.334 -15.905   2.506
   56   2HG1  VAL   8          2HG1      VAL   8   4.488 -17.038   1.802
   57   3HG1  VAL   8          3HG1      VAL   8   3.021 -17.639   2.574
   58   1HG2  VAL   8          1HG2      VAL   8   1.046 -17.710   1.620
   59   2HG2  VAL   8          2HG2      VAL   8   1.879 -18.735   0.449
   60   3HG2  VAL   8          3HG2      VAL   8   0.811 -17.445  -0.108
   61    H    SER   9           H        SER   9   2.041 -12.817   0.807
   62    HA   SER   9           HA       SER   9   4.709 -12.332   1.801
   63   1HB   SER   9          2HB       SER   9   4.174 -12.354  -1.113
   64   2HB   SER   9          1HB       SER   9   5.091 -10.969  -0.529
   65    HG   SER   9           HG       SER   9   6.600 -12.498  -0.871
   66    H    ASP  10           H        ASP  10   5.173  -9.826   1.586
   67    HA   ASP  10           HA       ASP  10   3.036  -8.385   2.778
   68   1HB   ASP  10          2HB       ASP  10   5.763  -7.998   1.888
   69   2HB   ASP  10          1HB       ASP  10   4.795  -6.570   1.516
   70    H    GLU  11           H        GLU  11   1.277  -8.968   1.173
   71    HA   GLU  11           HA       GLU  11   1.225  -8.113  -1.534
   72   1HB   GLU  11          2HB       GLU  11  -1.228  -8.265  -1.212
   73   2HB   GLU  11          1HB       GLU  11  -0.401  -9.619  -0.439
   74   1HG   GLU  11          2HG       GLU  11  -1.613  -9.033   1.392
   75   2HG   GLU  11          1HG       GLU  11  -0.403  -7.763   1.577
   76    H    ILE  12           H        ILE  12   1.213  -6.249   1.362
   77    HA   ILE  12           HA       ILE  12  -0.329  -3.980   0.660
   78    HB   ILE  12           HB       ILE  12   1.119  -2.854   2.312
   79   1HG1  ILE  12          2HG1      ILE  12   2.866  -5.284   1.839
   80   2HG1  ILE  12          1HG1      ILE  12   3.300  -3.589   1.612
   81   1HG2  ILE  12          1HG2      ILE  12   0.850  -5.711   3.230
   82   2HG2  ILE  12          2HG2      ILE  12  -0.584  -4.739   2.898
   83   3HG2  ILE  12          3HG2      ILE  12   0.561  -4.226   4.139
   84   1HD1  ILE  12          1HD1      ILE  12   4.163  -3.733   3.706
   85   2HD1  ILE  12          2HD1      ILE  12   3.249  -5.195   4.078
   86   3HD1  ILE  12          3HD1      ILE  12   2.485  -3.613   4.237
   87    H    VAL  13           H        VAL  13   2.716  -5.097  -0.602
   88    HA   VAL  13           HA       VAL  13   3.982  -2.767  -1.495
   89    HB   VAL  13           HB       VAL  13   4.903  -4.999  -1.750
   90   1HG1  VAL  13          1HG1      VAL  13   2.475  -5.883  -2.296
   91   2HG1  VAL  13          2HG1      VAL  13   3.885  -6.726  -2.938
   92   3HG1  VAL  13          3HG1      VAL  13   2.976  -5.618  -3.966
   93   1HG2  VAL  13          1HG2      VAL  13   5.559  -4.929  -4.162
   94   2HG2  VAL  13          2HG2      VAL  13   5.699  -3.357  -3.376
   95   3HG2  VAL  13          3HG2      VAL  13   4.326  -3.696  -4.431
   96    H    TYR  14           H        TYR  14   1.306  -4.532  -3.071
   97    HA   TYR  14           HA       TYR  14   1.134  -2.743  -5.341
   98   1HB   TYR  14          2HB       TYR  14   0.144  -5.214  -4.532
   99   2HB   TYR  14          1HB       TYR  14  -1.292  -4.191  -4.578
  100    HD1  TYR  14           1HD      TYR  14  -2.351  -3.774  -6.621
  101    HD2  TYR  14           2HD      TYR  14   1.755  -5.035  -6.592
  102    HE1  TYR  14           1HE      TYR  14  -2.378  -3.915  -9.097
  103    HE2  TYR  14           2HE      TYR  14   1.729  -5.176  -9.068
  104    HH   TYR  14           HH       TYR  14   0.530  -4.385 -10.941
  105    H    LYS  15           H        LYS  15  -0.670  -3.018  -2.270
  106    HA   LYS  15           HA       LYS  15  -2.498  -0.848  -2.885
  107   1HB   LYS  15          2HB       LYS  15  -2.303  -2.923  -1.079
  108   2HB   LYS  15          1HB       LYS  15  -1.982  -1.516  -0.064
  109   1HG   LYS  15          2HG       LYS  15  -4.254  -1.374   0.040
  110   2HG   LYS  15          1HG       LYS  15  -4.089  -0.608  -1.540
  111   1HD   LYS  15          2HD       LYS  15  -4.228  -3.600  -1.388
  112   2HD   LYS  15          1HD       LYS  15  -5.716  -2.665  -1.235
  113   1HE   LYS  15          2HE       LYS  15  -5.712  -2.754  -3.529
  114   2HE   LYS  15          1HE       LYS  15  -4.526  -1.440  -3.393
  115   1HZ   LYS  15          1HZ       LYS  15  -3.972  -4.353  -3.553
  116   2HZ   LYS  15          2HZ       LYS  15  -2.797  -3.197  -3.142
  117   3HZ   LYS  15          3HZ       LYS  15  -3.527  -3.162  -4.676
  118    H    ILE  16           H        ILE  16   0.407  -1.090  -0.789
  119    HA   ILE  16           HA       ILE  16   0.367   1.583   0.183
  120    HB   ILE  16           HB       ILE  16   2.652  -0.319  -0.424
  121   1HG1  ILE  16          2HG1      ILE  16   1.012   0.198   2.078
  122   2HG1  ILE  16          1HG1      ILE  16   0.975  -1.265   1.092
  123   1HG2  ILE  16          1HG2      ILE  16   3.475   1.158   1.696
  124   2HG2  ILE  16          2HG2      ILE  16   2.521   2.367   0.836
  125   3HG2  ILE  16          3HG2      ILE  16   3.870   1.567   0.028
  126   1HD1  ILE  16          1HD1      ILE  16   3.408  -0.212   2.565
  127   2HD1  ILE  16          2HD1      ILE  16   3.341  -1.691   1.605
  128   3HD1  ILE  16          3HD1      ILE  16   2.403  -1.561   3.093
  129    H    ASN  17           H        ASN  17   1.599   0.235  -2.851
  130    HA   ASN  17           HA       ASN  17   3.210   2.339  -3.783
  131   1HB   ASN  17          2HB       ASN  17   1.818   0.025  -4.775
  132   2HB   ASN  17          1HB       ASN  17   1.639   1.342  -5.936
  133   1HD2  ASN  17          1HD2      ASN  17   3.463  -1.219  -5.767
  134   2HD2  ASN  17          2HD2      ASN  17   4.999  -0.611  -6.162
  135    H    LYS  18           H        LYS  18  -0.227   1.905  -4.734
  136    HA   LYS  18           HA       LYS  18  -0.570   4.476  -5.871
  137   1HB   LYS  18          2HB       LYS  18  -2.943   3.949  -5.665
  138   2HB   LYS  18          1HB       LYS  18  -2.064   2.471  -6.054
  139   1HG   LYS  18          2HG       LYS  18  -2.021   2.658  -3.245
  140   2HG   LYS  18          1HG       LYS  18  -3.668   3.070  -3.722
  141   1HD   LYS  18          2HD       LYS  18  -2.131   0.573  -4.492
  142   2HD   LYS  18          1HD       LYS  18  -3.541   0.663  -3.437
  143   1HE   LYS  18          2HE       LYS  18  -4.044   1.919  -6.032
  144   2HE   LYS  18          1HE       LYS  18  -3.620   0.202  -6.181
  145   1HZ   LYS  18          1HZ       LYS  18  -6.059   0.983  -5.550
  146   2HZ   LYS  18          2HZ       LYS  18  -5.392   0.962  -3.987
  147   3HZ   LYS  18          3HZ       LYS  18  -5.385  -0.447  -4.937
  148    H    ILE  19           H        ILE  19  -0.485   3.499  -2.520
  149    HA   ILE  19           HA       ILE  19  -1.881   5.817  -1.452
  150    HB   ILE  19           HB       ILE  19   0.019   3.756  -0.290
  151   1HG1  ILE  19          2HG1      ILE  19  -2.192   2.971  -1.208
  152   2HG1  ILE  19          1HG1      ILE  19  -2.009   2.696   0.525
  153   1HG2  ILE  19          1HG2      ILE  19  -1.566   5.986   0.988
  154   2HG2  ILE  19          2HG2      ILE  19   0.132   5.571   1.225
  155   3HG2  ILE  19          3HG2      ILE  19  -1.131   4.536   1.894
  156   1HD1  ILE  19          1HD1      ILE  19  -3.438   5.068  -0.715
  157   2HD1  ILE  19          2HD1      ILE  19  -3.301   4.723   1.009
  158   3HD1  ILE  19          3HD1      ILE  19  -4.235   3.651  -0.034
  159    H    VAL  20           H        VAL  20   1.576   4.887  -1.146
  160    HA   VAL  20           HA       VAL  20   2.548   7.371  -0.234
  161    HB   VAL  20           HB       VAL  20   3.928   5.437  -2.116
  162   1HG1  VAL  20          1HG1      VAL  20   5.477   6.442   0.105
