*HEADER    TOXIN                                   18-APR-04   1T1T              
*TITLE     SOLUTION STRUCTURE OF KURTOXIN                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: KURTOXIN;                                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: KTX;                                                        
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PARABUTHUS TRANSVAALICUS;                       
*SOURCE   3 ORGANISM_COMMON: SOUTH AFRICAN FATTAIL SCORPION;                     
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    CYSTEINE STABILIZED ALPHA-BETA                                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.W.LEE, H.J.MIN, E.M.CHO, T.KOHNO, Y.J.EU, J.I.KIM                   
*REVDAT   1   28-JUN-05 1T1T    0                                                

! Kurtoxin restraints file

!Intra residue

! residue 1    Lys , intraresidue NOEs

! residue 1    Lys , NOEs forward in sequence
assi (resi 1    and name HA  ) (resi 2    and name HN  )  2.50  0.70  0.20
assi (resi 1    and name HA  ) (resi 48   and name HA# )  4.00  2.20  2.00

! residue 2    Ile , intraresidue NOEs
assi (resi 2    and name HN  ) (resi 2    and name HA  )  3.00  1.20  0.50
assi (resi 2    and name HN  ) (resi 2    and name HB  )  3.00  1.20  0.50
assi (resi 2    and name HN  ) (resi 2    and name HG2#)  2.50  0.70  2.20
assi (resi 2    and name HA  ) (resi 2    and name HB  )  2.50  0.70  0.20
assi (resi 2    and name HA  ) (resi 2    and name HG2#)  2.50  0.70  1.80
assi (resi 2    and name HN  ) (resi 2    and name HD1#)  3.00  1.20  2.50
assi (resi 2    and name HA  ) (resi 2    and name HD1#)  3.00  1.20  2.50

! residue 3    Asp , intraresidue NOEs
assi (resi 3    and name HN  ) (resi 3    and name HA  )  3.00  1.20  0.50
assi (resi 3    and name HN  ) (resi 3    and name HB# )  3.00  1.20  1.10
assi (resi 3    and name HA  ) (resi 3    and name HB# )  2.50  0.70  0.80

! residue 4    Gly , intraresidue NOEs
assi (resi 4    and name HN  ) (resi 4    and name HA# )  3.00  1.20  1.10

! residue 5    Tyr , intraresidue NOEs
assi (resi 5    and name HN  ) (resi 5    and name HA  )  4.00  2.20  1.00
assi (resi 5    and name HN  ) (resi 5    and name HB# )  4.00  2.20  2.00
assi (resi 5    and name HN  ) (resi 5    and name HD# )  3.00  1.20  2.50
assi (resi 5    and name HN  ) (resi 5    and name HE# )  4.00  2.20  4.00
assi (resi 5    and name HA  ) (resi 5    and name HB# )  4.00  2.20  1.60
assi (resi 5    and name HA  ) (resi 5    and name HD# )  3.00  1.20  2.50
assi (resi 5    and name HA  ) (resi 5    and name HE# )  4.00  2.20  4.00
assi (resi 5    and name HB# ) (resi 5    and name HD# )  2.50  0.70  2.80
assi (resi 5    and name HB# ) (resi 5    and name HE# )  4.00  2.20  4.00

! residue 6    Pro , intraresidue NOEs
assi (resi 6    and name HA  ) (resi 6    and name HB# )  3.00  1.20  1.10
assi (resi 6    and name HA  ) (resi 6    and name HG# )  4.00  2.20  2.00
assi (resi 6    and name HA  ) (resi 6    and name HD# )  4.00  2.20  3.00

! residue 7    Val , intraresidue NOEs
assi (resi 7    and name HN  ) (resi 7    and name HA  )  3.00  1.20  0.50
assi (resi 7    and name HA  ) (resi 7    and name HB  )  2.50  0.70  0.20
assi (resi 7    and name HN  ) (resi 7    and name HG# )  2.50  0.70  3.80
assi (resi 7    and name HA  ) (resi 7    and name HG# )  2.50  0.70  3.40

! residue 8    Asp , intraresidue NOEs
assi (resi 8    and name HN  ) (resi 8    and name HA  )  3.00  1.20  0.50
assi (resi 8    and name HN  ) (resi 8    and name HB# )  4.00  2.20  1.60
assi (resi 8    and name HA  ) (resi 8    and name HB# )  2.50  0.70  0.80

! residue 9    Tyr , intraresidue NOEs
assi (resi 9    and name HN  ) (resi 9    and name HA  )  3.00  1.20  0.50
assi (resi 9    and name HN  ) (resi 9    and name HB# )  2.50  0.70  0.80
assi (resi 9    and name HN  ) (resi 9    and name HD# )  4.00  2.20  3.00
assi (resi 9    and name HA  ) (resi 9    and name HB# )  2.50  0.70  0.80
assi (resi 9    and name HA  ) (resi 9    and name HD# )  2.50  0.70  2.20
assi (resi 9    and name HA  ) (resi 9    and name HE# )  4.00  2.20  3.40
assi (resi 9    and name HB# ) (resi 9    and name HD# )  2.50  0.70  2.80
assi (resi 9    and name HB# ) (resi 9    and name HE# )  4.00  2.20  4.40

! residue 10   Trp , intraresidue NOEs
assi (resi 10   and name HN  ) (resi 10   and name HA  )  3.00  1.20  0.50
assi (resi 10   and name HN  ) (resi 10   and name HD1 )  4.00  2.20  1.00
assi (resi 10   and name HN  ) (resi 10   and name HB# )  2.50  0.70  0.80
assi (resi 10   and name HA  ) (resi 10   and name HD1 )  4.00  2.20  1.00
assi (resi 10   and name HA  ) (resi 10   and name HE1 )  4.00  2.20  2.00
assi (resi 10   and name HA  ) (resi 10   and name HE3 )  4.00  2.20  1.00
assi (resi 10   and name HA  ) (resi 10   and name HB# )  2.50  0.70  0.80
assi (resi 10   and name HD1 ) (resi 10   and name HE1 )  2.50  0.70  0.20
assi (resi 10   and name HD1 ) (resi 10   and name HB# )  3.00  1.20  1.50
assi (resi 10   and name HE1 ) (resi 10   and name HZ2 )  3.00  1.20  0.50
assi (resi 10   and name HE1 ) (resi 10   and name HH2 )  4.00  2.20  2.00
assi (resi 10   and name HE1 ) (resi 10   and name HB# )  4.00  2.20  3.00
assi (resi 10   and name HE3 ) (resi 10   and name HZ3 )  2.50  0.70  0.20
assi (resi 10   and name HE3 ) (resi 10   and name HB# )  2.50  0.70  1.20
assi (resi 10   and name HZ2 ) (resi 10   and name HH2 )  2.50  0.70  0.20
assi (resi 10   and name HN  ) (resi 10   and name HE3 )  3.00  1.20  0.50

! residue 11   Asn , intraresidue NOEs
assi (resi 11   and name HN  ) (resi 11   and name HA  )  2.50  0.70  0.20
assi (resi 11   and name HN  ) (resi 11   and name HB2 )  3.00  1.20  0.50
assi (resi 11   and name HN  ) (resi 11   and name HB1 )  4.00  2.20  1.00
assi (resi 11   and name HA  ) (resi 11   and name HB2 )  3.00  1.20  0.50
assi (resi 11   and name HA  ) (resi 11   and name HB1 )  3.00  1.20  0.50
assi (resi 11   and name HA  ) (resi 11   and name HD2#)  4.00  2.20  2.00
assi (resi 11   and name HB2 ) (resi 11   and name HD2#)  3.00  1.20  1.20
assi (resi 11   and name HB1 ) (resi 11   and name HD2#)  4.00  2.20  1.50

! residue 12   Cys , intraresidue NOEs
assi (resi 12   and name HN  ) (resi 12   and name HA  )  3.00  1.20  0.50
assi (resi 12   and name HN  ) (resi 12   and name HB# )  3.00  1.20  1.10
assi (resi 12   and name HA  ) (resi 12   and name HB# )  2.50  0.70  0.80

! residue 13   Lys , intraresidue NOEs
assi (resi 13   and name HN  ) (resi 13   and name HA  )  3.00  1.20  0.50
assi (resi 13   and name HN  ) (resi 13   and name HB# )  3.00  1.20  1.50
assi (resi 13   and name HN  ) (resi 13   and name HG# )  4.00  2.20  2.00
assi (resi 13   and name HN  ) (resi 13   and name HD# )  3.00  1.20  1.50
assi (resi 13   and name HA  ) (resi 13   and name HB# )  3.00  1.20  1.50
assi (resi 13   and name HA  ) (resi 13   and name HG# )  3.00  1.20  1.10
assi (resi 13   and name HA  ) (resi 13   and name HD# )  2.50  0.70  1.70

! residue 14   Arg , intraresidue NOEs
assi (resi 14   and name HN  ) (resi 14   and name HA  )  3.00  1.20  0.50

! residue 15   Ile , intraresidue NOEs
assi (resi 15   and name HN  ) (resi 15   and name HA  )  3.00  1.20  0.50

! residue 16   Cys , intraresidue NOEs
assi (resi 16   and name HN  ) (resi 16   and name HA  )  3.00  1.20  0.50
assi (resi 16   and name HN  ) (resi 16   and name HB2 )  3.00  1.20  0.50
assi (resi 16   and name HN  ) (resi 16   and name HB1 )  3.00  1.20  0.50
assi (resi 16   and name HA  ) (resi 16   and name HB2 )  2.50  0.70  0.20
assi (resi 16   and name HA  ) (resi 16   and name HB1 )  4.00  2.20  1.00

! residue 17   Trp , intraresidue NOEs
assi (resi 17   and name HN  ) (resi 17   and name HA  )  3.00  1.20  0.50
assi (resi 17   and name HN  ) (resi 17   and name HB# )  3.00  1.20  1.10
assi (resi 17   and name HD1 ) (resi 17   and name HE1 )  2.50  0.70  0.20
assi (resi 17   and name HE1 ) (resi 17   and name HZ2 )  3.00  1.20  0.50

! residue 18   Tyr , intraresidue NOEs
assi (resi 18   and name HN  ) (resi 18   and name HA  )  3.00  1.20  0.50
assi (resi 18   and name HN  ) (resi 18   and name HB# )  3.00  1.20  1.10
assi (resi 18   and name HA  ) (resi 18   and name HB# )  3.00  1.20  1.10
assi (resi 18   and name HA  ) (resi 18   and name HD# )  3.00  1.20  2.50
assi (resi 18   and name HA  ) (resi 18   and name HE# )  4.00  2.20  1.00
assi (resi 18   and name HB# ) (resi 18   and name HD# )  2.50  0.70  2.80
assi (resi 18   and name HB# ) (resi 18   and name HE# )  4.00  2.20  4.60

! residue 19   Asn , intraresidue NOEs
assi (resi 19   and name HA  ) (resi 19   and name HB# )  3.00  1.20  1.10

! residue 20   Asn , intraresidue NOEs
assi (resi 20   and name HN  ) (resi 20   and name HA  )  4.00  2.20  1.00
assi (resi 20   and name HN  ) (resi 20   and name HB# )  3.00  1.20  1.50
assi (resi 20   and name HA  ) (resi 20   and name HB# )  4.00  2.20  1.60

! residue 21   Lys , intraresidue NOEs
assi (resi 21   and name HN  ) (resi 21   and name HA  )  3.00  1.20  0.50
assi (resi 21   and name HN  ) (resi 21   and name HB# )  2.50  0.70  1.20
assi (resi 21   and name HN  ) (resi 21   and name HG# )  4.00  2.20  2.00
assi (resi 21   and name HA  ) (resi 21   and name HB# )  2.50  0.70  0.80
assi (resi 21   and name HA  ) (resi 21   and name HG# )  3.00  1.20  1.50

! residue 22   Tyr , intraresidue NOEs
assi (resi 22   and name HN  ) (resi 22   and name HA  )  3.00  1.20  0.50
assi (resi 22   and name HN  ) (resi 22   and name HB# )  2.50  0.70  1.20

! residue 23   Cys , intraresidue NOEs
assi (resi 23   and name HN  ) (resi 23   and name HA  )  3.00  1.20  0.50
assi (resi 23   and name HN  ) (resi 23   and name HB# )  2.50  0.70  1.20

! residue 24   Asn , intraresidue NOEs
assi (resi 24   and name HN  ) (resi 24   and name HA  )  3.00  1.20  0.50
assi (resi 24   and name HN  ) (resi 24   and name HB# )  2.50  0.70  0.80
assi (resi 24   and name HA  ) (resi 24   and name HB# )  3.00  1.20  1.10

! residue 25   Asp , intraresidue NOEs
assi (resi 25   and name HA  ) (resi 25   and name HB# )  2.50  0.70  0.80

! residue 26   Leu , intraresidue NOEs
assi (resi 26   and name HN  ) (resi 26   and name HA  )  3.00  1.20  0.50
assi (resi 26   and name HN  ) (resi 26   and name HG  )  3.00  1.20  0.50
assi (resi 26   and name HN  ) (resi 26   and name HB# )  3.00  1.20  1.10
assi (resi 26   and name HN  ) (resi 26   and name HD# )  3.00  1.20  3.90

! residue 27   Cys , intraresidue NOEs
assi (resi 27   and name HN  ) (resi 27   and name HA  )  3.00  1.20  0.50
assi (resi 27   and name HN  ) (resi 27   and name HB1 )  3.00  1.20  0.50
assi (resi 27   and name HN  ) (resi 27   and name HB2 )  2.50  0.70  0.20
assi (resi 27   and name HA  ) (resi 27   and name HB1 )  2.50  0.70  0.20
assi (resi 27   and name HA  ) (resi 27   and name HB2 )  3.00  1.20  0.50

! residue 28   Lys , intraresidue NOEs
assi (resi 28   and name HN  ) (resi 28   and name HA  )  3.00  1.20  0.50
assi (resi 28   and name HN  ) (resi 28   and name HB# )  2.50  0.70  1.20
assi (resi 28   and name HN  ) (resi 28   and name HG# )  3.00  1.20  1.50
assi (resi 28   and name HN  ) (resi 28   and name HD# )  3.00  1.20  1.10

! residue 29   Gly , intraresidue NOEs
assi (resi 29   and name HN  ) (resi 29   and name HA# )  2.50  0.70  1.30

! residue 30   Leu , intraresidue NOEs
assi (resi 30   and name HN  ) (resi 30   and name HA  )  3.00  1.20  0.50
assi (resi 30   and name HN  ) (resi 30   and name HG  )  2.50  0.70  0.20
assi (resi 30   and name HN  ) (resi 30   and name HD# )  2.50  0.70  3.60
assi (resi 30   and name HN  ) (resi 30   and name HB# )  2.50  0.70  1.20
assi (resi 30   and name HA  ) (resi 30   and name HG  )  2.50  0.70  0.20
assi (resi 30   and name HA  ) (resi 30   and name HD# )  2.50  0.70  2.20

! residue 31   Lys , intraresidue NOEs
assi (resi 31   and name HN  ) (resi 31   and name HA  )  2.50  0.70  0.20
assi (resi 31   and name HN  ) (resi 31   and name HB1 )  3.00  1.20  1.00
assi (resi 31   and name HN  ) (resi 31   and name HB2 )  4.00  2.20  1.00
assi (resi 31   and name HN  ) (resi 31   and name HG# )  4.00  2.20  2.00
assi (resi 31   and name HN  ) (resi 31   and name HD# )  4.00  2.20  2.00
assi (resi 31   and name HA  ) (resi 31   and name HB1 )  3.00  1.20  0.70
assi (resi 31   and name HA  ) (resi 31   and name HB2 )  2.50  0.70  0.20
assi (resi 31   and name HA  ) (resi 31   and name HG# )  3.00  1.20  1.10
assi (resi 31   and name HA  ) (resi 31   and name HD# )  4.00  2.20  2.00

! residue 32   Ala , intraresidue NOEs
assi (resi 32   and name HN  ) (resi 32   and name HA  )  3.00  1.20  0.50
assi (resi 32   and name HN  ) (resi 32   and name HB# )  2.50  0.70  1.80
assi (resi 32   and name HA  ) (resi 32   and name HB# )  2.50  0.70  1.80

! residue 33   Asp , intraresidue NOEs

! residue 34   Ser , intraresidue NOEs
assi (resi 34   and name HN  ) (resi 34   and name HA  )  3.00  1.20  0.50
assi (resi 34   and name HN  ) (resi 34   and name HB# )  3.00  1.20  1.10
assi (resi 34   and name HA  ) (resi 34   and name HB# )  2.50  0.70  0.80

! residue 35   Gly , intraresidue NOEs
assi (resi 35   and name HN  ) (resi 35   and name HA# )  4.00  2.20  1.00

! residue 36   Tyr , intraresidue NOEs
assi (resi 36   and name HN  ) (resi 36   and name HA  )  3.00  1.20  0.50
assi (resi 36   and name HN  ) (resi 36   and name HB# )  4.00  2.20  2.60
assi (resi 36   and name HN  ) (resi 36   and name HD# )  3.00  1.20  2.50
assi (resi 36   and name HA  ) (resi 36   and name HB# )  2.50  0.70  0.80
assi (resi 36   and name HA  ) (resi 36   and name HD# )  3.00  1.20  2.90
assi (resi 36   and name HA  ) (resi 36   and name HE# )  4.00  2.20  3.40
assi (resi 36   and name HB# ) (resi 36   and name HD# )  2.50  0.70  2.80
assi (resi 36   and name HB# ) (resi 36   and name HE# )  3.00  1.20  3.50

! residue 37   Cys , intraresidue NOEs
assi (resi 37   and name HN  ) (resi 37   and name HA  )  4.00  2.20  1.00
assi (resi 37   and name HN  ) (resi 37   and name HB# )  3.00  1.20  1.50
assi (resi 37   and name HA  ) (resi 37   and name HB# )  3.00  1.20  1.10