  163   2HG1  VAL  20          2HG1      VAL  20   4.787   7.784  -0.807
  164   3HG1  VAL  20          3HG1      VAL  20   5.794   6.588  -1.624
  165   1HG2  VAL  20          1HG2      VAL  20   3.114   3.982  -0.490
  166   2HG2  VAL  20          2HG2      VAL  20   3.129   5.217   0.767
  167   3HG2  VAL  20          3HG2      VAL  20   4.641   4.479   0.238
  168    H    GLU  21           H        GLU  21   2.234   6.199  -3.591
  169    HA   GLU  21           HA       GLU  21   3.373   8.429  -4.915
  170   1HB   GLU  21          2HB       GLU  21   2.529   6.049  -5.668
  171   2HB   GLU  21          1HB       GLU  21   1.030   6.909  -6.017
  172   1HG   GLU  21          2HG       GLU  21   2.178   8.435  -7.508
  173   2HG   GLU  21          1HG       GLU  21   3.746   7.763  -7.056
  174    H    ARG  22           H        ARG  22  -0.142   7.770  -4.504
  175    HA   ARG  22           HA       ARG  22  -1.245  10.080  -5.525
  176   1HB   ARG  22          2HB       ARG  22  -2.338   8.081  -4.386
  177   2HB   ARG  22          1HB       ARG  22  -2.019   8.889  -2.850
  178   1HG   ARG  22          2HG       ARG  22  -4.240   9.522  -3.447
  179   2HG   ARG  22          1HG       ARG  22  -3.232  10.919  -3.833
  180   1HD   ARG  22          2HD       ARG  22  -3.817  10.796  -6.017
  181   2HD   ARG  22          1HD       ARG  22  -3.334   9.088  -6.089
  182    HE   ARG  22           HE       ARG  22  -5.831   9.477  -4.641
  183   1HH1  ARG  22          1HH2      ARG  22  -4.503   7.625  -6.978
  184   2HH1  ARG  22          2HH2      ARG  22  -5.839   7.662  -8.078
  185   1HH2  ARG  22          1HH1      ARG  22  -7.505  10.190  -6.384
  186   2HH2  ARG  22          2HH1      ARG  22  -7.540   9.116  -7.743
  187    H    ARG  23           H        ARG  23  -0.048   9.778  -2.154
  188    HA   ARG  23           HA       ARG  23  -0.548  12.324  -1.185
  189   1HB   ARG  23          2HB       ARG  23   1.383  10.170  -0.776
  190   2HB   ARG  23          1HB       ARG  23   2.073  11.745  -0.389
  191   1HG   ARG  23          2HG       ARG  23   1.071  11.211   1.639
  192   2HG   ARG  23          1HG       ARG  23  -0.236  12.097   0.855
  193   1HD   ARG  23          2HD       ARG  23  -1.464  10.158   0.415
  194   2HD   ARG  23          1HD       ARG  23  -0.023   9.122   0.450
  195    HE   ARG  23           HE       ARG  23   0.068   9.559   2.931
  196   1HH1  ARG  23          1HH2      ARG  23  -2.772   8.901   1.295
  197   2HH1  ARG  23          2HH2      ARG  23  -3.835   9.328   2.595
  198   1HH2  ARG  23          1HH1      ARG  23  -1.314  10.670   4.564
  199   2HH2  ARG  23          2HH1      ARG  23  -3.009  10.332   4.447
  200    H    ARG  24           H        ARG  24   2.689  11.587  -2.523
  201    HA   ARG  24           HA       ARG  24   3.276  14.354  -3.066
  202   1HB   ARG  24          2HB       ARG  24   5.092  12.856  -2.775
  203   2HB   ARG  24          1HB       ARG  24   4.404  11.668  -3.879
  204   1HG   ARG  24          2HG       ARG  24   5.152  12.768  -5.753
  205   2HG   ARG  24          1HG       ARG  24   5.002  14.360  -5.006
  206   1HD   ARG  24          2HD       ARG  24   7.251  14.309  -4.699
  207   2HD   ARG  24          1HD       ARG  24   6.982  13.026  -3.504
  208    HE   ARG  24           HE       ARG  24   7.910  11.562  -5.097
  209   1HH1  ARG  24          1HH1      ARG  24   7.889  14.379  -6.755
  210   2HH1  ARG  24          2HH1      ARG  24   7.458  13.722  -8.297
  211   1HH2  ARG  24          1HH2      ARG  24   6.638  10.598  -7.039
  212   2HH2  ARG  24          2HH2      ARG  24   6.753  11.582  -8.459
  213    H    ALA  25           H        ALA  25   1.861  11.731  -4.978
  214    HA   ALA  25           HA       ALA  25   1.994  12.652  -7.588
  215   1HB   ALA  25          1HB       ALA  25   0.811  10.617  -6.712
  216   2HB   ALA  25          2HB       ALA  25  -0.160  11.521  -7.874
  217   3HB   ALA  25          3HB       ALA  25  -0.491  11.663  -6.149
  218    H    GLU  26           H        GLU  26   0.001  13.912  -4.929
  219    HA   GLU  26           HA       GLU  26  -1.242  15.921  -6.675
  220   1HB   GLU  26          2HB       GLU  26  -1.342  15.473  -3.676
  221   2HB   GLU  26          1HB       GLU  26  -2.450  16.480  -4.610
  222   1HG   GLU  26          2HG       GLU  26  -2.067  13.529  -5.157
  223   2HG   GLU  26          1HG       GLU  26  -3.303  14.145  -4.058
  224    H    GLY  27           H        GLY  27   1.424  15.603  -4.439
  225   1HA   GLY  27          2HA       GLY  27   3.073  17.134  -3.766
  226   2HA   GLY  27          1HA       GLY  27   2.677  18.029  -5.237
  227    H    ALA  28           H        ALA  28   0.452  17.274  -2.601
  228    HA   ALA  28           HA       ALA  28  -0.100  20.186  -2.360
  229   1HB   ALA  28          1HB       ALA  28  -1.530  17.668  -2.120
  230   2HB   ALA  28          2HB       ALA  28  -2.175  19.292  -2.360
  231   3HB   ALA  28          3HB       ALA  28  -1.839  18.709  -0.730
  232    H    LYS  29           H        LYS  29   2.334  19.015  -1.152
  233    HA   LYS  29           HA       LYS  29   2.614  20.438   1.209
  234   1HB   LYS  29          2HB       LYS  29   0.826  18.146   1.500
  235   2HB   LYS  29          1HB       LYS  29   2.178  18.064   2.629
  236   1HG   LYS  29          2HG       LYS  29   1.656  20.189   3.571
  237   2HG   LYS  29          1HG       LYS  29   0.556  20.586   2.253
  238   1HD   LYS  29          2HD       LYS  29  -1.160  19.365   3.140
  239   2HD   LYS  29          1HD       LYS  29  -0.082  18.106   3.746
  240   1HE   LYS  29          2HE       LYS  29  -0.634  19.058   5.779
  241   2HE   LYS  29          1HE       LYS  29   0.673  20.177   5.342
  242   1HZ   LYS  29          1HZ       LYS  29  -1.164  21.549   5.756
  243   2HZ   LYS  29          2HZ       LYS  29  -2.241  20.517   4.941
  244   3HZ   LYS  29          3HZ       LYS  29  -1.106  21.429   4.064
  245    H    SER  30           H        SER  30   3.969  18.697   2.926
  246    HA   SER  30           HA       SER  30   6.320  17.995   1.272
  247   1HB   SER  30          2HB       SER  30   7.127  17.519   3.751
  248   2HB   SER  30          1HB       SER  30   6.926  19.178   3.196
  249    HG   SER  30           HG       SER  30   5.774  18.096   5.240
  250    H    THR  31           H        THR  31   3.983  16.369   0.948
  251    HA   THR  31           HA       THR  31   4.465  13.872   2.451
  252    HB   THR  31           HB       THR  31   2.198  14.829   1.889
  253    HG1  THR  31           1HG      THR  31   2.510  12.592   2.275
  254   1HG2  THR  31          1HG2      THR  31   1.448  14.384  -0.498
  255   2HG2  THR  31          2HG2      THR  31   3.151  14.170  -0.904
  256   3HG2  THR  31          3HG2      THR  31   2.576  15.724  -0.297
  257    H    ASP  32           H        ASP  32   6.645  14.730   0.806
  258    HA   ASP  32           HA       ASP  32   6.559  13.195  -1.700
  259   1HB   ASP  32          2HB       ASP  32   7.714  15.310  -1.636
  260   2HB   ASP  32          1HB       ASP  32   8.643  14.819  -0.220
  261    H    VAL  33           H        VAL  33   6.432  11.950   1.138
  262    HA   VAL  33           HA       VAL  33   8.771  10.497   1.759
  263    HB   VAL  33           HB       VAL  33   6.432  10.795   2.890
  264   1HG1  VAL  33          1HG1      VAL  33   5.876   8.091   1.734
  265   2HG1  VAL  33          2HG1      VAL  33   5.446   9.516   0.792
  266   3HG1  VAL  33          3HG1      VAL  33   4.753   9.277   2.395
  267   1HG2  VAL  33          1HG2      VAL  33   6.952   8.096   3.558
  268   2HG2  VAL  33          2HG2      VAL  33   7.534   9.536   4.394
  269   3HG2  VAL  33          3HG2      VAL  33   8.507   8.804   3.120
  270    H    SER  34           H        SER  34   7.954   7.759   1.570
  271    HA   SER  34           HA       SER  34   7.532   7.132  -1.277
  272   1HB   SER  34          2HB       SER  34  10.058   7.768  -0.498
  273   2HB   SER  34          1HB       SER  34  10.060   6.038  -0.168
  274    HG   SER  34           HG       SER  34   9.564   5.645  -2.285
  275    H    PHE  35           H        PHE  35   8.035   4.574  -1.475
  276    HA   PHE  35           HA       PHE  35   6.226   3.224   0.277
  277   1HB   PHE  35          2HB       PHE  35   6.974   2.625  -2.079
  278   2HB   PHE  35          1HB       PHE  35   8.475   2.029  -1.366
  279    HD1  PHE  35           1HD      PHE  35   8.264   0.295   0.554
  280    HD2  PHE  35           2HD      PHE  35   5.086   1.232  -2.177
  281    HE1  PHE  35           1HE      PHE  35   7.147  -1.846   1.119
  282    HE2  PHE  35           2HE      PHE  35   3.969  -0.907  -1.614
  283    HZ   PHE  35           HZ       PHE  35   4.999  -2.447   0.036
  284    H    SER  36           H        SER  36   9.800   2.955   0.066
  285    HA   SER  36           HA       SER  36  10.363   1.259   2.171
  286   1HB   SER  36          2HB       SER  36  12.301   2.010   1.221
  287   2HB   SER  36          1HB       SER  36  11.617   3.595   0.870
  288    HG   SER  36           HG       SER  36  13.335   3.105   2.694
  289    H    SER  37           H        SER  37   9.560   4.725   2.428
  290    HA   SER  37           HA       SER  37   9.766   4.734   5.346
  291   1HB   SER  37          2HB       SER  37   9.490   6.569   3.134
  292   2HB   SER  37          1HB       SER  37   8.294   6.951   4.369
  293    HG   SER  37           HG       SER  37  10.809   7.585   4.394
  294    H    ILE  38           H        ILE  38   7.065   4.985   2.996
  295    HA   ILE  38           HA       ILE  38   4.978   4.963   4.974
  296    HB   ILE  38           HB       ILE  38   5.079   4.203   2.038
  297   1HG1  ILE  38          2HG1      ILE  38   5.794   6.538   2.744
  298   2HG1  ILE  38          1HG1      ILE  38   4.425   6.482   1.634
  299   1HG2  ILE  38          1HG2      ILE  38   2.557   5.152   2.546
  300   2HG2  ILE  38          2HG2      ILE  38   2.898   4.242   4.018
  301   3HG2  ILE  38          3HG2      ILE  38   2.980   3.442   2.447
  302   1HD1  ILE  38          1HD1      ILE  38   2.858   6.896   3.378
  303   2HD1  ILE  38          2HD1      ILE  38   4.177   8.034   3.658
  304   3HD1  ILE  38          3HD1      ILE  38   4.055   6.568   4.631
  305    H    SER  39           H        SER  39   6.965   2.438   3.672
  306    HA   SER  39           HA       SER  39   5.104   0.239   4.055
  307   1HB   SER  39          2HB       SER  39   6.799  -0.287   2.577
  308   2HB   SER  39          1HB       SER  39   7.989   0.681   3.442
  309    HG   SER  39           HG       SER  39   7.002  -1.900   4.040
  310    H    THR  40           H        THR  40   8.195   0.790   5.767
  311    HA   THR  40           HA       THR  40   7.889  -0.835   7.960
  312    HB   THR  40           HB       THR  40   9.835   0.586   7.481
  313    HG1  THR  40           1HG      THR  40   8.926   1.489   9.970
  314   1HG2  THR  40          1HG2      THR  40   8.384   2.944   8.641
  315   2HG2  THR  40          2HG2      THR  40   8.222   2.574   6.925
  316   3HG2  THR  40          3HG2      THR  40   9.812   2.916   7.606
  317    H    MET  41           H        MET  41   6.463   2.432   7.635
  318    HA   MET  41           HA       MET  41   5.234   2.397  10.264
  319   1HB   MET  41          2HB       MET  41   4.204   4.454   9.463
  320   2HB   MET  41          1HB       MET  41   5.875   4.406   8.900
  321   1HG   MET  41          2HG       MET  41   5.241   3.848   6.695
  322   2HG   MET  41          1HG       MET  41   3.629   3.339   7.194
  323   1HE   MET  41          1HE       MET  41   1.769   5.203   5.894
  324   2HE   MET  41          2HE       MET  41   1.449   6.067   7.395
  325   3HE   MET  41          3HE       MET  41   1.870   4.357   7.445
  326    H    LEU  42           H        LEU  42   4.271   1.281   7.073
  327    HA   LEU  42           HA       LEU  42   1.433   1.128   7.534
  328   1HB   LEU  42          2HB       LEU  42   3.421   0.445   5.552
  329   2HB   LEU  42          1HB       LEU  42   2.283  -0.888   5.733
  330    HG   LEU  42           HG       LEU  42   1.652   0.928   4.038
  331   1HD1  LEU  42          1HD1      LEU  42   0.113  -0.591   5.869
  332   2HD1  LEU  42          2HD1      LEU  42  -0.402   0.051   4.308
  333   3HD1  LEU  42          3HD1      LEU  42  -0.646   0.999   5.774
  334   1HD2  LEU  42          1HD2      LEU  42   0.423   2.569   6.115
  335   2HD2  LEU  42          2HD2      LEU  42   1.382   3.067   4.722
  336   3HD2  LEU  42          3HD2      LEU  42   2.183   2.589   6.220
  337    H    LEU  43           H        LEU  43   3.963  -1.427   7.655
  338    HA   LEU  43           HA       LEU  43   2.203  -3.468   8.658
  339   1HB   LEU  43          2HB       LEU  43   4.285  -4.000   7.556
  340   2HB   LEU  43          1HB       LEU  43   5.206  -3.055   8.728
  341    HG   LEU  43           HG       LEU  43   3.699  -4.852  10.269
  342   1HD1  LEU  43          1HD1      LEU  43   5.104  -6.358   8.050
  343   2HD1  LEU  43          2HD1      LEU  43   3.365  -6.061   8.045
  344   3HD1  LEU  43          3HD1      LEU  43   4.093  -7.020   9.334
  345   1HD2  LEU  43          1HD2      LEU  43   6.181  -5.970  10.202
  346   2HD2  LEU  43          2HD2      LEU  43   5.796  -4.515  11.121
  347   3HD2  LEU  43          3HD2      LEU  43   6.533  -4.379   9.525
  348    H    GLU  44           H        GLU  44   4.394  -1.169  10.292
  349    HA   GLU  44           HA       GLU  44   4.150  -2.196  12.937
  350   1HB   GLU  44          2HB       GLU  44   4.559   0.582  11.787
  351   2HB   GLU  44          1HB       GLU  44   4.722   0.224  13.507
  352   1HG   GLU  44          2HG       GLU  44   6.201  -1.523  11.591
  353   2HG   GLU  44          1HG       GLU  44   6.818   0.109  11.850
  354    H    LEU  45           H        LEU  45   2.031  -0.255  10.949
  355    HA   LEU  45           HA       LEU  45   0.158   0.214  13.218
  356   1HB   LEU  45          2HB       LEU  45   0.971   1.522  10.752
  357   2HB   LEU  45          1HB       LEU  45  -0.784   1.352  10.823
  358    HG   LEU  45           HG       LEU  45   0.461   2.211  13.355
  359   1HD1  LEU  45          1HD1      LEU  45   0.924   3.654  10.801
  360   2HD1  LEU  45          2HD1      LEU  45   1.849   3.695  12.303
  361   3HD1  LEU  45          3HD1      LEU  45   0.366   4.638  12.155
  362   1HD2  LEU  45          1HD2      LEU  45  -1.583   3.883  12.081
  363   2HD2  LEU  45          2HD2      LEU  45  -1.615   3.074  13.648
  364   3HD2  LEU  45          3HD2      LEU  45  -2.057   2.188  12.188
  365    H    GLY  46           H        GLY  46   0.732  -2.236  11.109
  366   1HA   GLY  46          2HA       GLY  46  -0.597  -3.952  10.217
  367   2HA   GLY  46          1HA       GLY  46  -1.805  -3.480  11.414
  368    H    LEU  47           H        LEU  47  -0.639  -1.160   9.100
  369    HA   LEU  47           HA       LEU  47  -1.668  -0.143   7.233
  370   1HB   LEU  47          2HB       LEU  47  -3.563  -2.507   7.289
  371   2HB   LEU  47          1HB       LEU  47  -3.099  -1.526   5.902
  372    HG   LEU  47           HG       LEU  47  -0.786  -2.718   7.244
  373   1HD1  LEU  47          1HD1      LEU  47  -1.269  -5.020   6.372
  374   2HD1  LEU  47          2HD1      LEU  47  -2.930  -4.510   6.065
  375   3HD1  LEU  47          3HD1      LEU  47  -2.309  -4.553   7.716
  376   1HD2  LEU  47          1HD2      LEU  47  -1.543  -1.781   4.715