! residue 38   Trp , intraresidue NOEs
assi (resi 38   and name HN  ) (resi 38   and name HA  )  3.00  1.20  0.50
assi (resi 38   and name HN  ) (resi 38   and name HB# )  3.00  1.20  1.10
assi (resi 38   and name HA  ) (resi 38   and name HE3 )  2.50  0.70  0.20
assi (resi 38   and name HA  ) (resi 38   and name HZ3 )  4.00  2.20  2.00
assi (resi 38   and name HA  ) (resi 38   and name HB# )  3.00  1.20  1.10
assi (resi 38   and name HE3 ) (resi 38   and name HB# )  3.00  1.20  1.50

! residue 39   Gly , intraresidue NOEs
assi (resi 39   and name HN  ) (resi 39   and name HA# )  3.00  1.20  1.10

! residue 40   Trp , intraresidue NOEs
assi (resi 40   and name HA  ) (resi 40   and name HE3 )  2.50  0.70  0.20
assi (resi 40   and name HA  ) (resi 40   and name HB1 )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 40   and name HB2 )  2.50  0.70  0.20
assi (resi 40   and name HD1 ) (resi 40   and name HE1 )  2.50  0.70  0.20
assi (resi 40   and name HD1 ) (resi 40   and name HZ2 )  4.00  2.20  2.00
assi (resi 40   and name HE1 ) (resi 40   and name HZ2 )  3.00  1.20  0.50
assi (resi 40   and name HE1 ) (resi 40   and name HB1 )  4.00  2.20  1.00
assi (resi 40   and name HE1 ) (resi 40   and name HB2 )  4.00  2.20  1.00
assi (resi 40   and name HE3 ) (resi 40   and name HB1 )  4.00  2.20  1.00
assi (resi 40   and name HE3 ) (resi 40   and name HB2 )  3.00  1.20  0.50
assi (resi 40   and name HN  ) (resi 40   and name HA  )  3.00  1.20  0.50
assi (resi 40   and name HN  ) (resi 40   and name HB1 )  3.00  1.20  0.50
assi (resi 40   and name HN  ) (resi 40   and name HB2 )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 40   and name HE3 )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 40   and name HD1 )  4.00  2.20  2.00
assi (resi 40   and name HD1 ) (resi 40   and name HB1 )  4.00  2.20  1.00
assi (resi 40   and name HD1 ) (resi 40   and name HB2 )  4.00  2.20  1.00


! residue 41   Thr , intraresidue NOEs
assi (resi 41   and name HN  ) (resi 41   and name HA  )  3.00  1.20  0.50
assi (resi 41   and name HN  ) (resi 41   and name HB  )  4.00  2.20  1.00
assi (resi 41   and name HN  ) (resi 41   and name HG2#)  2.50  0.70  2.50
assi (resi 41   and name HA  ) (resi 41   and name HG2#)  2.50  0.70  1.80
assi (resi 41   and name HB  ) (resi 41   and name HG2#)  2.50  0.70  1.80

! residue 42   Leu , intraresidue NOEs
assi (resi 42   and name HN  ) (resi 42   and name HA  )  3.00  1.20  0.50
assi (resi 42   and name HN  ) (resi 42   and name HG  )  4.00  2.20  1.00
assi (resi 42   and name HN  ) (resi 42   and name HB# )  4.00  2.20  1.60
assi (resi 42   and name HN  ) (resi 42   and name HD# )  3.00  1.20  3.90
assi (resi 42   and name HA  ) (resi 42   and name HG  )  3.00  1.20  0.50
assi (resi 42   and name HA  ) (resi 42   and name HB# )  3.00  1.20  1.10
assi (resi 42   and name HA  ) (resi 42   and name HD# )  2.50  0.70  3.60

! residue 43   Ser , intraresidue NOEs
assi (resi 43   and name HN  ) (resi 43   and name HA  )  3.00  1.20  0.50
assi (resi 43   and name HN  ) (resi 43   and name HB# )  3.00  1.20  1.10
assi (resi 43   and name HA  ) (resi 43   and name HB# )  3.00  1.20  1.10

! residue 44   Cys , intraresidue NOEs
assi (resi 44   and name HN  ) (resi 44   and name HA  )  3.00  1.20  0.50
assi (resi 44   and name HN  ) (resi 44   and name HB1 )  3.00  1.20  0.50
assi (resi 44   and name HN  ) (resi 44   and name HB2 )  4.00  2.20  1.00
assi (resi 44   and name HA  ) (resi 44   and name HB1 )  3.00  1.20  0.50
assi (resi 44   and name HA  ) (resi 44   and name HB2 )  2.50  0.70  0.20

! residue 45   Tyr , intraresidue NOEs
assi (resi 45   and name HN  ) (resi 45   and name HA  )  3.00  1.20  0.50
assi (resi 45   and name HN  ) (resi 45   and name HB# )  3.00  1.20  1.10
assi (resi 45   and name HN  ) (resi 45   and name HD# )  4.00  2.20  3.00
assi (resi 45   and name HA  ) (resi 45   and name HB# )  2.50  0.70  0.80
assi (resi 45   and name HA  ) (resi 45   and name HD# )  4.00  2.20  3.00
assi (resi 45   and name HA  ) (resi 45   and name HE# )  4.00  2.20  4.00
assi (resi 45   and name HB# ) (resi 45   and name HD# )  3.00  1.20  3.10
assi (resi 45   and name HB# ) (resi 45   and name HE# )  3.00  1.20  3.10

! residue 46   Cys , intraresidue NOEs
assi (resi 46   and name HN  ) (resi 46   and name HA  )  3.00  1.20  0.50
assi (resi 46   and name HN  ) (resi 46   and name HB2 )  3.00  1.20  0.50
assi (resi 46   and name HN  ) (resi 46   and name HB1 )  4.00  2.20  1.00
assi (resi 46   and name HA  ) (resi 46   and name HB2 )  3.00  1.20  0.50
assi (resi 46   and name HA  ) (resi 46   and name HB1 )  2.50  0.70  0.20

! residue 47   Gln , intraresidue NOEs
assi (resi 47   and name HN  ) (resi 47   and name HA  )  3.00  1.20  0.50
assi (resi 47   and name HN  ) (resi 47   and name HB# )  3.00  1.20  1.10
assi (resi 47   and name HN  ) (resi 47   and name HG# )  4.00  2.20  2.00
assi (resi 47   and name HA  ) (resi 47   and name HB# )  2.50  0.70  1.20
assi (resi 47   and name HA  ) (resi 47   and name HG# )  4.00  2.20  1.50

! residue 48   Gly , intraresidue NOEs
assi (resi 48   and name HN  ) (resi 48   and name HA# )  2.50  0.70  1.20

! residue 49   Leu , intraresidue NOEs
assi (resi 49   and name HN  ) (resi 49   and name HA  )  3.00  1.20  0.50
assi (resi 49   and name HN  ) (resi 49   and name HB# )  2.50  0.70  1.20
assi (resi 49   and name HN  ) (resi 49   and name HD# )  3.00  1.20  3.90
assi (resi 49   and name HA  ) (resi 49   and name HB# )  4.00  2.20  1.60
assi (resi 49   and name HA  ) (resi 49   and name HD# )  2.50  0.70  3.60
assi (resi 49   and name HN  ) (resi 49   and name HG  )  3.00  1.20  0.50
assi (resi 49   and name HN  ) (resi 49   and name HD# )  3.00  1.20  3.90

! residue 50   Pro , intraresidue NOEs
assi (resi 50   and name HA  ) (resi 50   and name HB# )  2.50  0.70  0.80
assi (resi 50   and name HA  ) (resi 50   and name HG# )  3.00  1.20  1.10
assi (resi 50   and name HA  ) (resi 50   and name HD# )  4.00  2.20  3.00

! residue 51   Asp , intraresidue NOEs
assi (resi 51   and name HN  ) (resi 51   and name HA  )  3.00  1.20  0.50
assi (resi 51   and name HN  ) (resi 51   and name HB1 )  2.50  0.70  0.20
assi (resi 51   and name HN  ) (resi 51   and name HB2 )  3.00  1.20  0.50
assi (resi 51   and name HA  ) (resi 51   and name HB1 )  3.00  1.20  0.50
assi (resi 51   and name HA  ) (resi 51   and name HB2 )  2.50  0.70  0.20

! residue 52   Asn , intraresidue NOEs
assi (resi 52   and name HN  ) (resi 52   and name HA  )  3.00  1.20  0.50
assi (resi 52   and name HN  ) (resi 52   and name HB1 )  3.00  1.20  0.50
assi (resi 52   and name HN  ) (resi 52   and name HB2 )  3.00  1.20  0.50
assi (resi 52   and name HA  ) (resi 52   and name HB1 )  3.00  1.20  0.50
assi (resi 52   and name HA  ) (resi 52   and name HB2 )  2.50  0.70  0.20
assi (resi 52   and name HA  ) (resi 52   and name HD2#)  3.00  1.20  1.50
assi (resi 52   and name HB# ) (resi 52   and name HD2#)  2.50  0.70  1.80

! residue 53   Ala , intraresidue NOEs
assi (resi 53   and name HN  ) (resi 53   and name HA  )  2.50  0.70  0.50
assi (resi 53   and name HN  ) (resi 53   and name HB# )  2.50  0.70  1.80
assi (resi 53   and name HA  ) (resi 53   and name HB# )  2.50  0.70  1.80

! residue 54   Arg , intraresidue NOEs
assi (resi 54   and name HN  ) (resi 54   and name HA  )  3.00  1.20  0.50
assi (resi 54   and name HN  ) (resi 54   and name HB# )  3.00  1.20  1.10
assi (resi 54   and name HN  ) (resi 54   and name HG# )  4.00  2.20  2.00
assi (resi 54   and name HN  ) (resi 54   and name HD# )  4.00  2.20  2.00
assi (resi 54   and name HA  ) (resi 54   and name HB# )  2.50  0.70  0.80
assi (resi 54   and name HD# ) (resi 54   and name HH# )  2.50  0.70  1.40
assi (resi 54   and name HB# ) (resi 54   and name HH# )  3.00  1.20  1.70
assi (resi 54   and name HG# ) (resi 54   and name HH# )  3.00  1.20  1.70
assi (resi 54   and name HA  ) (resi 54   and name HD# )  3.00  1.20  1.50
assi (resi 54   and name HA  ) (resi 54   and name HG# )  3.00  1.20  1.10

! residue 55   Ile , intraresidue NOEs
assi (resi 55   and name HN  ) (resi 55   and name HA  )  3.00  1.20  0.50
assi (resi 55   and name HN  ) (resi 55   and name HB  )  4.00  2.20  1.00
assi (resi 55   and name HN  ) (resi 55   and name HG2#)  2.50  0.70  2.20
assi (resi 55   and name HN  ) (resi 55   and name HD1#)  3.00  1.20  2.50
assi (resi 55   and name HN  ) (resi 55   and name HG1#)  3.00  1.20  0.50
assi (resi 55   and name HA  ) (resi 55   and name HB  )  3.00  1.20  0.50
assi (resi 55   and name HA  ) (resi 55   and name HG2#)  3.00  1.20  3.50
assi (resi 55   and name HA  ) (resi 55   and name HD1#)  2.50  0.70  3.20
assi (resi 55   and name HN  ) (resi 55   and name HG12)  3.00  1.20  1.50
assi (resi 55   and name HA  ) (resi 55   and name HG12)  4.00  2.20  1.00

! residue 56   Lys , intraresidue NOEs
assi (resi 56   and name HN  ) (resi 56   and name HA  )  3.00  1.20  0.50
assi (resi 56   and name HN  ) (resi 56   and name HB# )  3.00  1.20  1.50
assi (resi 56   and name HN  ) (resi 56   and name HG# )  2.50  0.70  1.20
assi (resi 56   and name HA  ) (resi 56   and name HB# )  3.00  1.20  1.50
assi (resi 56   and name HA  ) (resi 56   and name HG# )  3.00  1.20  1.10

! residue 57   Arg , intraresidue NOEs
assi (resi 57   and name HN  ) (resi 57   and name HA  )  3.00  1.20  0.50
assi (resi 57   and name HN  ) (resi 57   and name HB# )  3.00  1.20  1.10
assi (resi 57   and name HN  ) (resi 57   and name HG# )  4.00  2.20  2.00
assi (resi 57   and name HN  ) (resi 57   and name HD# )  4.00  2.20  2.60
assi (resi 57   and name HN  ) (resi 57   and name HH# )  4.00  2.20  3.00
assi (resi 57   and name HA  ) (resi 57   and name HB# )  2.50  0.70  0.80
assi (resi 57   and name HA  ) (resi 57   and name HG# )  2.50  0.70  1.20
assi (resi 57   and name HA  ) (resi 57   and name HD# )  3.00  1.20  1.50
assi (resi 57   and name HB# ) (resi 57   and name HH# )  3.00  1.20  1.70
assi (resi 57   and name HG# ) (resi 57   and name HH# )  4.00  2.20  2.20
assi (resi 57   and name HD# ) (resi 57   and name HH# )  2.50  0.70  1.40

! residue 58   Ser , intraresidue NOEs
assi (resi 58   and name HN  ) (resi 58   and name HA  )  3.00  1.20  0.50
assi (resi 58   and name HN  ) (resi 58   and name HB# )  2.50  0.70  0.80
assi (resi 58   and name HA  ) (resi 58   and name HB# )  2.50  0.70  0.80

! residue 59   Gly , intraresidue NOEs
assi (resi 59   and name HN  ) (resi 59   and name HA# )  2.50  0.70  1.20

! residue 60   Arg , intraresidue NOEs
assi (resi 60   and name HN  ) (resi 60   and name HA  )  3.00  1.20  0.50
assi (resi 60   and name HN  ) (resi 60   and name HB# )  2.50  0.70  0.80
assi (resi 60   and name HN  ) (resi 60   and name HG# )  3.00  1.20  1.50
assi (resi 60   and name HN  ) (resi 60   and name HD# )  3.00  1.20  1.10
assi (resi 60   and name HA  ) (resi 60   and name HB# )  2.50  0.70  0.80
assi (resi 60   and name HA  ) (resi 60   and name HG# )  3.00  1.20  1.50
assi (resi 60   and name HA  ) (resi 60   and name HD# )  4.00  2.20  2.00
assi (resi 60   and name HA  ) (resi 60   and name HH# )  4.00  2.20  3.40

! residue 61   Cys , intraresidue NOEs
assi (resi 61   and name HN  ) (resi 61   and name HA  )  3.00  1.20  0.50
assi (resi 61   and name HN  ) (resi 61   and name HB# )  2.50  0.70  1.20
assi (resi 61   and name HA  ) (resi 61   and name HB# )  2.50  0.70  0.80

! residue 62   Arg , intraresidue NOEs
assi (resi 62   and name HN  ) (resi 62   and name HA  )  3.00  1.20  0.50
assi (resi 62   and name HN  ) (resi 62   and name HB2 )  3.00  1.20  0.50
assi (resi 62   and name HN  ) (resi 62   and name HB1 )  4.00  2.20  1.00
assi (resi 62   and name HN  ) (resi 62   and name HG# )  4.00  2.20  1.50
assi (resi 62   and name HN  ) (resi 62   and name HD# )  4.00  2.20  2.00
assi (resi 62   and name HA  ) (resi 62   and name HB2 )  4.00  2.20  1.00
assi (resi 62   and name HA  ) (resi 62   and name HB1 )  3.00  1.20  1.50
assi (resi 62   and name HA  ) (resi 62   and name HG# )  3.00  1.20  1.50
assi (resi 62   and name HA  ) (resi 62   and name HD# )  4.00  2.20  2.00
assi (resi 62   and name HB2 ) (resi 62   and name HH# )  3.00  1.20  1.00
assi (resi 62   and name HB1 ) (resi 62   and name HH# )  3.00  1.20  1.00
assi (resi 62   and name HG# ) (resi 62   and name HH# )  3.00  1.20  1.10
assi (resi 62   and name HD# ) (resi 62   and name HH# )  3.00  1.20  1.00

! residue 63   Ala , intraresidue NOEs
assi (resi 63   and name HN  ) (resi 63   and name HA  )  3.00  1.20  0.50
assi (resi 63   and name HN  ) (resi 63   and name HB# )  2.50  0.70  1.80


Inter residue

! residue 1    Lys , NOEs forward in sequence
assi (resi 1    and name HA  ) (resi 2    and name HN  )  2.50  0.70  0.20
assi (resi 1    and name HA  ) (resi 48   and name HA# )  4.00  2.20  2.00
assi (resi 1    and name HA  ) (resi 49   and name HN  )  4.00  2.20  1.00

! residue 2    Ile , NOEs forward in sequence
assi (resi 2    and name HN  ) (resi 3    and name HN  )  4.00  2.20  1.00
assi (resi 2    and name HN  ) (resi 48   and name HN  )  3.00  1.20  0.50
assi (resi 2    and name HA  ) (resi 3    and name HN  )  2.50  0.70  0.20
assi (resi 2    and name HB  ) (resi 3    and name HN  )  3.00  1.20  1.00
assi (resi 2    and name HG2#) (resi 3    and name HN  )  3.00  1.20  2.50
assi (resi 2    and name HN  ) (resi 48   and name HA# )  4.00  2.20  3.00
assi (resi 2    and name HN  ) (resi 49   and name HG  )  3.00  1.20  0.50
assi (resi 2    and name HN  ) (resi 49   and name HD# )  4.00  2.20  5.40
assi (resi 2    and name HA  ) (resi 49   and name HN  )  4.00  2.20  1.00
assi (resi 2    and name HA  ) (resi 49   and name HD# )  4.00  2.20  5.40
assi (resi 2    and name HG2#) (resi 49   and name HN  )  3.00  1.20  2.50
assi (resi 2    and name HG2#) (resi 51   and name HN  )  3.00  1.20  2.50
assi (resi 2    and name HG2#) (resi 51   and name HA  )  2.50  0.70  2.20
assi (resi 2    and name HG2#) (resi 51   and name HB2 )  4.00  2.20  2.00
assi (resi 2    and name HB  ) (resi 53   and name HB# )  3.00  1.20  2.50
assi (resi 2    and name HG2#) (resi 53   and name HN  )  4.00  2.20  3.00
assi (resi 2    and name HG2#) (resi 53   and name HA  )  3.00  1.20  2.50
assi (resi 2    and name HG2#) (resi 53   and name HB# )  3.00  1.20  3.50
assi (resi 2    and name HD1#) (resi 53   and name HA  )  4.00  2.20  3.00
assi (resi 2    and name HD1#) (resi 51   and name HA  )  2.50  0.70  2.20
assi (resi 2    and name HN  ) (resi 50   and name HA  )  4.00  2.20  1.00
assi (resi 2    and name HD1#) (resi 51   and name HN  )  4.00  2.20  2.00
assi (resi 2    and name HD1#) (resi 3    and name HN  )  3.00  1.20  2.50
assi (resi 2    and name HD1#) (resi 49   and name HG  )  3.00  1.20  2.50
assi (resi 2    and name HD1#) (resi 53   and name HN  )  3.00  1.20  2.50

! residue 3    Asp , NOEs forward in sequence
assi (resi 3    and name HA  ) (resi 4    and name HN  )  2.50  0.70  0.20
assi (resi 3    and name HB# ) (resi 4    and name HN  )  3.00  1.20  1.50
assi (resi 3    and name HB# ) (resi 45   and name HE# )  3.00  1.20  2.50
assi (resi 3    and name HB# ) (resi 47   and name HA  )  4.00  2.20  2.00
assi (resi 3    and name HA  ) (resi 48   and name HN  )  3.00  1.20  0.50
assi (resi 3    and name HA  ) (resi 49   and name HD# )  4.00  2.20  4.00

! residue 4    Gly , NOEs forward in sequence
assi (resi 4    and name HN  ) (resi 5    and name HN  )  4.00  2.20  2.00
assi (resi 4    and name HN  ) (resi 47   and name HA  )  3.00  1.20  0.50
assi (resi 4    and name HA# ) (resi 5    and name HN  )  3.00  1.20  1.50
assi (resi 4    and name HN  ) (resi 45   and name HD# )  4.00  2.20  4.00
assi (resi 4    and name HN  ) (resi 45   and name HE# )  3.00  1.20  2.50
assi (resi 4    and name HA# ) (resi 45   and name HE# )  2.50  0.70  3.20
assi (resi 4    and name HN  ) (resi 46   and name HN  )  3.00  1.20  0.50
assi (resi 4    and name HN  ) (resi 48   and name HN  )  4.00  2.20  2.00
assi (resi 4    and name HN  ) (resi 49   and name HD# )  3.00  1.20  3.50
assi (resi 4    and name HA# ) (resi 55   and name HG2#)  3.00  1.20  3.50
assi (resi 4    and name HA# ) (resi 55   and name HD1#)  3.00  1.20  3.50
assi (resi 4    and name HA# ) (resi 55   and name HB  )  4.00  2.20  2.00

! residue 5    Tyr , NOEs forward in sequence
assi (resi 5    and name HE# ) (resi 38   and name HN  )  4.00  2.20  4.00
assi (resi 5    and name HE# ) (resi 42   and name HD# )  3.00  1.20  5.90
assi (resi 5    and name HD# ) (resi 43   and name HB# )  3.00  1.20  2.50
assi (resi 5    and name HE# ) (resi 43   and name HB# )  3.00  1.20  3.10
assi (resi 5    and name HN  ) (resi 45   and name HD# )  4.00  2.20  4.40
assi (resi 5    and name HN  ) (resi 45   and name HE# )  4.00  2.20  3.00
assi (resi 5    and name HA  ) (resi 45   and name HA  )  3.00  1.20  0.50
assi (resi 5    and name HD# ) (resi 45   and name HA  )  3.00  1.20  2.50
assi (resi 5    and name HD# ) (resi 45   and name HB# )  3.00  1.20  3.10
assi (resi 5    and name HD# ) (resi 45   and name HD# )  3.00  1.20  4.50
assi (resi 5    and name HD# ) (resi 45   and name HE# )  3.00  1.20  4.50
assi (resi 5    and name HE# ) (resi 45   and name HA  )  4.00  2.20  4.00
assi (resi 5    and name HE# ) (resi 45   and name HB# )  3.00  1.20  3.50
assi (resi 5    and name HE# ) (resi 45   and name HD# )  3.00  1.20  4.50
assi (resi 5    and name HE# ) (resi 45   and name HE# )  3.00  1.20  4.50
assi (resi 5    and name HA  ) (resi 46   and name HN  )  3.00  1.20  0.50
assi (resi 5    and name HD# ) (resi 46   and name HN  )  4.00  2.20  4.00
assi (resi 5    and name HN  ) (resi 55   and name HB  )  4.00  2.20  1.00
assi (resi 5    and name HD# ) (resi 55   and name HB  )  4.00  2.20  4.00
assi (resi 5    and name HD# ) (resi 55   and name HD1#)  4.00  2.20  5.40
assi (resi 5    and name HN  ) (resi 56   and name HN  )  4.00  2.20  1.00
assi (resi 5    and name HN  ) (resi 56   and name HG# )  4.00  2.20  3.00
assi (resi 5    and name HB# ) (resi 56   and name HN  )  4.00  2.20  2.00
assi (resi 5    and name HD# ) (resi 56   and name HN  )  4.00  2.20  4.00
assi (resi 5    and name HD# ) (resi 56   and name HG# )  3.00  1.20  3.10
assi (resi 5    and name HN  ) (resi 55   and name HG2#)  4.00  2.20  4.00
assi (resi 5    and name HN  ) (resi 55   and name HD1#)  4.00  2.20  4.00
assi (resi 5    and name HA  ) (resi 6    and name HD# )  2.50  0.70  1.20

! residue 6    Pro , NOEs forward in sequence
assi (resi 6    and name HA  ) (resi 7    and name HN  )  2.50  0.70  0.20
assi (resi 6    and name HA  ) (resi 7    and name HG# )  2.50  0.70  3.60
assi (resi 6    and name HB# ) (resi 7    and name HG# )  3.00  1.20  4.90
assi (resi 6    and name HA  ) (resi 55   and name HG2#)  2.50  0.70  2.20
assi (resi 6    and name HA  ) (resi 55   and name HD1#)  2.50  0.70  3.20
assi (resi 6    and name HA  ) (resi 56   and name HN  )  4.00  2.20  1.00
assi (resi 6    and name HA  ) (resi 30   and name HD# )  4.00  2.20  4.40
assi (resi 6    and name HD# ) (resi 46   and name HN  )  3.00  1.20  1.50
assi (resi 6    and name HB# ) (resi 27   and name HA  )  4.00  2.20  2.00
assi (resi 6    and name HA  ) (resi 55   and name HB  )  4.00  2.20  1.00

! residue 7    Val , NOEs forward in sequence
assi (resi 7    and name HA  ) (resi 8    and name HN  )  2.50  0.70  0.20
assi (resi 7    and name HB  ) (resi 8    and name HN  )  2.50  0.70  0.20
assi (resi 7    and name HG# ) (resi 8    and name HN  )  2.50  0.70  3.60
assi (resi 7    and name HG# ) (resi 8    and name HA  )  4.00  2.20  5.40
assi (resi 7    and name HG# ) (resi 11   and name HN  )  3.00  1.20  3.90
assi (resi 7    and name HG# ) (resi 11   and name HA  )  2.50  0.70  3.60
assi (resi 7    and name HG# ) (resi 54   and name HA  )  3.00  1.20  3.90
assi (resi 7    and name HG# ) (resi 54   and name HB# )  3.00  1.20  4.90
assi (resi 7    and name HG# ) (resi 54   and name HG# )  3.00  1.20  4.90
assi (resi 7    and name HG# ) (resi 54   and name HD# )  3.00  1.20  3.90
assi (resi 7    and name HG# ) (resi 54   and name HH# )  3.00  1.20  3.90
assi (resi 7    and name HN  ) (resi 55   and name HD1#)  3.00  1.20  3.50
assi (resi 7    and name HG# ) (resi 55   and name HN  )  4.00  2.20  4.40
assi (resi 7    and name HG# ) (resi 55   and name HA  )  2.50  0.70  3.60
assi (resi 7    and name HN  ) (resi 55   and name HA  )  3.00  1.20  0.50
assi (resi 7    and name HG# ) (resi 55   and name HB  )  3.00  1.20  3.00
assi (resi 7    and name HN  ) (resi 56   and name HN  )  4.00  2.20  2.00
assi (resi 7    and name HG# ) (resi 56   and name HN  )  2.50  0.70  3.60
assi (resi 7    and name HG# ) (resi 56   and name HA  )  2.50  0.70  3.60
assi (resi 7    and name HG# ) (resi 56   and name HB# )  3.00  1.20  4.90
assi (resi 7    and name HG# ) (resi 56   and name HG# )  2.50  0.70  4.60
assi (resi 7    and name HG# ) (resi 57   and name HN  )  3.00  1.20  3.90
assi (resi 7    and name HA  ) (resi 16   and name HN  )  4.00  2.20  1.00
assi (resi 7    and name HB  ) (resi 11   and name HA  )  2.50  0.70  0.20
assi (resi 7    and name HB  ) (resi 16   and name HN  )  4.00  2.20  2.00
assi (resi 7    and name HG# ) (resi 16   and name HN  )  3.00  1.20  3.90
assi (resi 7    and name HB  ) (resi 15   and name HA  )  3.00  1.20  0.50
assi (resi 7    and name HG# ) (resi 15   and name HA  )  3.00  1.20  3.90
assi (resi 7    and name HN  ) (resi 15   and name HA  )  4.00  2.20  1.00
assi (resi 7    and name HB  ) (resi 11   and name HN  )  3.00  1.20  1.00

! residue 8    Asp , NOEs forward in sequence
assi (resi 8    and name HN  ) (resi 11   and name HA  )  3.00  1.20  0.50
assi (resi 8    and name HA  ) (resi 11   and name HN  )  4.00  2.20  2.00
assi (resi 8    and name HA  ) (resi 9    and name HN  )  3.00  1.20  0.50
assi (resi 8    and name HA  ) (resi 9    and name HA  )  4.00  2.20  2.00
assi (resi 8    and name HA  ) (resi 9    and name HB# )  4.00  2.20  2.00
assi (resi 8    and name HB# ) (resi 9    and name HN  )  2.50  0.70  1.20
assi (resi 8    and name HN  ) (resi 15   and name HA  )  3.00  1.20  0.50
assi (resi 8    and name HA  ) (resi 10   and name HN  )  4.00  2.20  2.00
assi (resi 8    and name HB# ) (resi 10   and name HN  )  4.00  2.20  2.00
assi (resi 8    and name HN  ) (resi 9    and name HN  )  4.00  2.20  2.00

! residue 9    Tyr , NOEs forward in sequence
assi (resi 9    and name HA  ) (resi 10   and name HN  )  4.00  2.20  1.00
assi (resi 9    and name HN  ) (resi 10   and name HN  )  2.50  0.70  0.20
assi (resi 9    and name HN  ) (resi 11   and name HN  )  4.00  2.20  1.00
assi (resi 9    and name HB# ) (resi 10   and name HN  )  4.00  2.20  2.00
assi (resi 9    and name HB# ) (resi 10   and name HE1 )  4.00  2.20  3.00
assi (resi 9    and name HB# ) (resi 10   and name HE3 )  4.00  2.20  2.00
assi (resi 9    and name HD# ) (resi 10   and name HN  )  4.00  2.20  3.00
assi (resi 9    and name HD# ) (resi 10   and name HA  )  4.00  2.20  4.00
assi (resi 9    and name HD# ) (resi 10   and name HD1 )  4.00  2.20  3.00
assi (resi 9    and name HD# ) (resi 10   and name HE1 )  4.00  2.20  3.00
assi (resi 9    and name HD# ) (resi 10   and name HZ2 )  3.00  1.20  2.50
assi (resi 9    and name HE# ) (resi 10   and name HE1 )  4.00  2.20  3.00
assi (resi 9    and name HA  ) (resi 54   and name HD# )  3.00  1.20  1.50
assi (resi 9    and name HD# ) (resi 54   and name HD# )  4.00  2.20  5.00
assi (resi 9    and name HN  ) (resi 10   and name HE3 )  4.00  2.20  1.00
assi (resi 9    and name HE# ) (resi 10   and name HZ2 )  4.00  2.20  4.00
assi (resi 9    and name HE# ) (resi 10   and name HH2 )  4.00  2.20  3.00
assi (resi 9    and name HD# ) (resi 10   and name HE3 )  4.00  2.20  4.00
assi (resi 9    and name HA  ) (resi 54   and name HH# )  4.00  2.20  2.00
assi (resi 9    and name HN  ) (resi 10   and name HN  )  3.00  1.20  0.50

! residue 10   Trp , NOEs forward in sequence
assi (resi 10   and name HN  ) (resi 11   and name HN  )  2.50  0.70  0.20
assi (resi 10   and name HN  ) (resi 11   and name HA  )  4.00  2.20  1.00
assi (resi 10   and name HA  ) (resi 11   and name HN  )  3.00  1.20  0.50
assi (resi 10   and name HA  ) (resi 11   and name HA  )  4.00  2.20  2.00
assi (resi 10   and name HB# ) (resi 11   and name HN  )  4.00  2.20  2.00
assi (resi 10   and name HB# ) (resi 61   and name HA  )  4.00  2.20  2.00
assi (resi 10   and name HD1 ) (resi 62   and name HN  )  4.00  2.20  2.00
assi (resi 10   and name HD1 ) (resi 62   and name HB2 )  3.00  1.20  0.50
assi (resi 10   and name HD1 ) (resi 62   and name HB1 )  3.00  1.20  0.50
assi (resi 10   and name HD1 ) (resi 62   and name HG# )  3.00  1.20  1.50
assi (resi 10   and name HE1 ) (resi 62   and name HG# )  4.00  2.20  3.00
assi (resi 10   and name HE3 ) (resi 62   and name HB2 )  4.00  2.20  2.00
assi (resi 10   and name HE3 ) (resi 62   and name HB1 )  4.00  2.20  2.00
assi (resi 10   and name HB# ) (resi 62   and name HN  )  3.00  1.20  1.50
assi (resi 10   and name HD1 ) (resi 63   and name HA  )  4.00  2.20  1.00
assi (resi 10   and name HD1 ) (resi 63   and name HB# )  3.00  1.20  1.50
assi (resi 10   and name HE1 ) (resi 63   and name HB# )  4.00  2.20  1.30
assi (resi 10   and name HE3 ) (resi 63   and name HB# )  4.00  2.20  3.00
assi (resi 10   and name HB# ) (resi 63   and name HN  )  4.00  2.20  2.00
assi (resi 10   and name HE3 ) (resi 11   and name HN  )  4.00  2.20  1.00
assi (resi 10   and name HN  ) (resi 13   and name HN  )  4.00  2.20  1.00
assi (resi 10   and name HA  ) (resi 62   and name HN  )  4.00  2.20  1.00

! residue 11   Asn , NOEs forward in sequence
assi (resi 11   and name HA  ) (resi 12   and name HN  )  4.00  2.20  1.00
assi (resi 11   and name HN  ) (resi 12   and name HN  )  2.50  0.70  0.20
assi (resi 11   and name HB2 ) (resi 58   and name HA  )  4.00  2.20  2.00
assi (resi 11   and name HB1 ) (resi 58   and name HA  )  4.00  2.20  2.00
assi (resi 11   and name HD2#) (resi 59   and name HN  )  4.00  2.20  3.00
assi (resi 11   and name HD2#) (resi 59   and name HA# )  3.00  1.20  2.50
assi (resi 11   and name HD2#) (resi 60   and name HN  )  4.00  2.20  2.00
assi (resi 11   and name HB2 ) (resi 61   and name HA  )  3.00  1.20  0.50
assi (resi 11   and name HB1 ) (resi 61   and name HA  )  4.00  2.20  1.00
assi (resi 11   and name HB2 ) (resi 62   and name HN  )  4.00  2.20  2.00
assi (resi 11   and name HB1 ) (resi 62   and name HN  )  4.00  2.20  2.00

! residue 12   Cys , NOEs forward in sequence
assi (resi 12   and name HN  ) (resi 13   and name HN  )  3.00  1.20  0.50
assi (resi 12   and name HA  ) (resi 13   and name HN  )  3.00  1.20  0.50
assi (resi 12   and name HB# ) (resi 13   and name HN  )  3.00  1.20  1.50
assi (resi 12   and name HN  ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 12   and name HN  ) (resi 61   and name HA  )  3.00  1.20  0.50
assi (resi 12   and name HA  ) (resi 61   and name HA  )  3.00  1.20  0.50

! residue 13   Lys , NOEs forward in sequence

! residue 14   Arg , NOEs forward in sequence

! residue 15   Ile , NOEs forward in sequence
assi (resi 15   and name HN  ) (resi 16   and name HN  )  4.00  2.20  1.00
assi (resi 15   and name HA  ) (resi 16   and name HN  )  3.00  1.20  0.50

! residue 16   Cys , NOEs forward in sequence
assi (resi 16   and name HN  ) (resi 17   and name HN  )  4.00  2.20  1.00
assi (resi 16   and name HA  ) (resi 17   and name HN  )  2.50  0.70  0.20
assi (resi 16   and name HB2 ) (resi 17   and name HN  )  4.00  2.20  1.00
assi (resi 16   and name HB1 ) (resi 17   and name HN  )  4.00  2.20  1.00
assi (resi 16   and name HN  ) (resi 43   and name HN  )  4.00  2.20  2.00
assi (resi 16   and name HB1 ) (resi 43   and name HA  )  4.00  2.20  1.00
assi (resi 16   and name HB# ) (resi 44   and name HN  )  4.00  2.20  2.00