  377   2HD2  LEU  47          2HD2      LEU  47  -1.345  -3.521   4.502
  378   3HD2  LEU  47          3HD2      LEU  47  -0.011  -2.552   5.129
  379    H    ARG  48           H        ARG  48  -3.042  -0.551  10.214
  380    HA   ARG  48           HA       ARG  48  -5.756   0.368   9.718
  381   1HB   ARG  48          2HB       ARG  48  -4.926  -0.958  11.689
  382   2HB   ARG  48          1HB       ARG  48  -4.055   0.477  12.229
  383   1HG   ARG  48          2HG       ARG  48  -5.998   1.628  12.766
  384   2HG   ARG  48          1HG       ARG  48  -6.977   0.719  11.614
  385   1HD   ARG  48          2HD       ARG  48  -5.990  -1.187  13.463
  386   2HD   ARG  48          1HD       ARG  48  -6.577   0.186  14.421
  387    HE   ARG  48           HE       ARG  48  -8.389  -0.474  12.250
  388   1HH1  ARG  48          1HH1      ARG  48  -8.174  -0.061  15.529
  389   2HH1  ARG  48          2HH1      ARG  48  -9.331  -1.275  15.959
  390   1HH2  ARG  48          1HH2      ARG  48  -9.551  -2.577  12.753
  391   2HH2  ARG  48          2HH2      ARG  48 -10.112  -2.699  14.388
  392    H    VAL  49           H        VAL  49  -2.679   1.918   9.857
  393    HA   VAL  49           HA       VAL  49  -3.081   4.415  10.963
  394    HB   VAL  49           HB       VAL  49  -0.971   3.958  10.060
  395   1HG1  VAL  49          1HG1      VAL  49  -1.001   2.281   8.532
  396   2HG1  VAL  49          2HG1      VAL  49  -1.069   3.583   7.345
  397   3HG1  VAL  49          3HG1      VAL  49  -2.554   2.787   7.868
  398   1HG2  VAL  49          1HG2      VAL  49  -1.550   5.520   7.671
  399   2HG2  VAL  49          2HG2      VAL  49  -0.591   5.954   9.085
  400   3HG2  VAL  49          3HG2      VAL  49  -2.338   6.195   9.097
  401    H    TYR  50           H        TYR  50  -3.190   4.589   7.440
  402    HA   TYR  50           HA       TYR  50  -5.124   6.671   7.399
  403   1HB   TYR  50          2HB       TYR  50  -5.277   5.921   4.940
  404   2HB   TYR  50          1HB       TYR  50  -3.671   6.339   5.537
  405    HD1  TYR  50           1HD      TYR  50  -5.974   3.415   5.119
  406    HD2  TYR  50           2HD      TYR  50  -1.915   4.798   5.357
  407    HE1  TYR  50           1HE      TYR  50  -5.166   1.141   4.547
  408    HE2  TYR  50           2HE      TYR  50  -1.106   2.523   4.786
  409    HH   TYR  50           HH       TYR  50  -2.576   0.357   3.355
  410    H    GLU  51           H        GLU  51  -5.493   3.156   7.331
  411    HA   GLU  51           HA       GLU  51  -8.192   2.987   6.478
  412   1HB   GLU  51          2HB       GLU  51  -6.158   1.320   7.123
  413   2HB   GLU  51          1HB       GLU  51  -7.160   1.145   8.560
  414   1HG   GLU  51          2HG       GLU  51  -8.767   1.117   6.142
  415   2HG   GLU  51          1HG       GLU  51  -7.530  -0.138   6.105
  416    H    ALA  52           H        ALA  52  -6.800   4.076   9.478
  417    HA   ALA  52           HA       ALA  52  -9.102   3.576  11.174
  418   1HB   ALA  52          1HB       ALA  52  -6.756   3.879  11.945
  419   2HB   ALA  52          2HB       ALA  52  -7.847   5.029  12.720
  420   3HB   ALA  52          3HB       ALA  52  -6.808   5.554  11.394
  421    H    GLN  53           H        GLN  53  -7.752   6.671   9.968
  422    HA   GLN  53           HA       GLN  53 -10.020   8.262  10.588
  423   1HB   GLN  53          2HB       GLN  53  -7.749   8.441   8.605
  424   2HB   GLN  53          1HB       GLN  53  -8.938   9.735   8.762
  425   1HG   GLN  53          2HG       GLN  53  -7.623   8.670  11.237
  426   2HG   GLN  53          1HG       GLN  53  -6.723   9.783  10.206
  427   1HE2  GLN  53          1HE2      GLN  53  -7.480  11.994  10.049
  428   2HE2  GLN  53          2HE2      GLN  53  -8.682  12.607  11.079
  429    H    MET  54           H        MET  54  -9.434   6.044   7.965
  430    HA   MET  54           HA       MET  54 -10.789   5.402   6.140
  431   1HB   MET  54          2HB       MET  54 -12.884   6.807   7.832
  432   2HB   MET  54          1HB       MET  54 -13.184   5.571   6.609
  433   1HG   MET  54          2HG       MET  54 -11.226   4.790   8.672
  434   2HG   MET  54          1HG       MET  54 -12.862   5.048   9.280
  435   1HE   MET  54          1HE       MET  54 -14.919   2.266   8.202
  436   2HE   MET  54          2HE       MET  54 -14.922   4.008   8.458
  437   3HE   MET  54          3HE       MET  54 -14.171   2.952   9.650
  438    H    GLU  55           H        GLU  55  -9.361   7.854   5.822
  439    HA   GLU  55           HA       GLU  55 -11.086   9.985   4.880
  440   1HB   GLU  55          2HB       GLU  55  -8.405   9.583   5.507
  441   2HB   GLU  55          1HB       GLU  55  -8.382   9.836   3.761
  442   1HG   GLU  55          2HG       GLU  55  -8.637  12.044   4.096
  443   2HG   GLU  55          1HG       GLU  55 -10.197  11.730   4.858
  444    H    ARG  56           H        ARG  56 -10.348  10.708   2.410
  445    HA   ARG  56           HA       ARG  56 -10.395   8.404   0.560
  446   1HB   ARG  56          2HB       ARG  56 -12.558   9.033  -0.381
  447   2HB   ARG  56          1HB       ARG  56 -12.745   8.799   1.356
  448   1HG   ARG  56          2HG       ARG  56 -12.136  11.408   1.378
  449   2HG   ARG  56          1HG       ARG  56 -12.840  11.317  -0.238
  450   1HD   ARG  56          2HD       ARG  56 -14.750   9.962   1.015
  451   2HD   ARG  56          1HD       ARG  56 -14.150  10.864   2.422
  452    HE   ARG  56           HE       ARG  56 -14.661  12.399  -0.067
  453   1HH1  ARG  56          1HH1      ARG  56 -14.516  12.661   3.215
  454   2HH1  ARG  56          2HH1      ARG  56 -16.028  13.480   3.424
  455   1HH2  ARG  56          1HH2      ARG  56 -17.063  12.961   0.156
  456   2HH2  ARG  56          2HH2      ARG  56 -17.470  13.651   1.691
  Start of MODEL   20
    1   1H    ALA   2          1H        ALA   2  -8.503 -18.402 -15.185
    2   2H    ALA   2          2H        ALA   2  -9.495 -19.778 -15.277
    3   3H    ALA   2          3H        ALA   2  -8.263 -19.537 -16.421
    4    HA   ALA   2           HA       ALA   2  -7.959 -20.220 -13.545
    5   1HB   ALA   2          1HB       ALA   2  -8.165 -21.622 -16.009
    6   2HB   ALA   2          2HB       ALA   2  -7.779 -22.292 -14.424
    7   3HB   ALA   2          3HB       ALA   2  -6.484 -21.749 -15.490
    8    H    LYS   3           H        LYS   3  -6.206 -19.258 -12.597
    9    HA   LYS   3           HA       LYS   3  -3.664 -18.976 -13.993
   10   1HB   LYS   3          2HB       LYS   3  -5.182 -17.114 -14.855
   11   2HB   LYS   3          1HB       LYS   3  -5.138 -16.445 -13.224
   12   1HG   LYS   3          2HG       LYS   3  -2.508 -16.763 -13.567
   13   2HG   LYS   3          1HG       LYS   3  -2.964 -16.610 -15.264
   14   1HD   LYS   3          2HD       LYS   3  -4.423 -14.591 -14.078
   15   2HD   LYS   3          1HD       LYS   3  -2.922 -14.571 -13.149
   16   1HE   LYS   3          2HE       LYS   3  -1.595 -14.220 -15.109
   17   2HE   LYS   3          1HE       LYS   3  -2.955 -14.605 -16.183
   18   1HZ   LYS   3          1HZ       LYS   3  -2.918 -12.276 -16.074
   19   2HZ   LYS   3          2HZ       LYS   3  -2.638 -12.263 -14.399
   20   3HZ   LYS   3          3HZ       LYS   3  -4.154 -12.729 -15.005
   21    H    VAL   4           H        VAL   4  -2.337 -19.562 -12.321
   22    HA   VAL   4           HA       VAL   4  -2.941 -19.461  -9.558
   23    HB   VAL   4           HB       VAL   4  -0.373 -19.477 -11.160
   24   1HG1  VAL   4          1HG1      VAL   4   0.783 -20.104  -9.077
   25   2HG1  VAL   4          2HG1      VAL   4  -0.713 -19.881  -8.171
   26   3HG1  VAL   4          3HG1      VAL   4   0.072 -18.497  -8.932
   27   1HG2  VAL   4          1HG2      VAL   4  -0.610 -21.739 -11.145