! residue 17   Trp , NOEs forward in sequence
assi (resi 17   and name HE1 ) (resi 18   and name HD# )  4.00  2.20  4.00
assi (resi 17   and name HE1 ) (resi 22   and name HB# )  4.00  2.20  3.00
assi (resi 17   and name HE3 ) (resi 22   and name HA  )  4.00  2.20  1.00
assi (resi 17   and name HE3 ) (resi 22   and name HB# )  3.00  1.20  1.50
assi (resi 17   and name HE3 ) (resi 23   and name HA  )  4.00  2.20  2.00
assi (resi 17   and name HE3 ) (resi 23   and name HB# )  4.00  2.20  2.00

! residue 18   Tyr , NOEs forward in sequence
assi (resi 18   and name HA  ) (resi 19   and name HN  )  3.00  1.20  0.50
assi (resi 18   and name HN  ) (resi 19   and name HN  )  4.00  2.20  1.00
assi (resi 18   and name HB# ) (resi 19   and name HN  )  3.00  1.20  1.50
assi (resi 18   and name HD# ) (resi 39   and name HA# )  4.00  2.20  4.00
assi (resi 18   and name HE# ) (resi 39   and name HA# )  4.00  2.20  4.00

! residue 19   Asn , NOEs forward in sequence
assi (resi 19   and name HA  ) (resi 20   and name HN  )  2.50  0.70  0.20
assi (resi 19   and name HA  ) (resi 21   and name HN  )  4.00  2.20  1.00
assi (resi 19   and name HB# ) (resi 22   and name HN  )  2.50  0.70  1.20
assi (resi 19   and name HB# ) (resi 22   and name HB# )  4.00  2.20  3.00
assi (resi 19   and name HB# ) (resi 22   and name HA  )  3.00  1.20  1.50

! residue 20   Asn , NOEs forward in sequence
assi (resi 20   and name HN  ) (resi 21   and name HN  )  3.00  1.20  0.50
assi (resi 20   and name HA  ) (resi 21   and name HN  )  4.00  2.20  1.00
assi (resi 20   and name HB# ) (resi 21   and name HN  )  4.00  2.20  2.00
assi (resi 20   and name HN  ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 20   and name HA  ) (resi 36   and name HD# )  4.00  2.20  4.40
assi (resi 20   and name HB# ) (resi 36   and name HA  )  4.00  2.20  3.00
assi (resi 20   and name HA  ) (resi 37   and name HN  )  4.00  2.20  1.00

! residue 21   Lys , NOEs forward in sequence
assi (resi 21   and name HN  ) (resi 22   and name HN  )  2.50  0.70  0.20
assi (resi 21   and name HA  ) (resi 22   and name HN  )  4.00  2.20  1.00
assi (resi 21   and name HB# ) (resi 22   and name HN  )  3.00  1.20  1.50
assi (resi 21   and name HN  ) (resi 23   and name HN  )  4.00  2.20  1.00
assi (resi 21   and name HA  ) (resi 24   and name HN  )  3.00  1.20  0.50
assi (resi 21   and name HA  ) (resi 24   and name HB# )  2.50  0.70  1.20

! residue 22   Tyr , NOEs forward in sequence
assi (resi 22   and name HA  ) (resi 23   and name HN  )  4.00  2.20  1.00
assi (resi 22   and name HB# ) (resi 23   and name HN  )  2.50  0.70  1.20
assi (resi 22   and name HN  ) (resi 24   and name HN  )  4.00  2.20  1.00
assi (resi 22   and name HN  ) (resi 23   and name HN  )  2.50  0.70  1.20
assi (resi 22   and name HA  ) (resi 25   and name HB# )  3.00  1.20  1.50

! residue 23   Cys , NOEs forward in sequence
assi (resi 23   and name HN  ) (resi 24   and name HN  )  2.50  0.70  0.20
assi (resi 23   and name HA  ) (resi 24   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HA  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 23   and name HA  ) (resi 26   and name HB# )  2.50  0.70  1.20

! residue 24   Asn , NOEs forward in sequence
assi (resi 24   and name HA  ) (resi 27   and name HB1 )  3.00  1.20  0.50
assi (resi 24   and name HA  ) (resi 27   and name HB2 )  3.00  1.20  0.50
assi (resi 24   and name HA  ) (resi 35   and name HN  )  3.00  1.20  0.50
assi (resi 24   and name HB# ) (resi 35   and name HN  )  4.00  2.20  2.00
assi (resi 24   and name HN  ) (resi 27   and name HB2 )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 28   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 27   and name HN  )  3.00  1.20  0.50
assi (resi 24   and name HN  ) (resi 26   and name HN  )  4.00  2.20  1.00
assi (resi 24   and name HA  ) (resi 36   and name HN  )  4.00  2.20  1.00

! residue 25   Asp , NOEs forward in sequence
assi (resi 25   and name HA  ) (resi 28   and name HB# )  3.00  1.20  1.50

! residue 26   Leu , NOEs forward in sequence
assi (resi 26   and name HA  ) (resi 27   and name HN  )  4.00  2.20  1.00
assi (resi 26   and name HN  ) (resi 27   and name HN  )  2.50  0.70  0.20
assi (resi 26   and name HD# ) (resi 30   and name HD# )  2.50  0.70  6.00
assi (resi 26   and name HA  ) (resi 30   and name HN  )  4.00  2.20  1.00

! residue 27   Cys , NOEs forward in sequence
assi (resi 27   and name HN  ) (resi 28   and name HN  )  2.50  0.70  0.20
assi (resi 27   and name HA  ) (resi 28   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HB1 ) (resi 28   and name HN  )  4.00  2.20  1.00
assi (resi 27   and name HB2 ) (resi 28   and name HN  )  3.00  1.20  0.50
assi (resi 27   and name HA  ) (resi 30   and name HN  )  3.00  1.20  0.50
assi (resi 27   and name HA  ) (resi 32   and name HB# )  3.00  1.20  2.50
assi (resi 27   and name HB1 ) (resi 32   and name HN  )  3.00  1.20  1.00
assi (resi 27   and name HB2 ) (resi 32   and name HN  )  4.00  2.20  2.00
assi (resi 27   and name HB1 ) (resi 32   and name HB# )  2.50  0.70  1.20
assi (resi 27   and name HB2 ) (resi 32   and name HB# )  4.00  2.20  2.00
assi (resi 27   and name HN  ) (resi 49   and name HD# )  4.00  2.20  4.50
assi (resi 27   and name HA  ) (resi 30   and name HB# )  3.00  1.20  1.50
assi (resi 27   and name HA  ) (resi 30   and name HD# )  2.50  0.70  3.60
assi (resi 27   and name HN  ) (resi 32   and name HB# )  4.00  2.20  3.00
assi (resi 27   and name HB# ) (resi 35   and name HN  )  4.00  2.20  2.00

! residue 28   Lys , NOEs forward in sequence
assi (resi 28   and name HN  ) (resi 29   and name HN  )  2.50  0.70  0.20
assi (resi 28   and name HN  ) (resi 30   and name HN  )  4.00  2.20  1.00
assi (resi 28   and name HA  ) (resi 29   and name HN  )  3.00  1.20  0.50
assi (resi 28   and name HA  ) (resi 32   and name HN  )  2.50  0.70  0.20
assi (resi 28   and name HA  ) (resi 33   and name HN  )  4.00  2.20  1.00
assi (resi 28   and name HB# ) (resi 29   and name HN  )  3.00  1.20  1.50
assi (resi 28   and name HG# ) (resi 29   and name HN  )  4.00  2.20  3.00
assi (resi 28   and name HD# ) (resi 29   and name HN  )  4.00  2.20  2.00
assi (resi 28   and name HN  ) (resi 32   and name HB# )  4.00  2.20  3.00
assi (resi 28   and name HD# ) (resi 32   and name HN  )  4.00  2.20  3.00
assi (resi 28   and name HD# ) (resi 34   and name HA  )  4.00  2.20  2.00

! residue 29   Gly , NOEs forward in sequence
assi (resi 29   and name HN  ) (resi 30   and name HN  )  3.00  1.20  0.50
assi (resi 29   and name HN  ) (resi 30   and name HD1#)  4.00  2.20  4.40
assi (resi 29   and name HA# ) (resi 30   and name HN  )  4.00  2.20  2.00
assi (resi 29   and name HN  ) (resi 31   and name HN  )  3.00  1.20  1.00
assi (resi 29   and name HA# ) (resi 31   and name HN  )  4.00  2.20  2.00

! residue 30   Leu , NOEs forward in sequence
assi (resi 30   and name HN  ) (resi 31   and name HN  )  2.50  0.70  0.20
assi (resi 30   and name HN  ) (resi 31   and name HA  )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 31   and name HN  )  3.00  1.20  0.50
assi (resi 30   and name HA  ) (resi 31   and name HA  )  4.00  2.20  1.00
assi (resi 30   and name HN  ) (resi 32   and name HN  )  4.00  2.20  1.00
assi (resi 30   and name HA  ) (resi 32   and name HN  )  4.00  2.20  1.00
assi (resi 30   and name HD# ) (resi 31   and name HN  )  4.00  2.20  4.40
assi (resi 30   and name HB# ) (resi 50   and name HD# )  3.00  1.20  2.50

! residue 31   Lys , NOEs forward in sequence
assi (resi 31   and name HN  ) (resi 32   and name HN  )  2.50  0.70  0.20
assi (resi 31   and name HN  ) (resi 49   and name HA  )  4.00  2.20  1.00
assi (resi 31   and name HA  ) (resi 32   and name HN  )  3.00  1.20  0.50
assi (resi 31   and name HB1 ) (resi 32   and name HN  )  4.00  2.20  1.00
assi (resi 31   and name HG# ) (resi 48   and name HA# )  3.00  1.20  2.50

! residue 32   Ala , NOEs forward in sequence
assi (resi 32   and name HN  ) (resi 46   and name HB2 )  4.00  2.20  2.00
assi (resi 32   and name HB# ) (resi 46   and name HN  )  4.00  2.20  4.00
assi (resi 32   and name HB# ) (resi 46   and name HA  )  4.00  2.20  3.00
assi (resi 32   and name HB# ) (resi 46   and name HB2 )  3.00  1.20  1.50
assi (resi 32   and name HB# ) (resi 46   and name HB1 )  2.50  0.70  1.20
assi (resi 32   and name HB# ) (resi 47   and name HN  )  3.00  1.20  2.50
assi (resi 32   and name HA  ) (resi 48   and name HA# )  4.00  2.20  2.00
assi (resi 32   and name HN  ) (resi 49   and name HB# )  4.00  2.20  3.00
assi (resi 32   and name HN  ) (resi 49   and name HD# )  3.00  1.20  3.90
assi (resi 32   and name HA  ) (resi 49   and name HA  )  3.00  1.20  0.50
assi (resi 32   and name HB# ) (resi 49   and name HN  )  3.00  1.20  2.50
assi (resi 32   and name HA  ) (resi 47   and name HN  )  4.00  2.20  2.00
assi (resi 32   and name HB# ) (resi 49   and name HA  )  2.50  0.70  2.20
assi (resi 32   and name HB# ) (resi 48   and name HA# )  3.00  1.20  3.50
assi (resi 32   and name HB# ) (resi 50   and name HD# )  4.00  2.20  4.00
assi (resi 32   and name HB# ) (resi 53   and name HB# )  3.00  1.20  3.50
assi (resi 32   and name HA  ) (resi 34   and name HN  )  4.00  2.20  1.00
assi (resi 32   and name HA  ) (resi 49   and name HN  )  4.00  2.20  1.00

! residue 33   Asp , NOEs forward in sequence
assi (resi 33   and name HA  ) (resi 34   and name HN  )  3.00  1.20  0.50
assi (resi 33   and name HA  ) (resi 35   and name HN  )  4.00  2.20  1.00

! residue 34   Ser , NOEs forward in sequence
assi (resi 34   and name HA  ) (resi 35   and name HN  )  2.50  0.70  0.20
assi (resi 34   and name HB# ) (resi 35   and name HN  )  3.00  1.20  1.50
assi (resi 34   and name HN  ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 34   and name HN  ) (resi 47   and name HB# )  4.00  2.20  2.00
assi (resi 34   and name HA  ) (resi 47   and name HN  )  4.00  2.20  1.00

! residue 35   Gly , NOEs forward in sequence
assi (resi 35   and name HA# ) (resi 36   and name HN  )  2.50  0.70  0.70
assi (resi 35   and name HN  ) (resi 46   and name HA  )  4.00  2.20  1.00
assi (resi 35   and name HA# ) (resi 47   and name HN  )  4.00  2.20  2.00

! residue 36   Tyr , NOEs forward in sequence
assi (resi 36   and name HN  ) (resi 37   and name HN  )  4.00  2.20  2.00
assi (resi 36   and name HA  ) (resi 37   and name HN  )  2.50  0.70  0.20
assi (resi 36   and name HB# ) (resi 37   and name HN  )  3.00  1.20  1.00
assi (resi 36   and name HD# ) (resi 37   and name HN  )  4.00  2.20  3.00
assi (resi 36   and name HD# ) (resi 38   and name HA  )  3.00  1.20  2.90
assi (resi 36   and name HD# ) (resi 38   and name HE3 )  3.00  1.20  2.50
assi (resi 36   and name HD# ) (resi 38   and name HB# )  4.00  2.20  5.00
assi (resi 36   and name HE# ) (resi 38   and name HA  )  3.00  1.20  2.90
assi (resi 36   and name HE# ) (resi 38   and name HE3 )  2.50  0.70  2.20
assi (resi 36   and name HE# ) (resi 38   and name HB# )  4.00  2.20  4.40
assi (resi 36   and name HN  ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 36   and name HN  ) (resi 45   and name HD# )  4.00  2.20  4.40
assi (resi 36   and name HD# ) (resi 45   and name HB# )  4.00  2.20  5.40
assi (resi 36   and name HD# ) (resi 45   and name HD# )  3.00  1.20  4.50
assi (resi 36   and name HE# ) (resi 45   and name HB# )  4.00  2.20  4.40
assi (resi 36   and name HE# ) (resi 45   and name HD# )  3.00  1.20  4.50
assi (resi 36   and name HE# ) (resi 45   and name HE# )  4.00  2.20  5.00
assi (resi 36   and name HN  ) (resi 46   and name HA  )  3.00  1.20  0.50
assi (resi 36   and name HE# ) (resi 47   and name HG# )  4.00  2.20  4.40
assi (resi 36   and name HD# ) (resi 46   and name HA  )  4.00  2.20  3.40

! residue 37   Cys , NOEs forward in sequence
assi (resi 37   and name HA  ) (resi 38   and name HN  )  2.50  0.70  0.20
assi (resi 37   and name HA  ) (resi 45   and name HN  )  3.00  1.20  0.50
assi (resi 37   and name HA  ) (resi 44   and name HA  )  3.00  1.20  0.50
assi (resi 37   and name HB# ) (resi 44   and name HA  )  3.00  1.20  1.50

! residue 38   Trp , NOEs forward in sequence
assi (resi 38   and name HA  ) (resi 39   and name HN  )  2.50  0.70  0.20
assi (resi 38   and name HA  ) (resi 39   and name HA# )  4.00  2.20  2.00
assi (resi 38   and name HD1 ) (resi 40   and name HE1 )  4.00  2.20  2.00
assi (resi 38   and name HD1 ) (resi 40   and name HE3 )  4.00  2.20  2.00
assi (resi 38   and name HD1 ) (resi 40   and name HA  )  4.00  2.20  1.00
assi (resi 38   and name HD1 ) (resi 40   and name HB# )  4.00  2.20  2.00
assi (resi 38   and name HD1 ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HE1 ) (resi 40   and name HB1 )  4.00  2.20  2.00
assi (resi 38   and name HE1 ) (resi 41   and name HG2#)  4.00  2.20  3.00
assi (resi 38   and name HE3 ) (resi 42   and name HD# )  3.00  1.20  3.50
assi (resi 38   and name HH2 ) (resi 42   and name HD# )  4.00  2.20  3.90
assi (resi 38   and name HN  ) (resi 43   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HN  ) (resi 44   and name HA  )  3.00  1.20  0.50
assi (resi 38   and name HB# ) (resi 44   and name HA  )  4.00  2.20  2.00
assi (resi 38   and name HB# ) (resi 45   and name HA  )  4.00  2.20  3.00
assi (resi 38   and name HB# ) (resi 45   and name HN  )  4.00  2.20  2.00
assi (resi 38   and name HE3 ) (resi 39   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HN  ) (resi 45   and name HN  )  4.00  2.20  1.00
assi (resi 38   and name HA  ) (resi 40   and name HN  )  4.00  2.20  2.00
assi (resi 38   and name HB# ) (resi 40   and name HD1 )  4.00  2.20  2.00

! residue 39   Gly , NOEs forward in sequence
assi (resi 39   and name HA# ) (resi 42   and name HN  )  4.00  2.20  2.00
assi (resi 39   and name HA# ) (resi 40   and name HN  )  4.00  2.20  2.00
assi (resi 39   and name HN  ) (resi 40   and name HN  )  4.00  2.20  1.00

! residue 40   Trp , NOEs forward in sequence
assi (resi 40   and name HN  ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HN  ) (resi 42   and name HN  )  4.00  2.20  2.00
assi (resi 40   and name HA  ) (resi 41   and name HN  )  3.00  1.20  0.50
assi (resi 40   and name HD1 ) (resi 41   and name HN  )  3.00  1.20  0.50
assi (resi 40   and name HE1 ) (resi 41   and name HN  )  4.00  2.20  2.00
assi (resi 40   and name HE1 ) (resi 41   and name HG2#)  3.00  1.20  2.50
assi (resi 40   and name HB1 ) (resi 41   and name HN  )  4.00  2.20  1.00
assi (resi 40   and name HB2 ) (resi 41   and name HN  )  4.00  2.20  2.00
assi (resi 40   and name HB1 ) (resi 41   and name HG2#)  4.00  2.20  2.00
assi (resi 40   and name HB2 ) (resi 41   and name HG2#)  3.00  1.20  2.90
assi (resi 40   and name HD1 ) (resi 42   and name HD# )  3.00  1.20  3.90
assi (resi 40   and name HD1 ) (resi 42   and name HG  )  4.00  2.20  1.00
assi (resi 40   and name HA  ) (resi 42   and name HN  )  4.00  2.20  2.00
assi (resi 40   and name HD1 ) (resi 41   and name HG2#)  2.50  0.70  2.20