   28   2HG2  VAL   4          2HG2      VAL   4  -2.297 -21.405 -10.753
   29   3HG2  VAL   4          3HG2      VAL   4  -1.145 -21.760  -9.465
   30    H    GLN   5           H        GLN   5  -3.224 -17.672  -8.286
   31    HA   GLN   5           HA       GLN   5  -1.840 -15.137  -9.064
   32   1HB   GLN   5          2HB       GLN   5  -4.491 -15.910  -8.155
   33   2HB   GLN   5          1HB       GLN   5  -3.808 -14.637  -7.145
   34   1HG   GLN   5          2HG       GLN   5  -3.199 -13.988  -9.848
   35   2HG   GLN   5          1HG       GLN   5  -4.909 -14.409  -9.783
   36   1HE2  GLN   5          1HE2      GLN   5  -5.469 -12.100 -10.091
   37   2HE2  GLN   5          2HE2      GLN   5  -5.322 -11.004  -8.803
   38    H    ALA   6           H        ALA   6  -0.783 -17.405  -7.467
   39    HA   ALA   6           HA       ALA   6   0.659 -17.628  -5.596
   40   1HB   ALA   6          1HB       ALA   6   0.247 -14.819  -4.762
   41   2HB   ALA   6          2HB       ALA   6   0.772 -15.022  -6.434
   42   3HB   ALA   6          3HB       ALA   6   1.747 -15.675  -5.116
   43    H    TYR   7           H        TYR   7  -0.092 -18.661  -3.791
   44    HA   TYR   7           HA       TYR   7  -2.689 -18.354  -2.684
   45   1HB   TYR   7          2HB       TYR   7  -0.077 -19.406  -1.561
   46   2HB   TYR   7          1HB       TYR   7  -1.644 -19.653  -0.788
   47    HD1  TYR   7           1HD      TYR   7   0.588 -21.465  -2.458
   48    HD2  TYR   7           2HD      TYR   7  -3.454 -20.127  -3.014
   49    HE1  TYR   7           1HE      TYR   7   0.155 -23.396  -3.953
   50    HE2  TYR   7           2HE      TYR   7  -3.887 -22.057  -4.510
   51    HH   TYR   7           HH       TYR   7  -1.329 -24.442  -5.218
   52    H    VAL   8           H        VAL   8  -3.477 -16.638  -1.555
   53    HA   VAL   8           HA       VAL   8  -3.429 -14.542  -0.412
   54    HB   VAL   8           HB       VAL   8  -2.564 -15.039   1.935
   55   1HG1  VAL   8          1HG1      VAL   8  -4.274 -17.302   0.931
   56   2HG1  VAL   8          2HG1      VAL   8  -4.879 -15.647   0.884
   57   3HG1  VAL   8          3HG1      VAL   8  -4.424 -16.376   2.424
   58   1HG2  VAL   8          1HG2      VAL   8  -0.780 -16.630   1.139
   59   2HG2  VAL   8          2HG2      VAL   8  -2.055 -17.779   0.736
   60   3HG2  VAL   8          3HG2      VAL   8  -1.803 -17.292   2.411
   61    H    SER   9           H        SER   9  -1.873 -13.500  -1.963
   62    HA   SER   9           HA       SER   9   0.922 -13.313  -0.926
   63   1HB   SER   9          2HB       SER   9   0.922 -13.821  -3.216
   64   2HB   SER   9          1HB       SER   9  -0.497 -12.826  -3.535
   65    HG   SER   9           HG       SER   9   2.155 -11.998  -2.966
   66    H    ASP  10           H        ASP  10   1.789 -11.267  -0.357
   67    HA   ASP  10           HA       ASP  10   0.063  -9.326   0.787
   68   1HB   ASP  10          2HB       ASP  10   2.812  -9.904   0.569
   69   2HB   ASP  10          1HB       ASP  10   2.628  -8.258  -0.039
   70    H    GLU  11           H        GLU  11  -1.456  -9.050  -1.125
   71    HA   GLU  11           HA       GLU  11  -0.616  -7.802  -3.570
   72   1HB   GLU  11          2HB       GLU  11  -2.744  -8.997  -3.238
   73   2HB   GLU  11          1HB       GLU  11  -3.256  -7.779  -2.071
   74   1HG   GLU  11          2HG       GLU  11  -2.850  -6.076  -3.986
   75   2HG   GLU  11          1HG       GLU  11  -2.876  -7.485  -5.047
   76    H    ILE  12           H        ILE  12  -0.959  -6.581  -0.366
   77    HA   ILE  12           HA       ILE  12  -1.663  -3.852  -0.922
   78    HB   ILE  12           HB       ILE  12  -0.199  -5.306   1.288
   79   1HG1  ILE  12          2HG1      ILE  12  -2.916  -3.959   1.136
   80   2HG1  ILE  12          1HG1      ILE  12  -2.637  -5.696   1.006
   81   1HG2  ILE  12          1HG2      ILE  12  -0.351  -2.432   0.755
   82   2HG2  ILE  12          2HG2      ILE  12   0.645  -3.304   1.920
   83   3HG2  ILE  12          3HG2      ILE  12  -1.016  -2.867   2.329
   84   1HD1  ILE  12          1HD1      ILE  12  -1.793  -4.035   3.396
   85   2HD1  ILE  12          2HD1      ILE  12  -1.765  -5.793   3.258
   86   3HD1  ILE  12          3HD1      ILE  12  -3.305  -4.936   3.316
   87    H    VAL  13           H        VAL  13   1.397  -5.613  -0.986
   88    HA   VAL  13           HA       VAL  13   3.333  -3.634  -0.882
   89    HB   VAL  13           HB       VAL  13   3.793  -6.003  -1.226
   90   1HG1  VAL  13          1HG1      VAL  13   3.013  -7.242  -3.008
   91   2HG1  VAL  13          2HG1      VAL  13   3.054  -5.867  -4.113
   92   3HG1  VAL  13          3HG1      VAL  13   1.739  -6.024  -2.949
   93   1HG2  VAL  13          1HG2      VAL  13   4.740  -4.370  -3.603
   94   2HG2  VAL  13          2HG2      VAL  13   5.499  -5.841  -2.996
   95   3HG2  VAL  13          3HG2      VAL  13   5.496  -4.380  -2.008
   96    H    TYR  14           H        TYR  14   1.174  -4.357  -3.618
   97    HA   TYR  14           HA       TYR  14   2.384  -2.456  -5.438
   98   1HB   TYR  14          2HB       TYR  14   1.000  -4.467  -6.018
   99   2HB   TYR  14          1HB       TYR  14  -0.413  -3.635  -5.371
  100    HD1  TYR  14           1HD      TYR  14  -1.661  -2.193  -6.741
  101    HD2  TYR  14           2HD      TYR  14   2.357  -3.226  -7.856
  102    HE1  TYR  14           1HE      TYR  14  -1.958  -1.018  -8.903
  103    HE2  TYR  14           2HE      TYR  14   2.059  -2.050 -10.019
  104    HH   TYR  14           HH       TYR  14   0.719  -0.459 -11.075
  105    H    LYS  15           H        LYS  15  -0.417  -2.337  -3.230
  106    HA   LYS  15           HA       LYS  15  -1.315   0.287  -4.011
  107   1HB   LYS  15          2HB       LYS  15  -1.615  -1.374  -1.487
  108   2HB   LYS  15          1HB       LYS  15  -2.541   0.090  -1.818
  109   1HG   LYS  15          2HG       LYS  15  -3.627  -0.890  -3.692
  110   2HG   LYS  15          1HG       LYS  15  -2.478  -2.227  -3.755
  111   1HD   LYS  15          2HD       LYS  15  -4.195  -3.304  -2.665
  112   2HD   LYS  15          1HD       LYS  15  -3.391  -2.604  -1.260
  113   1HE   LYS  15          2HE       LYS  15  -4.933  -0.708  -1.262
  114   2HE   LYS  15          1HE       LYS  15  -5.692  -1.294  -2.755
  115   1HZ   LYS  15          1HZ       LYS  15  -5.465  -2.956  -0.311
  116   2HZ   LYS  15          2HZ       LYS  15  -6.418  -3.249  -1.687
  117   3HZ   LYS  15          3HZ       LYS  15  -6.820  -1.985  -0.626
  118    H    ILE  16           H        ILE  16   0.852  -0.866  -1.419
  119    HA   ILE  16           HA       ILE  16   1.294   1.407   0.093
  120    HB   ILE  16           HB       ILE  16   3.225  -0.640  -1.032
  121   1HG1  ILE  16          2HG1      ILE  16   1.825  -0.353   1.646
  122   2HG1  ILE  16          1HG1      ILE  16   1.424  -1.527   0.392
  123   1HG2  ILE  16          1HG2      ILE  16   4.428   1.414  -0.312
  124   2HG2  ILE  16          2HG2      ILE  16   4.777   0.040   0.739
  125   3HG2  ILE  16          3HG2      ILE  16   3.652   1.293   1.268
  126   1HD1  ILE  16          1HD1      ILE  16   3.040  -2.921   1.105
  127   2HD1  ILE  16          2HD1      ILE  16   3.310  -1.836   2.469
  128   3HD1  ILE  16          3HD1      ILE  16   4.249  -1.643   0.988
  129    H    ASN  17           H        ASN  17   2.860   0.671  -3.044
  130    HA   ASN  17           HA       ASN  17   4.342   3.157  -3.151
  131   1HB   ASN  17          2HB       ASN  17   4.164   0.699  -4.517
  132   2HB   ASN  17          1HB       ASN  17   3.773   1.930  -5.718
  133   1HD2  ASN  17          1HD2      ASN  17   6.348   0.231  -5.001
  134   2HD2  ASN  17          2HD2      ASN  17   7.580   1.398  -5.053