! residue 41   Thr , NOEs forward in sequence
assi (resi 41   and name HN  ) (resi 42   and name HN  )  2.50  0.70  0.20
assi (resi 41   and name HN  ) (resi 42   and name HA  )  4.00  2.20  1.00
assi (resi 41   and name HA  ) (resi 42   and name HN  )  4.00  2.20  1.00
assi (resi 41   and name HG2#) (resi 42   and name HN  )  4.00  2.20  3.00
assi (resi 41   and name HB  ) (resi 42   and name HN  )  4.00  2.20  1.00

! residue 42   Leu , NOEs forward in sequence
assi (resi 42   and name HN  ) (resi 43   and name HN  )  3.00  1.20  0.50
assi (resi 42   and name HA  ) (resi 43   and name HN  )  3.00  1.20  0.50
assi (resi 42   and name HD# ) (resi 43   and name HN  )  4.00  2.20  4.40

! residue 43   Ser , NOEs forward in sequence
assi (resi 43   and name HN  ) (resi 44   and name HN  )  4.00  2.20  2.00
assi (resi 43   and name HA  ) (resi 44   and name HN  )  2.50  0.70  0.20
assi (resi 43   and name HB# ) (resi 44   and name HN  )  3.00  1.20  1.50

! residue 44   Cys , NOEs forward in sequence
assi (resi 44   and name HN  ) (resi 45   and name HN  )  4.00  2.20  2.00
assi (resi 44   and name HA  ) (resi 45   and name HN  )  2.50  0.70  0.20
assi (resi 44   and name HB1 ) (resi 45   and name HN  )  4.00  2.20  2.00
assi (resi 44   and name HB2 ) (resi 45   and name HN  )  4.00  2.20  1.00

! residue 45   Tyr , NOEs forward in sequence
assi (resi 45   and name HA  ) (resi 46   and name HN  )  2.50  0.70  0.20
assi (resi 45   and name HD# ) (resi 46   and name HN  )  3.00  1.20  2.90
assi (resi 45   and name HE# ) (resi 46   and name HN  )  4.00  2.20  4.00
assi (resi 45   and name HD# ) (resi 47   and name HG# )  3.00  1.20  4.00
assi (resi 45   and name HE# ) (resi 47   and name HB# )  3.00  1.20  3.50
assi (resi 45   and name HE# ) (resi 47   and name HG# )  3.00  1.20  3.50

! residue 46   Cys , NOEs forward in sequence
assi (resi 46   and name HA  ) (resi 47   and name HN  )  2.50  0.70  0.20
assi (resi 46   and name HB2 ) (resi 47   and name HN  )  4.00  2.20  1.00
assi (resi 46   and name HB1 ) (resi 47   and name HN  )  3.00  1.20  0.50
assi (resi 46   and name HN  ) (resi 49   and name HD# )  3.00  1.20  3.90
assi (resi 46   and name HA  ) (resi 49   and name HD# )  4.00  2.20  5.40
assi (resi 46   and name HB2 ) (resi 49   and name HN  )  4.00  2.20  2.00
assi (resi 46   and name HB2 ) (resi 49   and name HD# )  2.50  0.70  2.20
assi (resi 46   and name HB1 ) (resi 49   and name HD# )  3.00  1.20  2.50

! residue 47   Gln , NOEs forward in sequence
assi (resi 47   and name HA  ) (resi 48   and name HN  )  2.50  0.70  0.20
assi (resi 47   and name HA  ) (resi 48   and name HA# )  3.00  1.20  1.50
assi (resi 47   and name HB# ) (resi 48   and name HN  )  3.00  1.20  1.50
assi (resi 47   and name HG# ) (resi 48   and name HN  )  4.00  2.20  2.00

! residue 48   Gly , NOEs forward in sequence
assi (resi 48   and name HA# ) (resi 49   and name HN  )  3.00  1.20  1.50
assi (resi 48   and name HA# ) (resi 49   and name HA  )  3.00  1.20  1.50
assi (resi 48   and name HA# ) (resi 49   and name HD# )  3.00  1.20  4.90
assi (resi 48   and name HN  ) (resi 49   and name HG  )  4.00  2.20  1.00

! residue 49   Leu , NOEs forward in sequence
assi (resi 49   and name HA  ) (resi 50   and name HD# )  2.50  0.70  1.20
assi (resi 49   and name HD# ) (resi 50   and name HD# )  3.00  1.20  4.90
assi (resi 49   and name HN  ) (resi 53   and name HB# )  3.00  1.20  2.50
assi (resi 49   and name HD# ) (resi 53   and name HA  )  4.00  2.20  4.40
assi (resi 49   and name HD# ) (resi 53   and name HB# )  3.00  1.20  4.90
assi (resi 49   and name HD# ) (resi 55   and name HG1#)  2.50  0.70  4.60
assi (resi 49   and name HN  ) (resi 50   and name HD# )  4.00  2.20  3.00
assi (resi 49   and name HG  ) (resi 50   and name HN  )  4.00  2.20  1.00
assi (resi 49   and name HA  ) (resi 50   and name HB# )  3.00  1.20  2.50
assi (resi 49   and name HB# ) (resi 50   and name HD# )  4.00  2.20  3.00

! residue 50   Pro , NOEs forward in sequence
assi (resi 50   and name HA  ) (resi 51   and name HN  )  2.50  0.70  0.20
assi (resi 50   and name HA  ) (resi 51   and name HB1 )  4.00  2.20  1.00
assi (resi 50   and name HA  ) (resi 51   and name HB2 )  4.00  2.20  2.00
assi (resi 50   and name HB# ) (resi 51   and name HN  )  3.00  1.20  1.50
assi (resi 50   and name HG# ) (resi 51   and name HN  )  4.00  2.20  2.00
assi (resi 50   and name HA  ) (resi 52   and name HN  )  3.00  1.20  1.00
assi (resi 50   and name HB# ) (resi 52   and name HN  )  3.00  1.20  1.50
assi (resi 50   and name HA  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 50   and name HA  ) (resi 53   and name HB# )  4.00  2.20  4.00
assi (resi 50   and name HB# ) (resi 53   and name HN  )  3.00  1.20  1.50
assi (resi 50   and name HG# ) (resi 53   and name HN  )  4.00  2.20  2.00
assi (resi 50   and name HD# ) (resi 53   and name HA  )  4.00  2.20  3.00
assi (resi 50   and name HD# ) (resi 53   and name HB# )  3.00  1.20  3.50

! residue 51   Asp , NOEs forward in sequence
assi (resi 51   and name HN  ) (resi 52   and name HN  )  2.50  0.70  0.20
assi (resi 51   and name HA  ) (resi 52   and name HN  )  3.00  1.20  0.50
assi (resi 51   and name HB1 ) (resi 52   and name HN  )  3.00  1.20  0.50
assi (resi 51   and name HB2 ) (resi 52   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HN  ) (resi 53   and name HN  )  4.00  2.20  1.00
assi (resi 51   and name HA  ) (resi 53   and name HN  )  3.00  1.20  0.50

! residue 52   Asn , NOEs forward in sequence
assi (resi 52   and name HN  ) (resi 53   and name HN  )  2.50  0.70  0.20
assi (resi 52   and name HN  ) (resi 53   and name HB# )  3.00  1.20  2.50
assi (resi 52   and name HA  ) (resi 53   and name HN  )  3.00  1.20  0.50
assi (resi 52   and name HA  ) (resi 53   and name HB# )  4.00  2.20  3.00
assi (resi 52   and name HB1 ) (resi 53   and name HN  )  4.00  2.20  2.00
assi (resi 52   and name HB2 ) (resi 53   and name HN  )  4.00  2.20  2.00

! residue 53   Ala , NOEs forward in sequence
assi (resi 53   and name HN  ) (resi 54   and name HN  )  4.00  2.20  1.00
assi (resi 53   and name HA  ) (resi 54   and name HN  )  2.50  0.70  0.20
assi (resi 53   and name HA  ) (resi 54   and name HA  )  4.00  2.20  2.00
assi (resi 53   and name HB# ) (resi 54   and name HN  )  2.50  0.70  2.20

! residue 54   Arg , NOEs forward in sequence
assi (resi 54   and name HN  ) (resi 55   and name HG2#)  4.00  2.20  4.00
assi (resi 54   and name HN  ) (resi 55   and name HD1#)  4.00  2.20  4.00
assi (resi 54   and name HA  ) (resi 55   and name HN  )  2.50  0.70  0.20
assi (resi 54   and name HA  ) (resi 55   and name HD1#)  3.00  1.20  2.50

! residue 55   Ile , NOEs forward in sequence
assi (resi 55   and name HN  ) (resi 56   and name HN  )  4.00  2.20  2.00
assi (resi 55   and name HA  ) (resi 56   and name HN  )  2.50  0.70  0.20
assi (resi 55   and name HA  ) (resi 56   and name HG# )  4.00  2.20  2.00
assi (resi 55   and name HB  ) (resi 56   and name HN  )  3.00  1.20  0.50
assi (resi 55   and name HG2#) (resi 56   and name HN  )  3.00  1.20  2.50
assi (resi 55   and name HD1#) (resi 56   and name HN  )  3.00  1.20  2.50
assi (resi 55   and name HN  ) (resi 57   and name HG# )  4.00  2.20  2.00

! residue 56   Lys , NOEs forward in sequence
assi (resi 56   and name HA  ) (resi 57   and name HN  )  2.50  0.70  0.20
assi (resi 56   and name HB# ) (resi 57   and name HN  )  4.00  2.20  1.00
assi (resi 56   and name HG# ) (resi 57   and name HN  )  4.00  2.20  2.00
assi (resi 56   and name HA  ) (resi 58   and name HN  )  3.00  1.20  0.50
assi (resi 56   and name HA  ) (resi 57   and name HB# )  4.00  2.20  2.00
assi (resi 56   and name HN  ) (resi 57   and name HN  )  4.00  2.20  2.00

! residue 57   Arg , NOEs forward in sequence
assi (resi 57   and name HN  ) (resi 58   and name HN  )  2.50  0.70  0.20
assi (resi 57   and name HA  ) (resi 58   and name HN  )  3.00  1.20  0.50
assi (resi 57   and name HA  ) (resi 58   and name HB# )  4.00  2.20  2.00
assi (resi 57   and name HD# ) (resi 58   and name HN  )  4.00  2.20  2.00
assi (resi 57   and name HG# ) (resi 58   and name HN  )  4.00  2.20  1.00
assi (resi 57   and name HB# ) (resi 58   and name HN  )  3.00  1.20  1.50

! residue 58   Ser , NOEs forward in sequence
assi (resi 58   and name HA  ) (resi 59   and name HN  )  2.50  0.70  0.20
assi (resi 58   and name HB# ) (resi 59   and name HN  )  2.50  0.70  1.20

! residue 59   Gly , NOEs forward in sequence
assi (resi 59   and name HA# ) (resi 60   and name HN  )  2.50  0.70  0.70

! residue 60   Arg , NOEs forward in sequence
assi (resi 60   and name HA  ) (resi 61   and name HN  )  2.50  0.70  0.20
assi (resi 60   and name HB# ) (resi 61   and name HN  )  3.00  1.20  1.50
assi (resi 60   and name HG# ) (resi 61   and name HN  )  4.00  2.20  2.00
assi (resi 60   and name HD# ) (resi 61   and name HN  )  4.00  2.20  2.00
assi (resi 60   and name HN  ) (resi 62   and name HN  )  4.00  2.20  2.00

! residue 61   Cys , NOEs forward in sequence
assi (resi 61   and name HN  ) (resi 62   and name HN  )  4.00  2.20  1.00
assi (resi 61   and name HA  ) (resi 62   and name HN  )  2.50  0.70  0.20
assi (resi 61   and name HB# ) (resi 62   and name HN  )  4.00  2.20  2.00
assi (resi 61   and name HA  ) (resi 62   and name HB2 )  4.00  2.20  2.00
assi (resi 61   and name HA  ) (resi 62   and name HB1 )  4.00  2.20  2.00
assi (resi 61   and name HA  ) (resi 62   and name HG# )  4.00  2.20  3.00

! residue 62   Arg , NOEs forward in sequence
assi (resi 62   and name HN  ) (resi 63   and name HN  )  3.00  1.20  0.50
assi (resi 62   and name HA  ) (resi 63   and name HN  )  3.00  1.20  0.50

hydrogenbond 
set message=off echo=off end

assign (resid   2 and name o   )  (resid  49 and name hn  ) 2.00 0.20 0.30
assign (resid   2 and name o   )  (resid  49 and name n   ) 3.00 0.20 0.30
assign (resid   4 and name o   )  (resid  46 and name hn  ) 2.00 0.20 0.30
assign (resid   4 and name o   )  (resid  46 and name n   ) 3.00 0.20 0.30
assign (resid   5 and name o   )  (resid  56 and name hn  ) 2.00 0.20 0.30
assign (resid   5 and name o   )  (resid  56 and name n   ) 3.00 0.20 0.30
assign (resid  10 and name o   )  (resid  62 and name hn  ) 2.00 0.20 0.30
assign (resid  10 and name o   )  (resid  62 and name n   ) 3.00 0.20 0.30
assign (resid  15 and name o   )  (resid  44 and name hn  ) 2.00 0.20 0.30
assign (resid  15 and name o   )  (resid  44 and name n   ) 3.00 0.20 0.30
assign (resid  21 and name o   )  (resid  25 and name hn  ) 2.00 0.20 0.30
assign (resid  21 and name o   )  (resid  25 and name n   ) 3.00 0.20 0.30
assign (resid  23 and name o   )  (resid  27 and name hn  ) 2.00 0.20 0.30
assign (resid  23 and name o   )  (resid  27 and name n   ) 3.00 0.20 0.30
assign (resid  24 and name o   )  (resid  28 and name hn  ) 2.00 0.20 0.30
assign (resid  24 and name o   )  (resid  28 and name n   ) 3.00 0.20 0.30
assign (resid  26 and name o   )  (resid  29 and name hn  ) 2.00 0.20 0.30
assign (resid  26 and name o   )  (resid  29 and name n   ) 3.00 0.20 0.30
assign (resid  27 and name o   )  (resid  30 and name hn  ) 2.00 0.20 0.30
assign (resid  27 and name o   )  (resid  30 and name n   ) 3.00 0.20 0.30
assign (resid  27 and name o   )  (resid  32 and name hn  ) 2.00 0.20 0.30
assign (resid  27 and name o   )  (resid  32 and name n   ) 3.00 0.20 0.30
assign (resid  28 and name o   )  (resid  31 and name hn  ) 2.00 0.20 0.30
assign (resid  28 and name o   )  (resid  31 and name n   ) 3.00 0.20 0.30
assign (resid  33 and name o   )  (resid  35 and name hn  ) 2.00 0.20 0.30
assign (resid  33 and name o   )  (resid  35 and name n   ) 3.00 0.20 0.30
assign (resid  34 and name o   )  (resid  47 and name hn  ) 2.00 0.20 0.30
assign (resid  34 and name o   )  (resid  47 and name n   ) 3.00 0.20 0.30
assign (resid  36 and name o   )  (resid  45 and name hn  ) 2.00 0.20 0.30
assign (resid  36 and name o   )  (resid  45 and name n   ) 3.00 0.20 0.30
assign (resid  43 and name o   )  (resid  38 and name hn  ) 2.00 0.20 0.30
assign (resid  43 and name o   )  (resid  38 and name n   ) 3.00 0.20 0.30
assign (resid  45 and name o   )  (resid  36 and name hn  ) 2.00 0.20 0.30
assign (resid  45 and name o   )  (resid  36 and name n   ) 3.00 0.20 0.30
assign (resid  46 and name o   )  (resid   4 and name hn  ) 2.00 0.20 0.30
assign (resid  46 and name o   )  (resid   4 and name n   ) 3.00 0.20 0.30
assign (resid  49 and name o   )  (resid   2 and name hn  ) 2.00 0.20 0.30
assign (resid  49 and name o   )  (resid   2 and name n   ) 3.00 0.20 0.30
assign (resid  50 and name o   )  (resid  53 and name hn  ) 2.00 0.20 0.30
assign (resid  50 and name o   )  (resid  53 and name n   ) 3.00 0.20 0.30
assign (resid  61 and name o   )  (resid  63 and name hn  ) 2.00 0.20 0.30
assign (resid  61 and name o   )  (resid  63 and name n   ) 3.00 0.20 0.30

set message=on echo=on end


s-sbond 
set message=off echo=off end

assign (resid  12 and name sg  )  (resid  61 and name sg  ) 2.02 0.02 0.02
assign (resid  12 and name cb  )  (resid  61 and name sg  ) 2.99 0.50 0.50 
assign (resid  12 and name sg  )  (resid  61 and name cb  ) 2.99 0.50 0.50 

assign (resid  16 and name sg  )  (resid  37 and name sg  ) 2.02 0.02 0.02 
assign (resid  16 and name cb  )  (resid  37 and name sg  ) 2.99 0.50 0.50 
assign (resid  16 and name sg  )  (resid  37 and name cb  ) 2.99 0.50 0.50 

assign (resid  23 and name sg  )  (resid  44 and name sg  ) 2.02 0.02 0.02 
assign (resid  23 and name cb  )  (resid  44 and name sg  ) 2.99 0.50 0.50 
assign (resid  23 and name sg  )  (resid  44 and name cb  ) 2.99 0.50 0.50

assign (resid  27 and name sg  )  (resid  46 and name sg  ) 2.02 0.02 0.02 
assign (resid  27 and name cb  )  (resid  46 and name sg  ) 2.99 0.50 0.50 
assign (resid  27 and name sg  )  (resid  46 and name cb  ) 2.99 0.50 0.50

set message=on echo=on end


restraints
  dihedral

  reset

assign (resid   1 and name c   )  (resid   2 and name n   )
       (resid   2 and name ca  )  (resid   2 and name c   ) 1 -120.0 40.0 2
assign (resid   2 and name c   )  (resid   3 and name n   )
       (resid   3 and name ca  )  (resid   3 and name c   ) 1 -120.0 40.0 2
assign (resid   4 and name c   )  (resid   5 and name n   )
       (resid   5 and name ca  )  (resid   5 and name c   ) 1 -120.0 40.0 2
assign (resid   6 and name c   )  (resid   7 and name n   )
       (resid   7 and name ca  )  (resid   7 and name c   ) 1 -120.0 40.0 2
assign (resid  15 and name c   )  (resid  16 and name n   )
       (resid  16 and name ca  )  (resid  16 and name c   ) 1 -120.0 40.0 2
assign (resid  17 and name c   )  (resid  18 and name n   )
       (resid  18 and name ca  )  (resid  18 and name c   ) 1 -120.0 40.0 2
assign (resid  29 and name c   )  (resid  30 and name n   )
       (resid  30 and name ca  )  (resid  30 and name c   ) 1 -120.0 40.0 2
assign (resid  30 and name c   )  (resid  31 and name n   )
       (resid  31and name  ca  )  (resid  31 and name c   ) 1 -120.0 40.0 2
assign (resid  35 and name c   )  (resid  36 and name n   )
       (resid  36 and name ca  )  (resid  36 and name c   ) 1 -120.0 40.0 2
assign (resid  36 and name c   )  (resid  37 and name n   )
       (resid  37 and name ca  )  (resid  37 and name c   ) 1 -120.0 40.0 2
assign (resid  37 and name c   )  (resid  38 and name n   )
       (resid  38 and name ca  )  (resid  38 and name c   ) 1 -120.0 40.0 2
assign (resid  39 and name c   )  (resid  40 and name n   )
       (resid  40 and name ca  )  (resid  40 and name c   ) 1 -120.0 40.0 2
assign (resid  44 and name c   )  (resid  45 and name n   )
       (resid  45 and name ca  )  (resid  45 and name c   ) 1 -120.0 40.0 2
assign (resid  45 and name c   )  (resid  46 and name n   )
       (resid  46 and name ca  )  (resid  46 and name c   ) 1 -120.0 40.0 2
assign (resid  46 and name c   )  (resid  47 and name n   )
       (resid  47 and name ca  )  (resid  47 and name c   ) 1 -120.0 40.0 2
assign (resid  51 and name c   )  (resid  52 and name n   )
       (resid  52 and name ca  )  (resid  52 and name c   ) 1 -120.0 40.0 2
assign (resid  54 and name c   )  (resid  55 and name n   )
       (resid  55 and name ca  )  (resid  55 and name c   ) 1 -120.0 40.0 2
assign (resid  56 and name c   )  (resid  57 and name n   )
       (resid  57 and name ca  )  (resid  57 and name c   ) 1 -120.0 40.0 2
assign (resid  61 and name c   )  (resid  62 and name n   )
       (resid  62 and name ca  )  (resid  62 and name c   ) 1 -120.0 40.0 2
       
assign (resid  19 and name c   )  (resid  20 and name n   )
       (resid  20 and name ca  )  (resid  20 and name c   ) 1  -65.0 25.0 2
assign (resid  21 and name c   )  (resid  22 and name n   )
       (resid  22 and name ca  )  (resid  22 and name c   ) 1  -65.0 25.0 2
assign (resid  23 and name c   )  (resid  24 and name n   )
       (resid  24 and name ca  )  (resid  24 and name c   ) 1  -65.0 25.0 2
assign (resid  24 and name c   )  (resid  25 and name n   )
       (resid  25 and name ca  )  (resid  25 and name c   ) 1  -65.0 25.0 2
assign (resid  25 and name c   )  (resid  26 and name n   )
       (resid  26 and name ca  )  (resid  26 and name c   ) 1  -65.0 25.0 2
assign (resid  26 and name c   )  (resid  27 and name n   )
       (resid  27 and name ca  )  (resid  27 and name c   ) 1  -65.0 25.0 2
assign (resid  27 and name c   )  (resid  28 and name n   )
       (resid  28 and name ca  )  (resid  28 and name c   ) 1  -65.0 25.0 2
assign (resid  32 and name c   )  (resid  33 and name n   )
       (resid  33 and name ca  )  (resid  33 and name c   ) 1  -65.0 25.0 2
assign (resid  43 and name c   )  (resid  44 and name n   )
       (resid  44 and name ca  )  (resid  44 and name c   ) 1  -65.0 25.0 2
assign (resid  52 and name c   )  (resid  53 and name n   )
       (resid  53 and name ca  )  (resid  53 and name c   ) 1  -65.0 25.0 2
assign (resid  50 and name c   )  (resid  51 and name n   )
       (resid  51 and name ca  )  (resid  51 and name c   ) 1  -65.0 25.0 2

assign (resid  11 and name n   )  (resid  11 and name ca  )
       (resid  11 and name cb  )  (resid  11 and name sg  ) 1  180.0 30.0 2
assign (resid  16 and name n   )  (resid  16 and name ca  )
       (resid  16 and name cb  )  (resid  16 and name sg  ) 1  180.0 30.0 2
assign (resid  40 and name n   )  (resid  40 and name ca  )
       (resid  40 and name cb  )  (resid  40 and name sg  ) 1  180.0 30.0 2
assign (resid  44 and name n   )  (resid  44 and name ca  )
       (resid  44 and name cb  )  (resid  44 and name sg  ) 1  180.0 30.0 2
assign (resid  51 and name n   )  (resid  51 and name ca  )
       (resid  51 and name cb  )  (resid  51 and name sg  ) 1  180.0 30.0 2
assign (resid  52 and name n   )  (resid  52 and name ca  )
       (resid  52 and name cb  )  (resid  52 and name sg  ) 1  180.0 30.0 2