  135    H    LYS  18           H        LYS  18   1.070   2.261  -3.941
  136    HA   LYS  18           HA       LYS  18   0.566   4.397  -5.853
  137   1HB   LYS  18          2HB       LYS  18  -0.760   2.139  -4.630
  138   2HB   LYS  18          1HB       LYS  18  -1.821   3.547  -4.590
  139   1HG   LYS  18          2HG       LYS  18  -2.053   3.597  -6.855
  140   2HG   LYS  18          1HG       LYS  18  -0.368   3.160  -7.134
  141   1HD   LYS  18          2HD       LYS  18  -1.122   1.103  -7.687
  142   2HD   LYS  18          1HD       LYS  18  -1.467   0.876  -5.972
  143   1HE   LYS  18          2HE       LYS  18  -3.528   2.413  -7.441
  144   2HE   LYS  18          1HE       LYS  18  -3.378   0.708  -7.916
  145   1HZ   LYS  18          1HZ       LYS  18  -4.735   0.582  -6.065
  146   2HZ   LYS  18          2HZ       LYS  18  -3.941   1.846  -5.254
  147   3HZ   LYS  18          3HZ       LYS  18  -3.204   0.322  -5.386
  148    H    ILE  19           H        ILE  19   0.487   4.112  -2.351
  149    HA   ILE  19           HA       ILE  19  -1.127   6.498  -1.899
  150    HB   ILE  19           HB       ILE  19   0.649   4.702  -0.237
  151   1HG1  ILE  19          2HG1      ILE  19  -2.291   5.213   0.129
  152   2HG1  ILE  19          1HG1      ILE  19  -1.748   4.128  -1.151
  153   1HG2  ILE  19          1HG2      ILE  19  -0.709   6.073   1.636
  154   2HG2  ILE  19          2HG2      ILE  19  -0.559   7.344   0.422
  155   3HG2  ILE  19          3HG2      ILE  19   0.886   6.575   1.076
  156   1HD1  ILE  19          1HD1      ILE  19  -1.826   2.556   0.499
  157   2HD1  ILE  19          2HD1      ILE  19  -1.693   3.756   1.785
  158   3HD1  ILE  19          3HD1      ILE  19  -0.249   3.220   0.927
  159    H    VAL  20           H        VAL  20   2.367   5.754  -1.577
  160    HA   VAL  20           HA       VAL  20   3.233   8.354  -0.826
  161    HB   VAL  20           HB       VAL  20   4.699   6.361  -2.578
  162   1HG1  VAL  20          1HG1      VAL  20   6.245   8.018  -2.303
  163   2HG1  VAL  20          2HG1      VAL  20   6.457   7.281  -0.715
  164   3HG1  VAL  20          3HG1      VAL  20   5.417   8.694  -0.900
  165   1HG2  VAL  20          1HG2      VAL  20   4.357   4.847  -0.938
  166   2HG2  VAL  20          2HG2      VAL  20   3.584   6.049   0.095
  167   3HG2  VAL  20          3HG2      VAL  20   5.339   5.876   0.103
  168    H    GLU  21           H        GLU  21   3.058   6.876  -4.085
  169    HA   GLU  21           HA       GLU  21   3.968   9.115  -5.568
  170   1HB   GLU  21          2HB       GLU  21   3.480   6.637  -6.193
  171   2HB   GLU  21          1HB       GLU  21   1.836   7.198  -6.500
  172   1HG   GLU  21          2HG       GLU  21   3.210   9.107  -7.830
  173   2HG   GLU  21          1HG       GLU  21   4.337   7.760  -8.003
  174    H    ARG  22           H        ARG  22   0.565   8.095  -5.018
  175    HA   ARG  22           HA       ARG  22  -0.768  10.219  -6.233
  176   1HB   ARG  22          2HB       ARG  22  -1.489   8.070  -4.823
  177   2HB   ARG  22          1HB       ARG  22  -1.684   9.271  -3.544
  178   1HG   ARG  22          2HG       ARG  22  -3.447  10.300  -4.590
  179   2HG   ARG  22          1HG       ARG  22  -2.816   9.972  -6.204
  180   1HD   ARG  22          2HD       ARG  22  -3.342   7.443  -5.498
  181   2HD   ARG  22          1HD       ARG  22  -4.534   8.254  -4.462
  182    HE   ARG  22           HE       ARG  22  -4.532   8.254  -7.407
  183   1HH1  ARG  22          1HH1      ARG  22  -6.847   8.038  -5.337
  184   2HH1  ARG  22          2HH1      ARG  22  -7.674   9.526  -5.655
  185   1HH2  ARG  22          1HH2      ARG  22  -5.050  10.907  -7.453
  186   2HH2  ARG  22          2HH2      ARG  22  -6.657  11.150  -6.853
  187    H    ARG  23           H        ARG  23   0.398  10.137  -2.841
  188    HA   ARG  23           HA       ARG  23  -0.459  12.677  -2.014
  189   1HB   ARG  23          2HB       ARG  23   1.673  10.739  -1.352
  190   2HB   ARG  23          1HB       ARG  23   1.999  12.391  -0.827
  191   1HG   ARG  23          2HG       ARG  23   0.804  11.193   0.939
  192   2HG   ARG  23          1HG       ARG  23  -0.236  12.451   0.272
  193   1HD   ARG  23          2HD       ARG  23  -1.151  10.613  -1.303
  194   2HD   ARG  23          1HD       ARG  23  -0.381   9.465  -0.187
  195    HE   ARG  23           HE       ARG  23  -1.691  10.971   1.596
  196   1HH1  ARG  23          1HH2      ARG  23  -3.144  11.812  -1.106
  197   2HH1  ARG  23          2HH2      ARG  23  -4.620  10.933  -0.896
  198   1HH2  ARG  23          1HH1      ARG  23  -3.407   8.993   1.708
  199   2HH2  ARG  23          2HH1      ARG  23  -4.770   9.337   0.697
  200    H    ARG  24           H        ARG  24   2.923  12.068  -3.053
  201    HA   ARG  24           HA       ARG  24   3.457  14.843  -3.554
  202   1HB   ARG  24          2HB       ARG  24   5.227  13.250  -3.121
  203   2HB   ARG  24          1HB       ARG  24   4.730  12.249  -4.486
  204   1HG   ARG  24          2HG       ARG  24   5.462  13.858  -6.073
  205   2HG   ARG  24          1HG       ARG  24   5.578  15.124  -4.851
  206   1HD   ARG  24          2HD       ARG  24   7.824  14.227  -5.473
  207   2HD   ARG  24          1HD       ARG  24   7.448  13.908  -3.767
  208    HE   ARG  24           HE       ARG  24   6.574  11.797  -5.609
  209   1HH1  ARG  24          1HH2      ARG  24   9.295  13.109  -3.975
  210   2HH1  ARG  24          2HH2      ARG  24   9.963  11.567  -3.559
  211   1HH2  ARG  24          1HH1      ARG  24   7.324   9.762  -4.904
  212   2HH2  ARG  24          2HH1      ARG  24   8.848   9.671  -4.085
  213    H    ALA  25           H        ALA  25   2.156  12.243  -5.559
  214    HA   ALA  25           HA       ALA  25   2.470  13.206  -8.154
  215   1HB   ALA  25          1HB       ALA  25   0.408  11.714  -6.613
  216   2HB   ALA  25          2HB       ALA  25   1.242  11.258  -8.099
  217   3HB   ALA  25          3HB       ALA  25  -0.123  12.372  -8.160
  218    H    GLU  26           H        GLU  26  -0.040  14.172  -5.790
  219    HA   GLU  26           HA       GLU  26  -1.009  16.330  -7.499
  220   1HB   GLU  26          2HB       GLU  26  -1.495  15.709  -4.569
  221   2HB   GLU  26          1HB       GLU  26  -2.508  16.716  -5.603
  222   1HG   GLU  26          2HG       GLU  26  -2.395  14.419  -7.076
  223   2HG   GLU  26          1HG       GLU  26  -2.331  13.772  -5.435
  224    H    GLY  27           H        GLY  27   1.468  15.909  -5.132
  225   1HA   GLY  27          2HA       GLY  27   3.034  17.402  -4.230
  226   2HA   GLY  27          1HA       GLY  27   2.572  18.516  -5.519
  227    H    ALA  28           H        ALA  28   0.170  17.272  -3.328
  228    HA   ALA  28           HA       ALA  28  -0.092  20.024  -2.167
  229   1HB   ALA  28          1HB       ALA  28  -1.973  19.324  -3.524
  230   2HB   ALA  28          2HB       ALA  28  -2.482  19.271  -1.836
  231   3HB   ALA  28          3HB       ALA  28  -2.064  17.779  -2.679
  232    H    LYS  29           H        LYS  29   1.752  18.137  -1.013
  233    HA   LYS  29           HA       LYS  29   0.955  18.235   1.742
  234   1HB   LYS  29          2HB       LYS  29  -0.498  16.397   0.449
  235   2HB   LYS  29          1HB       LYS  29   0.926  15.408   0.771
  236   1HG   LYS  29          2HG       LYS  29   0.353  15.179   2.933
  237   2HG   LYS  29          1HG       LYS  29   0.218  16.927   3.126
  238   1HD   LYS  29          2HD       LYS  29  -2.007  15.961   1.571
  239   2HD   LYS  29          1HD       LYS  29  -1.892  15.039   3.070
  240   1HE   LYS  29          2HE       LYS  29  -1.622  17.323   4.251
  241   2HE   LYS  29          1HE       LYS  29  -2.217  18.027   2.734
  242   1HZ   LYS  29          1HZ       LYS  29  -3.941  16.070   2.980