assign (resid  27 and name n   )  (resid  27 and name ca  )
       (resid  27 and name cb  )  (resid  27 and name cg  ) 1  -60.0 30.0 2
assign (resid  46 and name n   )  (resid  46 and name ca  )
       (resid  46 and name cb  )  (resid  46 and name cg  ) 1  -60.0 30.0 2
end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    LYS   1          1HT       LYS   1  -2.240  14.345  -2.792
    2   2H    LYS   1          2HT       LYS   1  -3.704  14.797  -2.057
    3   3H    LYS   1          3HT       LYS   1  -3.243  15.493  -3.537
    4    HA   LYS   1           HA       LYS   1  -4.408  12.860  -3.003
    5   1HB   LYS   1          2HB       LYS   1  -4.496  14.855  -5.290
    6   2HB   LYS   1          1HB       LYS   1  -5.609  13.511  -5.034
    7   1HG   LYS   1          2HG       LYS   1  -6.412  14.507  -2.961
    8   2HG   LYS   1          1HG       LYS   1  -5.223  15.804  -3.089
    9   1HD   LYS   1          2HD       LYS   1  -6.495  16.967  -4.553
   10   2HD   LYS   1          1HD       LYS   1  -6.849  15.525  -5.507
   11   1HE   LYS   1          2HE       LYS   1  -8.633  14.878  -3.998
   12   2HE   LYS   1          1HE       LYS   1  -8.200  16.173  -2.863
   13   1HZ   LYS   1          1HZ       LYS   1 -10.006  16.869  -4.327
   14   2HZ   LYS   1          2HZ       LYS   1  -9.041  16.558  -5.690
   15   3HZ   LYS   1          3HZ       LYS   1  -8.613  17.795  -4.607
   16    H    ILE   2           H        ILE   2  -2.587  11.432  -3.172
   17    HA   ILE   2           HA       ILE   2  -1.261  11.383  -5.865
   18    HB   ILE   2           HB       ILE   2   0.108  11.966  -3.799
   19   1HG1  ILE   2          2HG1      ILE   2   0.823   9.415  -5.282
   20   2HG1  ILE   2          1HG1      ILE   2   1.147  11.055  -5.845
   21   1HG2  ILE   2          1HG2      ILE   2  -1.192  10.251  -2.388
   22   2HG2  ILE   2          2HG2      ILE   2   0.557  10.294  -2.167
   23   3HG2  ILE   2          3HG2      ILE   2  -0.177   9.027  -3.150
   24   1HD1  ILE   2          1HD1      ILE   2   2.758  11.446  -4.183
   25   2HD1  ILE   2          2HD1      ILE   2   3.048   9.758  -4.609
   26   3HD1  ILE   2          3HD1      ILE   2   2.141  10.156  -3.150
   27    H    ASP   3           H        ASP   3  -0.623   9.127  -6.537
   28    HA   ASP   3           HA       ASP   3  -2.280   6.970  -5.309
   29   1HB   ASP   3          2HB       ASP   3  -3.216   6.427  -7.496
   30   2HB   ASP   3          1HB       ASP   3  -3.525   8.131  -7.157
   31    H    GLY   4           H        GLY   4  -1.320   4.919  -5.525
   32   1HA   GLY   4          2HA       GLY   4   0.589   4.118  -7.436
   33   2HA   GLY   4          1HA       GLY   4   1.497   4.812  -6.091
   34    H    TYR   5           H        TYR   5   2.386   2.745  -5.534
   35    HA   TYR   5           HA       TYR   5   0.418   0.738  -4.497
   36   1HB   TYR   5          2HB       TYR   5   3.351   0.465  -5.228
   37   2HB   TYR   5          1HB       TYR   5   2.244  -0.854  -4.849
   38    HD1  TYR   5           1HD      TYR   5   0.982  -1.869  -6.556
   39    HD2  TYR   5           2HD      TYR   5   2.713   2.009  -7.217
   40    HE1  TYR   5           1HE      TYR   5   0.282  -1.961  -8.932
   41    HE2  TYR   5           2HE      TYR   5   2.011   1.915  -9.594
   42    HH   TYR   5           HH       TYR   5   0.289  -0.929 -10.891
   43    HA   PRO   6           HA       PRO   6   2.207   2.409  -0.665
   44   1HB   PRO   6          2HB       PRO   6   0.029   1.832   0.883
   45   2HB   PRO   6          1HB       PRO   6   0.141   3.293  -0.118
   46   1HG   PRO   6          2HG       PRO   6  -1.340   0.770  -0.614
   47   2HG   PRO   6          1HG       PRO   6  -1.773   2.436  -1.027
   48   1HD   PRO   6          2HD       PRO   6  -0.759   0.595  -2.808
   49   2HD   PRO   6          1HD       PRO   6  -0.669   2.356  -3.014
   50    H    VAL   7           H        VAL   7   3.216   1.230   1.002
   51    HA   VAL   7           HA       VAL   7   2.820  -1.740   0.932
   52    HB   VAL   7           HB       VAL   7   5.133  -1.842   1.652
   53   1HG1  VAL   7          1HG1      VAL   7   4.291  -0.351  -0.689
   54   2HG1  VAL   7          2HG1      VAL   7   5.620  -1.497  -0.522
   55   3HG1  VAL   7          3HG1      VAL   7   5.871   0.206  -0.135
   56   1HG2  VAL   7          1HG2      VAL   7   6.362   0.373   2.009
   57   2HG2  VAL   7          2HG2      VAL   7   5.224  -0.083   3.277
   58   3HG2  VAL   7          3HG2      VAL   7   4.772   1.135   2.085
   59    H    ASP   8           H        ASP   8   3.821  -2.522   3.309
   60    HA   ASP   8           HA       ASP   8   1.838  -1.492   5.246
   61   1HB   ASP   8          2HB       ASP   8   3.617  -3.864   4.887
   62   2HB   ASP   8          1HB       ASP   8   3.136  -3.460   6.536
   63    H    TYR   9           H        TYR   9   5.012  -2.652   6.208
   64    HA   TYR   9           HA       TYR   9   5.788   0.090   7.104
   65   1HB   TYR   9          2HB       TYR   9   4.672  -1.970   8.703
   66   2HB   TYR   9          1HB       TYR   9   6.385  -1.889   9.119
   67    HD1  TYR   9           1HD      TYR   9   3.359  -0.722  10.167
   68    HD2  TYR   9           2HD      TYR   9   7.192   0.807   8.978
   69    HE1  TYR   9           1HE      TYR   9   2.942   1.341  11.479
   70    HE2  TYR   9           2HE      TYR   9   6.776   2.871  10.291
   71    HH   TYR   9           HH       TYR   9   4.456   3.131  12.616
   72    H    TRP  10           H        TRP  10   6.754  -3.337   6.806
   73    HA   TRP  10           HA       TRP  10   9.575  -2.413   6.365
   74   1HB   TRP  10          2HB       TRP  10   8.593  -5.137   7.263
   75   2HB   TRP  10          1HB       TRP  10  10.238  -4.510   7.353
   76    HD1  TRP  10           HD       TRP  10  10.716  -2.560   9.155
   77    HE1  TRP  10           1HE      TRP  10   9.527  -1.988  11.370
   78    HE3  TRP  10           3HE      TRP  10   6.350  -5.121   8.499
   79    HZ2  TRP  10           2HZ      TRP  10   7.050  -2.542  12.689
   80    HZ3  TRP  10           3HZ      TRP  10   4.592  -5.083  10.248
   81    HH2  TRP  10           HH       TRP  10   4.938  -3.798  12.340
   82    H    ASN  11           H        ASN  11   7.088  -3.008   4.511
   83    HA   ASN  11           HA       ASN  11   6.791  -3.897   2.341
   84   1HB   ASN  11          2HB       ASN  11   9.814  -3.861   2.623
   85   2HB   ASN  11          1HB       ASN  11   8.972  -4.132   1.097
   86   1HD2  ASN  11          1HD2      ASN  11  10.653  -1.873   1.353
   87   2HD2  ASN  11          2HD2      ASN  11   9.701  -0.469   1.388
   88    H    CYS  12           H        CYS  12   7.358  -5.700   4.860
   89    HA   CYS  12           HA       CYS  12   8.544  -8.138   3.853
   90   1HB   CYS  12          2HB       CYS  12   6.776  -7.369   6.183
   91   2HB   CYS  12          1HB       CYS  12   7.316  -9.031   5.943
   92    H    LYS  13           H        LYS  13   5.523  -6.657   3.277
   93    HA   LYS  13           HA       LYS  13   4.236  -9.270   2.589
   94   1HB   LYS  13          2HB       LYS  13   3.304  -6.513   3.348
   95   2HB   LYS  13          1HB       LYS  13   2.219  -7.579   2.453
   96   1HG   LYS  13          2HG       LYS  13   1.698  -8.116   4.667
   97   2HG   LYS  13          1HG       LYS  13   2.895  -9.349   4.266
   98   1HD   LYS  13          2HD       LYS  13   4.667  -7.852   5.232
   99   2HD   LYS  13          1HD       LYS  13   3.386  -6.764   5.768
  100   1HE   LYS  13          2HE       LYS  13   2.379  -8.943   6.864
  101   2HE   LYS  13          1HE       LYS  13   4.053  -9.523   6.756
  102   1HZ   LYS  13          1HZ       LYS  13   3.661  -8.293   8.821
  103   2HZ   LYS  13          2HZ       LYS  13   3.211  -6.922   7.924
  104   3HZ   LYS  13          3HZ       LYS  13   4.801  -7.511   7.840
  105    H    ARG  14           H        ARG  14   6.267  -8.164   0.846
  106    HA   ARG  14           HA       ARG  14   6.583  -7.488  -1.407
  107   1HB   ARG  14          2HB       ARG  14   5.316  -9.706  -1.395
  108   2HB   ARG  14          1HB       ARG  14   3.850  -8.767  -1.675
  109   1HG   ARG  14          2HG       ARG  14   4.331  -8.871  -3.877
  110   2HG   ARG  14          1HG       ARG  14   5.675  -7.775  -3.547
  111   1HD   ARG  14          2HD       ARG  14   6.927  -9.996  -2.841
  112   2HD   ARG  14          1HD       ARG  14   5.713 -10.759  -3.885
  113    HE   ARG  14           HE       ARG  14   7.321  -8.444  -4.884
  114   1HH1  ARG  14          1HH2      ARG  14   7.343 -11.794  -4.816
  115   2HH1  ARG  14          2HH2      ARG  14   7.401 -12.008  -6.534
  116   1HH2  ARG  14          1HH1      ARG  14   6.882  -8.651  -7.235
  117   2HH2  ARG  14          2HH1      ARG  14   7.141 -10.228  -7.903
  118    H    ILE  15           H        ILE  15   5.298  -5.500   0.323
  119    HA   ILE  15           HA       ILE  15   4.250  -3.403   0.083
  120    HB   ILE  15           HB       ILE  15   4.296  -4.155  -2.856
  121   1HG1  ILE  15          2HG1      ILE  15   6.448  -2.436  -2.068
  122   2HG1  ILE  15          1HG1      ILE  15   6.456  -3.849  -1.013
  123   1HG2  ILE  15          1HG2      ILE  15   3.400  -1.848  -1.423
  124   2HG2  ILE  15          2HG2      ILE  15   3.478  -2.084  -3.170
  125   3HG2  ILE  15          3HG2      ILE  15   4.862  -1.410  -2.308
  126   1HD1  ILE  15          1HD1      ILE  15   6.381  -5.326  -2.999
  127   2HD1  ILE  15          2HD1      ILE  15   7.800  -4.278  -3.031
  128   3HD1  ILE  15          3HD1      ILE  15   6.406  -3.906  -4.046
  129    H    CYS  16           H        CYS  16   2.749  -6.260  -0.320
  130    HA   CYS  16           HA       CYS  16   0.071  -4.987  -0.471
  131   1HB   CYS  16          2HB       CYS  16   0.600  -5.572  -2.768
  132   2HB   CYS  16          1HB       CYS  16   1.126  -7.182  -2.281
  133    H    TRP  17           H        TRP  17  -0.760  -5.707   1.471
  134    HA   TRP  17           HA       TRP  17   0.026  -7.811   3.075
  135   1HB   TRP  17          2HB       TRP  17  -1.710  -6.055   3.516
  136   2HB   TRP  17          1HB       TRP  17  -2.840  -6.967   2.521
  137    HD1  TRP  17           HD       TRP  17  -1.055  -9.633   3.954
  138    HE1  TRP  17           1HE      TRP  17  -2.087 -10.496   6.150
  139    HE3  TRP  17           3HE      TRP  17  -4.092  -5.691   5.116
  140    HZ2  TRP  17           2HZ      TRP  17  -3.949  -9.634   8.138
  141    HZ3  TRP  17           3HZ      TRP  17  -5.483  -5.741   7.168
  142    HH2  TRP  17           HH       TRP  17  -5.414  -7.705   8.678
  143    H    TYR  18           H        TYR  18  -3.133  -8.539   1.727
  144    HA   TYR  18           HA       TYR  18  -2.154 -10.746   0.058
  145   1HB   TYR  18          2HB       TYR  18  -2.135 -11.249   2.674
  146   2HB   TYR  18          1HB       TYR  18  -3.849 -11.548   2.387
  147    HD1  TYR  18           1HD      TYR  18  -4.596 -13.505   1.238
  148    HD2  TYR  18           2HD      TYR  18  -0.414 -12.527   1.350
  149    HE1  TYR  18           1HE      TYR  18  -4.050 -15.734   0.298
  150    HE2  TYR  18           2HE      TYR  18   0.132 -14.756   0.408
  151    HH   TYR  18           HH       TYR  18  -2.366 -16.918  -0.764
  152    H    ASN  19           H        ASN  19  -5.078 -10.065   1.987
  153    HA   ASN  19           HA       ASN  19  -6.891 -10.806  -0.137
  154   1HB   ASN  19          2HB       ASN  19  -6.924 -10.164   2.622
  155   2HB   ASN  19          1HB       ASN  19  -8.024  -9.029   1.840
  156   1HD2  ASN  19          1HD2      ASN  19 -10.074  -9.824   1.285
  157   2HD2  ASN  19          2HD2      ASN  19 -10.501 -11.468   1.291
  158    H    ASN  20           H        ASN  20  -8.586  -9.150  -0.925
  159    HA   ASN  20           HA       ASN  20  -7.219  -6.946  -2.250
  160   1HB   ASN  20          2HB       ASN  20  -9.585  -8.499  -2.490
  161   2HB   ASN  20          1HB       ASN  20 -10.099  -6.819  -2.344
  162   1HD2  ASN  20          1HD2      ASN  20  -9.219  -5.263  -3.956
  163   2HD2  ASN  20          2HD2      ASN  20  -8.652  -5.825  -5.454
  164    H    LYS  21           H        LYS  21  -9.946  -7.075   0.076
  165    HA   LYS  21           HA       LYS  21  -9.916  -4.223   0.580
  166   1HB   LYS  21          2HB       LYS  21 -11.303  -6.673   1.475
  167   2HB   LYS  21          1HB       LYS  21 -11.213  -5.402   2.696
  168   1HG   LYS  21          2HG       LYS  21 -12.151  -3.786   1.073
  169   2HG   LYS  21          1HG       LYS  21 -12.264  -5.070  -0.130
  170   1HD   LYS  21          2HD       LYS  21 -14.311  -5.536   0.689
  171   2HD   LYS  21          1HD       LYS  21 -13.513  -6.117   2.152
  172   1HE   LYS  21          2HE       LYS  21 -14.181  -4.303   3.353
  173   2HE   LYS  21          1HE       LYS  21 -13.748  -3.182   2.045
  174   1HZ   LYS  21          1HZ       LYS  21 -15.730  -3.666   0.895
  175   2HZ   LYS  21          2HZ       LYS  21 -16.204  -3.425   2.509
  176   3HZ   LYS  21          3HZ       LYS  21 -16.084  -4.999   1.881
  177    H    TYR  22           H        TYR  22  -8.039  -6.876   1.752
  178    HA   TYR  22           HA       TYR  22  -7.395  -6.061   4.391
  179   1HB   TYR  22          2HB       TYR  22  -6.273  -7.731   2.226
  180   2HB   TYR  22          1HB       TYR  22  -5.085  -7.165   3.399
  181    HD1  TYR  22           1HD      TYR  22  -4.682  -9.342   4.407
  182    HD2  TYR  22           2HD      TYR  22  -8.641  -7.685   4.239
  183    HE1  TYR  22           1HE      TYR  22  -5.466 -11.049   6.026
  184    HE2  TYR  22           2HE      TYR  22  -9.425  -9.392   5.858
  185    HH   TYR  22           HH       TYR  22  -7.424 -12.084   6.801
  186    H    CYS  23           H        CYS  23  -6.371  -4.783   1.287
  187    HA   CYS  23           HA       CYS  23  -4.277  -3.099   2.570
  188   1HB   CYS  23          2HB       CYS  23  -4.281  -4.509   0.289
  189   2HB   CYS  23          1HB       CYS  23  -4.952  -3.005  -0.341
  190    H    ASN  24           H        ASN  24  -7.544  -2.934   1.438
  191    HA   ASN  24           HA       ASN  24  -7.626  -0.105   0.797
  192   1HB   ASN  24          2HB       ASN  24  -9.214  -1.992   0.114
  193   2HB   ASN  24          1HB       ASN  24  -9.875  -1.901   1.747
  194   1HD2  ASN  24          1HD2      ASN  24 -11.949  -1.049   1.077
  195   2HD2  ASN  24          2HD2      ASN  24 -12.116   0.514   0.438
  196    H    ASP  25           H        ASP  25  -8.332  -2.011   3.742
  197    HA   ASP  25           HA       ASP  25  -9.333   0.158   5.327
  198   1HB   ASP  25          2HB       ASP  25  -9.023  -2.542   5.579
  199   2HB   ASP  25          1HB       ASP  25  -7.729  -1.969   6.632
  200    H    LEU  26           H        LEU  26  -6.046  -1.225   5.017
  201    HA   LEU  26           HA       LEU  26  -4.764   0.654   6.786
  202   1HB   LEU  26          2HB       LEU  26  -4.132  -1.570   5.061
  203   2HB   LEU  26          1HB       LEU  26  -2.977  -0.269   4.769
  204    HG   LEU  26           HG       LEU  26  -3.687  -1.086   7.580
  205   1HD1  LEU  26          1HD1      LEU  26  -1.634  -2.543   7.494
  206   2HD1  LEU  26          2HD1      LEU  26  -1.630  -2.342   5.741
  207   3HD1  LEU  26          3HD1      LEU  26  -2.983  -3.152   6.534
  208   1HD2  LEU  26          1HD2      LEU  26  -2.268   0.631   7.960
  209   2HD2  LEU  26          2HD2      LEU  26  -1.844   0.733   6.251
  210   3HD2  LEU  26          3HD2      LEU  26  -0.985  -0.387   7.309
  211    H    CYS  27           H        CYS  27  -5.203   0.549   3.244
  212    HA   CYS  27           HA       CYS  27  -3.741   2.909   2.604
  213   1HB   CYS  27          2HB       CYS  27  -5.922   1.244   1.414
  214   2HB   CYS  27          1HB       CYS  27  -5.618   2.822   0.690
  215    H    LYS  28           H        LYS  28  -7.134   2.423   3.574
  216    HA   LYS  28           HA       LYS  28  -8.055   5.093   3.200
  217   1HB   LYS  28          2HB       LYS  28  -8.865   2.612   4.461
  218   2HB   LYS  28          1HB       LYS  28  -9.308   3.985   5.477
  219   1HG   LYS  28          2HG       LYS  28 -10.881   4.709   4.014
  220   2HG   LYS  28          1HG       LYS  28  -9.843   4.413   2.619
  221   1HD   LYS  28          2HD       LYS  28 -11.276   2.703   2.187
  222   2HD   LYS  28          1HD       LYS  28 -10.374   1.857   3.446
  223   1HE   LYS  28          2HE       LYS  28 -12.128   1.938   4.899
  224   2HE   LYS  28          1HE       LYS  28 -12.483   3.632   4.498
  225   1HZ   LYS  28          1HZ       LYS  28 -13.394   2.874   2.370
  226   2HZ   LYS  28          2HZ       LYS  28 -14.246   2.212   3.683
  227   3HZ   LYS  28          3HZ       LYS  28 -13.129   1.262   2.823
  228    H    GLY  29           H        GLY  29  -6.166   3.591   5.768
  229   1HA   GLY  29          2HA       GLY  29  -6.446   5.655   7.734
  230   2HA   GLY  29          1HA       GLY  29  -5.073   4.545   7.622
  231    H    LEU  30           H        LEU  30  -4.485   5.284   4.860
  232    HA   LEU  30           HA       LEU  30  -2.958   7.769   5.402
  233   1HB   LEU  30          2HB       LEU  30  -2.984   5.898   3.008
  234   2HB   LEU  30          1HB       LEU  30  -1.734   7.077   3.408
  235    HG   LEU  30           HG       LEU  30  -2.343   5.170   5.574
  236   1HD1  LEU  30          1HD1      LEU  30  -0.582   3.944   3.570
  237   2HD1  LEU  30          2HD1      LEU  30  -2.260   4.070   3.038
  238   3HD1  LEU  30          3HD1      LEU  30  -1.868   3.214   4.530
  239   1HD2  LEU  30          1HD2      LEU  30   0.134   6.246   4.201
  240   2HD2  LEU  30          2HD2      LEU  30   0.202   5.071   5.516
  241   3HD2  LEU  30          3HD2      LEU  30  -0.482   6.672   5.798
  242    H    LYS  31           H        LYS  31  -5.982   7.462   4.753
  243    HA   LYS  31           HA       LYS  31  -7.550   8.899   3.728
  244   1HB   LYS  31          2HB       LYS  31  -5.586  10.521   4.113
  245   2HB   LYS  31          1HB       LYS  31  -5.187  10.250   2.416
  246   1HG   LYS  31          2HG       LYS  31  -6.719  11.796   1.860
  247   2HG   LYS  31          1HG       LYS  31  -7.966  10.716   2.481
  248   1HD   LYS  31          2HD       LYS  31  -8.081  11.799   4.531
  249   2HD   LYS  31          1HD       LYS  31  -6.421  12.388   4.428
  250   1HE   LYS  31          2HE       LYS  31  -7.001  14.208   3.107
  251   2HE   LYS  31          1HE       LYS  31  -8.403  13.379   2.404
  252   1HZ   LYS  31          1HZ       LYS  31  -8.609  13.578   5.243
  253   2HZ   LYS  31          2HZ       LYS  31  -9.706  14.082   4.047
  254   3HZ   LYS  31          3HZ       LYS  31  -8.447  15.111   4.536
  255    H    ALA  32           H        ALA  32  -5.906   6.539   2.311
  256    HA   ALA  32           HA       ALA  32  -6.491   7.226  -0.513
  257   1HB   ALA  32          1HB       ALA  32  -4.394   6.061   0.353
  258   2HB   ALA  32          2HB       ALA  32  -5.216   5.239  -0.972
  259   3HB   ALA  32          3HB       ALA  32  -5.411   4.660   0.682
  260    H    ASP  33           H        ASP  33  -8.900   7.311   0.149
  261    HA   ASP  33           HA       ASP  33 -10.501   5.252   1.055
  262   1HB   ASP  33          2HB       ASP  33 -10.801   7.266  -1.169
  263   2HB   ASP  33          1HB       ASP  33 -12.128   6.183  -0.746
  264    H    SER  34           H        SER  34  -9.809   5.696  -2.424
  265    HA   SER  34           HA       SER  34 -10.699   3.012  -3.097
  266   1HB   SER  34          2HB       SER  34  -9.927   5.469  -4.373
  267   2HB   SER  34          1HB       SER  34  -9.038   4.143  -5.117
  268    HG   SER  34           HG       SER  34 -11.744   4.715  -5.112