  243   2HZ   LYS  29          2HZ       LYS  29  -4.199  17.574   3.728
  244   3HZ   LYS  29          3HZ       LYS  29  -3.592  16.268   4.628
  245    H    SER  30           H        SER  30   2.560  17.138   3.151
  246    HA   SER  30           HA       SER  30   5.222  17.044   1.872
  247   1HB   SER  30          2HB       SER  30   4.452  16.620   4.772
  248   2HB   SER  30          1HB       SER  30   6.006  17.160   4.145
  249    HG   SER  30           HG       SER  30   4.844  18.937   4.867
  250    H    THR  31           H        THR  31   3.471  14.922   1.113
  251    HA   THR  31           HA       THR  31   4.553  12.560   2.595
  252    HB   THR  31           HB       THR  31   2.632  11.700   0.784
  253    HG1  THR  31           1HG      THR  31   1.841  14.194   1.875
  254   1HG2  THR  31          1HG2      THR  31   2.203  12.681   3.619
  255   2HG2  THR  31          2HG2      THR  31   2.835  11.096   3.176
  256   3HG2  THR  31          3HG2      THR  31   1.180  11.533   2.753
  257    H    ASP  32           H        ASP  32   6.327  13.923   0.866
  258    HA   ASP  32           HA       ASP  32   6.333  12.617  -1.763
  259   1HB   ASP  32          2HB       ASP  32   8.313  13.993  -2.083
  260   2HB   ASP  32          1HB       ASP  32   7.102  14.961  -1.242
  261    H    VAL  33           H        VAL  33   6.800  11.270   1.096
  262    HA   VAL  33           HA       VAL  33   9.397  10.146   1.202
  263    HB   VAL  33           HB       VAL  33   8.280   8.444   2.580
  264   1HG1  VAL  33          1HG1      VAL  33   6.618  10.841   3.158
  265   2HG1  VAL  33          2HG1      VAL  33   8.363  11.088   3.111
  266   3HG1  VAL  33          3HG1      VAL  33   7.668   9.915   4.232
  267   1HG2  VAL  33          1HG2      VAL  33   6.313   7.701   1.712
  268   2HG2  VAL  33          2HG2      VAL  33   6.022   9.212   0.852
  269   3HG2  VAL  33          3HG2      VAL  33   5.600   9.074   2.557
  270    H    SER  34           H        SER  34   8.712   7.328   1.146
  271    HA   SER  34           HA       SER  34   8.117   6.768  -1.713
  272   1HB   SER  34          2HB       SER  34  10.640   5.827  -0.324
  273   2HB   SER  34          1HB       SER  34  10.245   5.674  -2.033
  274    HG   SER  34           HG       SER  34  10.805   7.690  -2.338
  275    H    PHE  35           H        PHE  35   9.137   4.063  -1.513
  276    HA   PHE  35           HA       PHE  35   6.881   2.777  -0.234
  277   1HB   PHE  35          2HB       PHE  35   8.266   2.075  -2.278
  278   2HB   PHE  35          1HB       PHE  35   9.484   1.521  -1.128
  279    HD1  PHE  35           1HD      PHE  35   6.045   1.008  -2.375
  280    HD2  PHE  35           2HD      PHE  35   9.104  -0.415   0.285
  281    HE1  PHE  35           1HE      PHE  35   4.772  -1.093  -2.032
  282    HE2  PHE  35           2HE      PHE  35   7.831  -2.515   0.627
  283    HZ   PHE  35           HZ       PHE  35   5.664  -2.855  -0.532
  284    H    SER  36           H        SER  36  10.381   2.333   0.414
  285    HA   SER  36           HA       SER  36  10.365   0.926   2.762
  286   1HB   SER  36          2HB       SER  36  12.293   1.969   1.450
  287   2HB   SER  36          1HB       SER  36  12.007   3.441   2.376
  288    HG   SER  36           HG       SER  36  12.368   2.234   4.267
  289    H    SER  37           H        SER  37   9.705   4.427   2.502
  290    HA   SER  37           HA       SER  37   9.414   4.833   5.359
  291   1HB   SER  37          2HB       SER  37   8.585   6.351   2.873
  292   2HB   SER  37          1HB       SER  37   8.345   6.983   4.499
  293    HG   SER  37           HG       SER  37  10.606   6.756   4.815
  294    H    ILE  38           H        ILE  38   6.842   5.405   2.965
  295    HA   ILE  38           HA       ILE  38   4.661   5.051   4.669
  296    HB   ILE  38           HB       ILE  38   5.315   5.330   1.882
  297   1HG1  ILE  38          2HG1      ILE  38   3.077   6.413   1.862
  298   2HG1  ILE  38          1HG1      ILE  38   2.797   5.790   3.485
  299   1HG2  ILE  38          1HG2      ILE  38   3.213   4.242   0.979
  300   2HG2  ILE  38          2HG2      ILE  38   3.107   3.354   2.499
  301   3HG2  ILE  38          3HG2      ILE  38   4.496   3.121   1.434
  302   1HD1  ILE  38          1HD1      ILE  38   5.363   7.165   3.243
  303   2HD1  ILE  38          2HD1      ILE  38   4.080   7.387   4.433
  304   3HD1  ILE  38          3HD1      ILE  38   3.993   8.214   2.879
  305    H    SER  39           H        SER  39   6.529   2.591   2.921
  306    HA   SER  39           HA       SER  39   4.813   0.360   3.207
  307   1HB   SER  39          2HB       SER  39   6.848   0.324   1.882
  308   2HB   SER  39          1HB       SER  39   7.833   0.633   3.309
  309    HG   SER  39           HG       SER  39   7.077  -1.692   2.334
  310    H    THR  40           H        THR  40   7.730   0.574   5.222
  311    HA   THR  40           HA       THR  40   7.003  -1.059   7.315
  312    HB   THR  40           HB       THR  40   8.476   1.591   7.325
  313    HG1  THR  40           1HG      THR  40   9.080  -1.081   6.822
  314   1HG2  THR  40          1HG2      THR  40   7.840  -0.303   9.506
  315   2HG2  THR  40          2HG2      THR  40   8.283   1.401   9.588
  316   3HG2  THR  40          3HG2      THR  40   9.534   0.172   9.393
  317    H    MET  41           H        MET  41   6.158   2.405   7.028
  318    HA   MET  41           HA       MET  41   4.886   2.884   9.452
  319   1HB   MET  41          2HB       MET  41   5.097   4.056   6.937
  320   2HB   MET  41          1HB       MET  41   3.359   3.835   7.141
  321   1HG   MET  41          2HG       MET  41   4.513   4.787   9.608
  322   2HG   MET  41          1HG       MET  41   4.972   5.857   8.283
  323   1HE   MET  41          1HE       MET  41   2.660   5.342   6.263
  324   2HE   MET  41          2HE       MET  41   3.312   6.942   6.614
  325   3HE   MET  41          3HE       MET  41   1.568   6.687   6.625
  326    H    LEU  42           H        LEU  42   3.193   1.682   6.521
  327    HA   LEU  42           HA       LEU  42   0.676   1.161   7.578
  328   1HB   LEU  42          2HB       LEU  42   2.433  -0.143   5.522
  329   2HB   LEU  42          1HB       LEU  42   0.871  -0.872   5.895
  330    HG   LEU  42           HG       LEU  42   1.083   2.075   5.307
  331   1HD1  LEU  42          1HD1      LEU  42   2.015   1.309   3.314
  332   2HD1  LEU  42          2HD1      LEU  42   0.294   1.221   2.936
  333   3HD1  LEU  42          3HD1      LEU  42   1.172  -0.238   3.396
  334   1HD2  LEU  42          1HD2      LEU  42  -0.978   0.630   6.228
  335   2HD2  LEU  42          2HD2      LEU  42  -1.182   0.299   4.507
  336   3HD2  LEU  42          3HD2      LEU  42  -1.214   1.961   5.095
  337    H    LEU  43           H        LEU  43   3.234  -1.347   7.341
  338    HA   LEU  43           HA       LEU  43   1.933  -3.268   8.978
  339   1HB   LEU  43          2HB       LEU  43   3.819  -3.732   7.483
  340   2HB   LEU  43          1HB       LEU  43   4.876  -2.725   8.476
  341    HG   LEU  43           HG       LEU  43   3.638  -4.547  10.248
  342   1HD1  LEU  43          1HD1      LEU  43   3.403  -6.510   9.164
  343   2HD1  LEU  43          2HD1      LEU  43   5.032  -6.387   8.500
  344   3HD1  LEU  43          3HD1      LEU  43   3.675  -5.650   7.648
  345   1HD2  LEU  43          1HD2      LEU  43   6.415  -4.376   9.034
  346   2HD2  LEU  43          2HD2      LEU  43   6.010  -5.428  10.392
  347   3HD2  LEU  43          3HD2      LEU  43   5.873  -3.678  10.560
  348    H    GLU  44           H        GLU  44   4.272  -0.708   9.865
  349    HA   GLU  44           HA       GLU  44   4.568  -1.423  12.615
  350   1HB   GLU  44          2HB       GLU  44   5.156   0.778  10.799
  351   2HB   GLU  44          1HB       GLU  44   4.701   1.378  12.393
  352   1HG   GLU  44          2HG       GLU  44   6.575  -0.932  12.336
  353   2HG   GLU  44          1HG       GLU  44   7.221   0.619  11.793
  354    H    LEU  45           H        LEU  45   1.965  -0.049  10.840
  355    HA   LEU  45           HA       LEU  45   0.594   0.949  13.287
  356   1HB   LEU  45          2HB       LEU  45   0.537   1.382  10.351
  357   2HB   LEU  45          1HB       LEU  45  -1.021   1.499  11.169
  358    HG   LEU  45           HG       LEU  45   0.599   2.912  12.874
  359   1HD1  LEU  45          1HD1      LEU  45   1.764   4.511  11.196
  360   2HD1  LEU  45          2HD1      LEU  45   1.633   3.175  10.051
  361   3HD1  LEU  45          3HD1      LEU  45   2.551   2.971  11.544
  362   1HD2  LEU  45          1HD2      LEU  45  -1.668   3.429  11.699
  363   2HD2  LEU  45          2HD2      LEU  45  -0.678   4.243  10.491
  364   3HD2  LEU  45          3HD2      LEU  45  -0.643   4.784  12.169
  365    H    GLY  46           H        GLY  46   0.848  -1.880  11.473
  366   1HA   GLY  46          2HA       GLY  46  -0.387  -3.884  11.689
  367   2HA   GLY  46          1HA       GLY  46  -1.502  -3.039  12.764
  368    H    LEU  47           H        LEU  47  -0.970  -1.310   9.905
  369    HA   LEU  47           HA       LEU  47  -2.181  -1.110   7.873
  370   1HB   LEU  47          2HB       LEU  47  -2.363  -3.796   8.563
  371   2HB   LEU  47          1HB       LEU  47  -4.048  -3.309   8.371
  372    HG   LEU  47           HG       LEU  47  -3.410  -2.268   6.162
  373   1HD1  LEU  47          1HD1      LEU  47  -1.168  -1.948   5.950
  374   2HD1  LEU  47          2HD1      LEU  47  -1.151  -3.630   5.419
  375   3HD1  LEU  47          3HD1      LEU  47  -0.781  -3.231   7.097
  376   1HD2  LEU  47          1HD2      LEU  47  -4.319  -4.227   5.497
  377   2HD2  LEU  47          2HD2      LEU  47  -3.613  -5.087   6.866
  378   3HD2  LEU  47          3HD2      LEU  47  -2.677  -4.859   5.389
  379    H    ARG  48           H        ARG  48  -4.032  -1.873  10.830
  380    HA   ARG  48           HA       ARG  48  -6.455  -0.548   9.945
  381   1HB   ARG  48          2HB       ARG  48  -6.278  -2.354  11.665
  382   2HB   ARG  48          1HB       ARG  48  -5.439  -1.222  12.726
  383   1HG   ARG  48          2HG       ARG  48  -7.965  -0.183  11.628
  384   2HG   ARG  48          1HG       ARG  48  -8.164  -1.590  12.674
  385   1HD   ARG  48          2HD       ARG  48  -6.724   0.993  13.384
  386   2HD   ARG  48          1HD       ARG  48  -8.242   0.394  14.083
  387    HE   ARG  48           HE       ARG  48  -5.683  -0.420  14.972
  388   1HH1  ARG  48          1HH1      ARG  48  -8.249  -1.197  16.317
  389   2HH1  ARG  48          2HH1      ARG  48  -8.252  -2.918  16.120
  390   1HH2  ARG  48          1HH2      ARG  48  -5.836  -2.908  13.633
  391   2HH2  ARG  48          2HH2      ARG  48  -6.886  -3.886  14.601
  392    H    VAL  49           H        VAL  49  -4.246   0.354  12.622
  393    HA   VAL  49           HA       VAL  49  -5.068   2.928  13.146
  394    HB   VAL  49           HB       VAL  49  -2.191   2.024  12.811
  395   1HG1  VAL  49          1HG1      VAL  49  -1.870   3.556  14.783
  396   2HG1  VAL  49          2HG1      VAL  49  -3.539   4.087  14.575
  397   3HG1  VAL  49          3HG1      VAL  49  -2.354   4.388  13.305
  398   1HG2  VAL  49          1HG2      VAL  49  -3.135   1.770  15.490
  399   2HG2  VAL  49          2HG2      VAL  49  -2.595   0.489  14.407
  400   3HG2  VAL  49          3HG2      VAL  49  -4.295   0.956  14.440
  401    H    TYR  50           H        TYR  50  -3.319   1.835  10.286
  402    HA   TYR  50           HA       TYR  50  -2.249   4.147   9.199
  403   1HB   TYR  50          2HB       TYR  50  -2.088   2.052   8.061
  404   2HB   TYR  50          1HB       TYR  50  -3.843   1.884   7.976
  405    HD1  TYR  50           1HD      TYR  50  -4.638   2.121   5.800
  406    HD2  TYR  50           2HD      TYR  50  -1.419   4.628   7.142
  407    HE1  TYR  50           1HE      TYR  50  -4.647   3.300   3.619
  408    HE2  TYR  50           2HE      TYR  50  -1.428   5.808   4.960
  409    HH   TYR  50           HH       TYR  50  -2.133   5.393   2.652
  410    H    GLU  51           H        GLU  51  -5.621   3.085   8.558
  411    HA   GLU  51           HA       GLU  51  -6.517   5.429   7.281
  412   1HB   GLU  51          2HB       GLU  51  -7.458   2.971   7.890
  413   2HB   GLU  51          1HB       GLU  51  -8.337   3.920   9.085
  414   1HG   GLU  51          2HG       GLU  51  -8.365   5.254   6.521
  415   2HG   GLU  51          1HG       GLU  51  -8.975   3.608   6.363
  416    H    ALA  52           H        ALA  52  -5.720   4.920  10.599
  417    HA   ALA  52           HA       ALA  52  -7.491   6.949  11.722
  418   1HB   ALA  52          1HB       ALA  52  -5.890   4.838  12.603
  419   2HB   ALA  52          2HB       ALA  52  -6.772   5.965  13.632
  420   3HB   ALA  52          3HB       ALA  52  -5.082   6.275  13.230
  421    H    GLN  53           H        GLN  53  -4.610   7.093   9.903
  422    HA   GLN  53           HA       GLN  53  -3.598   9.536  11.184
  423   1HB   GLN  53          2HB       GLN  53  -1.713   9.189   9.793
  424   2HB   GLN  53          1HB       GLN  53  -2.265   7.559  10.173
  425   1HG   GLN  53          2HG       GLN  53  -3.645   7.690   8.012
  426   2HG   GLN  53          1HG       GLN  53  -2.684   9.116   7.618
  427   1HE2  GLN  53          1HE2      GLN  53  -1.278   8.323   6.004
  428   2HE2  GLN  53          2HE2      GLN  53  -0.253   6.985   6.215
  429    H    MET  54           H        MET  54  -6.093   8.921   9.106
  430    HA   MET  54           HA       MET  54  -5.613  11.336   7.411
  431   1HB   MET  54          2HB       MET  54  -7.717   9.155   7.242
  432   2HB   MET  54          1HB       MET  54  -7.357  10.361   6.006
  433   1HG   MET  54          2HG       MET  54  -5.269   9.398   5.498
  434   2HG   MET  54          1HG       MET  54  -5.208   8.507   7.019
  435   1HE   MET  54          1HE       MET  54  -5.273   5.605   4.630
  436   2HE   MET  54          2HE       MET  54  -4.317   6.778   5.533
  437   3HE   MET  54          3HE       MET  54  -4.808   7.137   3.879
  438    H    GLU  55           H        GLU  55  -6.471  11.373  10.319
  439    HA   GLU  55           HA       GLU  55  -9.098  12.780   9.936
  440   1HB   GLU  55          2HB       GLU  55  -9.650  11.982  12.194
  441   2HB   GLU  55          1HB       GLU  55  -9.205  10.616  11.169
  442   1HG   GLU  55          2HG       GLU  55  -7.328  10.168  12.369
  443   2HG   GLU  55          1HG       GLU  55  -6.936  11.877  12.568
  444    H    ARG  56           H        ARG  56  -9.429  14.591  11.489
  445    HA   ARG  56           HA       ARG  56  -7.299  15.602  13.151
  446   1HB   ARG  56          2HB       ARG  56  -6.757  17.537  11.558
  447   2HB   ARG  56          1HB       ARG  56  -6.131  15.956  11.089
  448   1HG   ARG  56          2HG       ARG  56  -8.797  16.240  10.057
  449   2HG   ARG  56          1HG       ARG  56  -7.849  17.653   9.591
  450   1HD   ARG  56          2HD       ARG  56  -6.069  15.565   9.173
  451   2HD   ARG  56          1HD       ARG  56  -7.622  14.888   8.644
  452    HE   ARG  56           HE       ARG  56  -6.688  17.572   7.697
  453   1HH1  ARG  56          1HH2      ARG  56  -5.972  14.955   6.212
  454   2HH1  ARG  56          2HH2      ARG  56  -7.184  14.957   4.974
  455   1HH2  ARG  56          1HH1      ARG  56  -9.143  17.360   6.529
  456   2HH2  ARG  56          2HH1      ARG  56  -8.980  16.321   5.153