  269    H    GLY  35           H        GLY  35  -9.290   1.738  -1.630
  270   1HA   GLY  35          2HA       GLY  35  -6.509   1.497  -2.705
  271   2HA   GLY  35          1HA       GLY  35  -6.862   1.336  -0.985
  272    H    TYR  36           H        TYR  36  -6.332  -0.410  -3.762
  273    HA   TYR  36           HA       TYR  36  -7.560  -2.840  -2.532
  274   1HB   TYR  36          2HB       TYR  36  -8.502  -3.458  -4.671
  275   2HB   TYR  36          1HB       TYR  36  -8.983  -1.792  -4.353
  276    HD1  TYR  36           1HD      TYR  36  -6.392  -3.844  -6.096
  277    HD2  TYR  36           2HD      TYR  36  -8.434  -0.072  -5.867
  278    HE1  TYR  36           1HE      TYR  36  -5.302  -3.125  -8.205
  279    HE2  TYR  36           2HE      TYR  36  -7.342   0.647  -7.974
  280    HH   TYR  36           HH       TYR  36  -5.846   0.136  -9.535
  281    H    CYS  37           H        CYS  37  -6.338  -4.748  -2.920
  282    HA   CYS  37           HA       CYS  37  -3.584  -4.272  -3.953
  283   1HB   CYS  37          2HB       CYS  37  -4.780  -5.633  -1.762
  284   2HB   CYS  37          1HB       CYS  37  -4.040  -6.865  -2.785
  285    H    TRP  38           H        TRP  38  -2.802  -5.396  -5.740
  286    HA   TRP  38           HA       TRP  38  -4.737  -6.741  -7.479
  287   1HB   TRP  38          2HB       TRP  38  -2.697  -5.187  -8.008
  288   2HB   TRP  38          1HB       TRP  38  -1.744  -6.661  -7.835
  289    HD1  TRP  38           HD       TRP  38  -1.469  -8.000  -9.972
  290    HE1  TRP  38           1HE      TRP  38  -2.757  -8.223 -12.195
  291    HE3  TRP  38           3HE      TRP  38  -5.439  -4.937  -9.005
  292    HZ2  TRP  38           2HZ      TRP  38  -5.153  -7.235 -13.402
  293    HZ3  TRP  38           3HZ      TRP  38  -7.208  -4.596 -10.708
  294    HH2  TRP  38           HH       TRP  38  -7.070  -5.741 -12.903
  295    H    GLY  39           H        GLY  39  -5.328  -8.767  -6.686
  296   1HA   GLY  39          2HA       GLY  39  -3.549 -10.523  -5.277
  297   2HA   GLY  39          1HA       GLY  39  -5.095 -10.992  -5.979
  298    H    TRP  40           H        TRP  40  -1.806 -10.101  -7.083
  299    HA   TRP  40           HA       TRP  40  -1.641 -12.573  -8.652
  300   1HB   TRP  40          2HB       TRP  40  -2.987 -11.207 -10.132
  301   2HB   TRP  40          1HB       TRP  40  -1.907  -9.830  -9.912
  302    HD1  TRP  40           HD       TRP  40  -0.925  -9.566 -12.270
  303    HE1  TRP  40           1HE      TRP  40   0.461 -11.074 -13.827
  304    HE3  TRP  40           3HE      TRP  40  -1.239 -13.996  -9.739
  305    HZ2  TRP  40           2HZ      TRP  40   1.331 -13.793 -13.986
  306    HZ3  TRP  40           3HZ      TRP  40  -0.123 -16.023 -10.616
  307    HH2  TRP  40           HH       TRP  40   1.160 -15.930 -12.735
  308    H    THR  41           H        THR  41  -0.207  -9.318  -8.864
  309    HA   THR  41           HA       THR  41   2.230  -9.917  -7.504
  310    HB   THR  41           HB       THR  41   2.528 -11.566  -9.274
  311    HG1  THR  41           1HG      THR  41   4.106  -9.508 -10.262
  312   1HG2  THR  41          1HG2      THR  41   2.656  -9.685 -11.511
  313   2HG2  THR  41          2HG2      THR  41   1.045  -9.792 -10.801
  314   3HG2  THR  41          3HG2      THR  41   1.841 -11.246 -11.403
  315    H    LEU  42           H        LEU  42   0.353  -7.693  -7.960
  316    HA   LEU  42           HA       LEU  42   2.223  -5.703  -9.220
  317   1HB   LEU  42          2HB       LEU  42  -0.707  -6.199  -9.318
  318   2HB   LEU  42          1HB       LEU  42  -0.210  -4.507  -9.269
  319    HG   LEU  42           HG       LEU  42   0.764  -6.584 -11.254
  320   1HD1  LEU  42          1HD1      LEU  42  -0.389  -4.667 -12.742
  321   2HD1  LEU  42          2HD1      LEU  42  -1.356  -4.488 -11.278
  322   3HD1  LEU  42          3HD1      LEU  42  -1.300  -6.040 -12.114
  323   1HD2  LEU  42          1HD2      LEU  42   2.439  -5.161 -11.758
  324   2HD2  LEU  42          2HD2      LEU  42   1.994  -4.207 -10.343
  325   3HD2  LEU  42          3HD2      LEU  42   1.303  -3.822 -11.919
  326    H    SER  43           H        SER  43   1.800  -6.721  -6.292
  327    HA   SER  43           HA       SER  43   1.830  -5.730  -4.150
  328   1HB   SER  43          2HB       SER  43   2.403  -3.189  -5.680
  329   2HB   SER  43          1HB       SER  43   3.014  -3.666  -4.100
  330    HG   SER  43           HG       SER  43   4.616  -4.053  -5.593
  331    H    CYS  44           H        CYS  44   0.979  -3.369  -3.144
  332    HA   CYS  44           HA       CYS  44  -1.916  -3.482  -3.518
  333   1HB   CYS  44          2HB       CYS  44  -0.558  -3.120  -1.374
  334   2HB   CYS  44          1HB       CYS  44  -0.270  -1.480  -1.953
  335    H    TYR  45           H        TYR  45  -3.186  -1.482  -3.984
  336    HA   TYR  45           HA       TYR  45  -1.759   0.620  -5.530
  337   1HB   TYR  45          2HB       TYR  45  -2.376  -1.303  -7.038
  338   2HB   TYR  45          1HB       TYR  45  -4.068  -1.017  -6.626
  339    HD1  TYR  45           1HD      TYR  45  -5.203   1.066  -7.314
  340    HD2  TYR  45           2HD      TYR  45  -1.156   0.216  -8.475
  341    HE1  TYR  45           1HE      TYR  45  -5.322   2.847  -9.037
  342    HE2  TYR  45           2HE      TYR  45  -1.274   1.995 -10.197
  343    HH   TYR  45           HH       TYR  45  -2.531   3.990 -10.690
  344    H    CYS  46           H        CYS  46  -2.471   2.242  -4.092
  345    HA   CYS  46           HA       CYS  46  -5.447   2.557  -3.844
  346   1HB   CYS  46          2HB       CYS  46  -3.239   3.323  -1.906
  347   2HB   CYS  46          1HB       CYS  46  -4.968   3.516  -1.627
  348    H    GLN  47           H        GLN  47  -6.243   4.705  -4.059
  349    HA   GLN  47           HA       GLN  47  -4.246   6.778  -4.904
  350   1HB   GLN  47          2HB       GLN  47  -6.978   6.358  -6.142
  351   2HB   GLN  47          1HB       GLN  47  -5.632   7.303  -6.781
  352   1HG   GLN  47          2HG       GLN  47  -5.431   5.362  -8.041
  353   2HG   GLN  47          1HG       GLN  47  -4.369   4.983  -6.685
  354   1HE2  GLN  47          1HE2      GLN  47  -7.935   4.821  -7.273
  355   2HE2  GLN  47          2HE2      GLN  47  -8.108   3.251  -6.652
  356    H    GLY  48           H        GLY  48  -4.684   8.836  -4.076
  357   1HA   GLY  48          2HA       GLY  48  -6.353  10.508  -3.315
  358   2HA   GLY  48          1HA       GLY  48  -7.262   9.177  -2.601
  359    H    LEU  49           H        LEU  49  -3.828   9.066  -2.314
  360    HA   LEU  49           HA       LEU  49  -4.109   9.588   0.611
  361   1HB   LEU  49          2HB       LEU  49  -1.603   8.620   0.364
  362   2HB   LEU  49          1HB       LEU  49  -3.011   7.568   0.454
  363    HG   LEU  49           HG       LEU  49  -2.052   8.561  -2.223
  364   1HD1  LEU  49          1HD1      LEU  49  -0.787   6.519  -0.440
  365   2HD1  LEU  49          2HD1      LEU  49  -0.036   7.599  -1.616
  366   3HD1  LEU  49          3HD1      LEU  49  -0.895   6.159  -2.163
  367   1HD2  LEU  49          1HD2      LEU  49  -4.249   7.198  -1.593
  368   2HD2  LEU  49          2HD2      LEU  49  -3.132   5.833  -1.604
  369   3HD2  LEU  49          3HD2      LEU  49  -3.341   6.813  -3.054
  370    HA   PRO  50           HA       PRO  50  -1.832  13.323   0.473
  371   1HB   PRO  50          2HB       PRO  50  -0.031  13.083   2.523
  372   2HB   PRO  50          1HB       PRO  50  -1.770  13.332   2.784
  373   1HG   PRO  50          2HG       PRO  50  -0.179  10.816   2.916
  374   2HG   PRO  50          1HG       PRO  50  -1.496  11.375   3.962
  375   1HD   PRO  50          2HD       PRO  50  -1.848   9.525   2.009
  376   2HD   PRO  50          1HD       PRO  50  -3.128  10.649   2.521
  377    H    ASP  51           H        ASP  51   0.306  14.283  -0.037
  378    HA   ASP  51           HA       ASP  51   1.835  12.772  -1.921
  379   1HB   ASP  51          2HB       ASP  51   1.800  15.147  -2.073
  380   2HB   ASP  51          1HB       ASP  51   2.229  15.339  -0.373
  381    H    ASN  52           H        ASN  52   1.926  12.887   1.517
  382    HA   ASN  52           HA       ASN  52   4.717  11.884   1.672
  383   1HB   ASN  52          2HB       ASN  52   3.544  13.648   3.180
  384   2HB   ASN  52          1HB       ASN  52   2.746  12.264   3.928
  385   1HD2  ASN  52          1HD2      ASN  52   5.717  14.060   3.777
  386   2HD2  ASN  52          2HD2      ASN  52   6.618  13.058   4.809
  387    H    ALA  53           H        ALA  53   2.064  10.431   0.705
  388    HA   ALA  53           HA       ALA  53   1.422   8.320   2.470
  389   1HB   ALA  53          1HB       ALA  53   1.601   7.606  -0.376
  390   2HB   ALA  53          2HB       ALA  53   0.794   9.147  -0.089
  391   3HB   ALA  53          3HB       ALA  53   0.187   7.677   0.674
  392    H    ARG  54           H        ARG  54   2.291   6.195   2.712
  393    HA   ARG  54           HA       ARG  54   5.180   5.969   2.094
  394   1HB   ARG  54          2HB       ARG  54   3.259   5.005   4.064
  395   2HB   ARG  54          1HB       ARG  54   4.276   3.697   3.460
  396   1HG   ARG  54          2HG       ARG  54   6.288   5.076   3.930
  397   2HG   ARG  54          1HG       ARG  54   5.249   6.332   4.601
  398   1HD   ARG  54          2HD       ARG  54   5.593   3.504   5.654
  399   2HD   ARG  54          1HD       ARG  54   6.049   5.015   6.466
  400    HE   ARG  54           HE       ARG  54   3.604   5.597   6.482
  401   1HH1  ARG  54          1HH2      ARG  54   4.030   2.616   4.985
  402   2HH1  ARG  54          2HH2      ARG  54   2.798   1.794   5.883
  403   1HH2  ARG  54          1HH1      ARG  54   2.258   4.440   8.062
  404   2HH2  ARG  54          2HH1      ARG  54   1.793   2.829   7.629
  405    H    ILE  55           H        ILE  55   5.024   5.552  -0.221
  406    HA   ILE  55           HA       ILE  55   4.079   2.778  -0.847
  407    HB   ILE  55           HB       ILE  55   3.146   3.587  -2.920
  408   1HG1  ILE  55          2HG1      ILE  55   5.011   5.299  -3.251
  409   2HG1  ILE  55          1HG1      ILE  55   3.401   5.808  -3.749
  410   1HG2  ILE  55          1HG2      ILE  55   2.327   4.716  -0.369
  411   2HG2  ILE  55          2HG2      ILE  55   1.339   4.082  -1.682
  412   3HG2  ILE  55          3HG2      ILE  55   1.878   5.761  -1.714
  413   1HD1  ILE  55          1HD1      ILE  55   3.748   7.634  -2.461
  414   2HD1  ILE  55          2HD1      ILE  55   5.133   6.899  -1.655
  415   3HD1  ILE  55          3HD1      ILE  55   3.501   6.570  -1.079
  416    H    LYS  56           H        LYS  56   5.289   1.759  -2.599
  417    HA   LYS  56           HA       LYS  56   7.397   1.172  -3.526
  418   1HB   LYS  56          2HB       LYS  56   6.866   4.056  -4.278
  419   2HB   LYS  56          1HB       LYS  56   8.184   3.124  -4.989
  420   1HG   LYS  56          2HG       LYS  56   6.435   1.362  -5.587
  421   2HG   LYS  56          1HG       LYS  56   5.217   2.565  -5.161
  422   1HD   LYS  56          2HD       LYS  56   6.999   3.948  -6.809
  423   2HD   LYS  56          1HD       LYS  56   6.843   2.364  -7.570
  424   1HE   LYS  56          2HE       LYS  56   4.759   2.866  -8.301
  425   2HE   LYS  56          1HE       LYS  56   4.250   3.325  -6.665
  426   1HZ   LYS  56          1HZ       LYS  56   4.445   5.121  -8.546
  427   2HZ   LYS  56          2HZ       LYS  56   6.087   5.093  -8.112
  428   3HZ   LYS  56          3HZ       LYS  56   4.906   5.480  -6.954
  429    H    ARG  57           H        ARG  57   7.883   1.491  -0.889
  430    HA   ARG  57           HA       ARG  57   9.910   3.589  -0.432
  431   1HB   ARG  57          2HB       ARG  57   8.143   2.792   1.212
  432   2HB   ARG  57          1HB       ARG  57   9.047   1.281   1.331
  433   1HG   ARG  57          2HG       ARG  57  10.819   3.557   1.602
  434   2HG   ARG  57          1HG       ARG  57   9.517   3.633   2.789
  435   1HD   ARG  57          2HD       ARG  57  11.258   1.187   2.308
  436   2HD   ARG  57          1HD       ARG  57  11.466   2.332   3.649
  437    HE   ARG  57           HE       ARG  57   9.481   0.274   3.571
  438   1HH1  ARG  57          1HH1      ARG  57  10.439   2.244   5.821
  439   2HH1  ARG  57          2HH1      ARG  57   8.911   2.925   6.272
  440   1HH2  ARG  57          1HH2      ARG  57   7.256   1.741   3.464
  441   2HH2  ARG  57          2HH2      ARG  57   7.109   2.640   4.937
  442    H    SER  58           H        SER  58   9.891   0.502  -1.777
  443    HA   SER  58           HA       SER  58  11.623  -1.015  -2.304
  444   1HB   SER  58          2HB       SER  58  12.515   1.600  -2.533
  445   2HB   SER  58          1HB       SER  58  13.751   0.851  -1.527
  446    HG   SER  58           HG       SER  58  13.364  -0.919  -3.308
  447    H    GLY  59           H        GLY  59  13.684  -2.037  -1.263
  448   1HA   GLY  59          2HA       GLY  59  14.961  -2.489   0.764
  449   2HA   GLY  59          1HA       GLY  59  13.659  -1.757   1.702
  450    H    ARG  60           H        ARG  60  15.010  -4.602   1.421
  451    HA   ARG  60           HA       ARG  60  12.841  -6.391   0.725
  452   1HB   ARG  60          2HB       ARG  60  15.557  -6.498   1.954
  453   2HB   ARG  60          1HB       ARG  60  14.496  -7.877   2.247
  454   1HG   ARG  60          2HG       ARG  60  15.278  -8.610   0.239
  455   2HG   ARG  60          1HG       ARG  60  14.105  -7.475  -0.427
  456   1HD   ARG  60          2HD       ARG  60  16.456  -5.990   0.244
  457   2HD   ARG  60          1HD       ARG  60  16.947  -7.404  -0.709
  458    HE   ARG  60           HE       ARG  60  14.711  -5.622  -1.601
  459   1HH1  ARG  60          1HH2      ARG  60  17.934  -5.818  -2.153
  460   2HH1  ARG  60          2HH2      ARG  60  17.840  -6.235  -3.831
  461   1HH2  ARG  60          1HH1      ARG  60  14.431  -6.862  -3.759
  462   2HH2  ARG  60          2HH1      ARG  60  15.858  -6.827  -4.740
  463    H    CYS  61           H        CYS  61  12.064  -8.016   2.487
  464    HA   CYS  61           HA       CYS  61  10.350  -6.879   4.331
  465   1HB   CYS  61          2HB       CYS  61  10.387  -9.245   3.778
  466   2HB   CYS  61          1HB       CYS  61  11.985  -9.430   4.502
  467    H    ARG  62           H        ARG  62  11.030  -5.205   5.675
  468    HA   ARG  62           HA       ARG  62  13.598  -5.370   7.117
  469   1HB   ARG  62          2HB       ARG  62  11.636  -3.396   6.299
  470   2HB   ARG  62          1HB       ARG  62  12.034  -3.197   8.005
  471   1HG   ARG  62          2HG       ARG  62  13.856  -2.068   7.274
  472   2HG   ARG  62          1HG       ARG  62  14.507  -3.654   6.861
  473   1HD   ARG  62          2HD       ARG  62  14.519  -3.038   4.683
  474   2HD   ARG  62          1HD       ARG  62  12.751  -2.887   4.744
  475    HE   ARG  62           HE       ARG  62  14.551  -0.674   4.708
  476   1HH1  ARG  62          1HH2      ARG  62  11.364  -1.147   4.763
  477   2HH1  ARG  62          2HH2      ARG  62  10.958   0.075   5.922
  478   1HH2  ARG  62          1HH1      ARG  62  14.237   0.594   6.922
  479   2HH2  ARG  62          2HH1      ARG  62  12.583   1.061   7.144
  480    H    ALA  63           H        ALA  63  12.013  -7.505   7.926
  481    HA   ALA  63           HA       ALA  63  11.836  -7.119  10.775
  482   1HB   ALA  63          1HB       ALA  63   9.741  -6.298  10.969
  483   2HB   ALA  63          2HB       ALA  63   9.103  -7.641  10.021
  484   3HB   ALA  63          3HB       ALA  63   9.661  -6.176   9.212
  Start of MODEL    2
    1   1H    LYS   1          1HT       LYS   1  -2.195  15.145  -3.375
    2   2H    LYS   1          2HT       LYS   1  -1.876  13.862  -2.307
    3   3H    LYS   1          3HT       LYS   1  -3.325  14.741  -2.176
    4    HA   LYS   1           HA       LYS   1  -3.970  12.775  -3.249
    5   1HB   LYS   1          2HB       LYS   1  -4.277  15.240  -4.300
    6   2HB   LYS   1          1HB       LYS   1  -3.424  14.473  -5.640
    7   1HG   LYS   1          2HG       LYS   1  -5.701  12.997  -4.373
    8   2HG   LYS   1          1HG       LYS   1  -6.070  14.333  -5.465
    9   1HD   LYS   1          2HD       LYS   1  -4.040  12.855  -6.743
   10   2HD   LYS   1          1HD       LYS   1  -5.170  11.658  -6.108
   11   1HE   LYS   1          2HE       LYS   1  -6.198  14.087  -7.578
   12   2HE   LYS   1          1HE       LYS   1  -5.668  12.643  -8.466
   13   1HZ   LYS   1          1HZ       LYS   1  -7.087  11.319  -6.947
   14   2HZ   LYS   1          2HZ       LYS   1  -7.972  12.378  -7.938
   15   3HZ   LYS   1          3HZ       LYS   1  -7.702  12.763  -6.304
   16    H    ILE   2           H        ILE   2  -2.119  11.269  -3.013
   17    HA   ILE   2           HA       ILE   2  -0.461  11.079  -5.508
   18    HB   ILE   2           HB       ILE   2   0.639  11.633  -3.267
   19   1HG1  ILE   2          2HG1      ILE   2   1.428   9.096  -4.731
   20   2HG1  ILE   2          1HG1      ILE   2   1.925  10.737  -5.144
   21   1HG2  ILE   2          1HG2      ILE   2  -0.778  10.104  -1.911
   22   2HG2  ILE   2          2HG2      ILE   2   0.940   9.766  -1.705
   23   3HG2  ILE   2          3HG2      ILE   2  -0.047   8.726  -2.732
   24   1HD1  ILE   2          1HD1      ILE   2   2.830  10.829  -2.703
   25   2HD1  ILE   2          2HD1      ILE   2   3.757   9.937  -3.909
   26   3HD1  ILE   2          3HD1      ILE   2   2.727   9.071  -2.769
   27    H    ASP   3           H        ASP   3   0.126   8.806  -6.078
   28    HA   ASP   3           HA       ASP   3  -1.797   6.754  -5.070
   29   1HB   ASP   3          2HB       ASP   3  -2.087   6.167  -7.563
   30   2HB   ASP   3          1HB       ASP   3  -2.871   7.646  -7.007
   31    H    GLY   4           H        GLY   4  -0.856   4.721  -4.933
   32   1HA   GLY   4          2HA       GLY   4   1.301   3.801  -6.576
   33   2HA   GLY   4          1HA       GLY   4   1.963   4.416  -5.062
   34    H    TYR   5           H        TYR   5   2.623   2.103  -4.770
   35    HA   TYR   5           HA       TYR   5   0.362   0.333  -3.938
   36   1HB   TYR   5          2HB       TYR   5   3.271  -0.416  -4.288
   37   2HB   TYR   5          1HB       TYR   5   1.859  -1.467  -4.382
   38    HD1  TYR   5           1HD      TYR   5   4.208  -0.791  -6.460
   39    HD2  TYR   5           2HD      TYR   5   0.091   0.362  -6.046
   40    HE1  TYR   5           1HE      TYR   5   4.074  -0.393  -8.904
   41    HE2  TYR   5           2HE      TYR   5  -0.044   0.759  -8.489
   42    HH   TYR   5           HH       TYR   5   2.565  -0.151 -10.645
   43    HA   PRO   6           HA       PRO   6   1.913   1.598   0.110
   44   1HB   PRO   6          2HB       PRO   6  -0.390   0.957   1.443
   45   2HB   PRO   6          1HB       PRO   6  -0.174   2.481   0.560
   46   1HG   PRO   6          2HG       PRO   6  -1.633   0.021  -0.243
   47   2HG   PRO   6          1HG       PRO   6  -2.031   1.718  -0.542
   48   1HD   PRO   6          2HD       PRO   6  -0.910   0.047  -2.406
   49   2HD   PRO   6          1HD       PRO   6  -0.749   1.817  -2.425
   50    H    VAL   7           H        VAL   7   3.362   0.033   0.793
   51    HA   VAL   7           HA       VAL   7   2.526  -2.803   1.079
   52    HB   VAL   7           HB       VAL   7   4.920  -3.150   1.436
   53   1HG1  VAL   7          1HG1      VAL   7   5.661  -2.530  -0.694
   54   2HG1  VAL   7          2HG1      VAL   7   4.818  -0.981  -0.647
   55   3HG1  VAL   7          3HG1      VAL   7   3.909  -2.473  -0.888
   56   1HG2  VAL   7          1HG2      VAL   7   5.047  -0.118   1.557
   57   2HG2  VAL   7          2HG2      VAL   7   6.444  -1.193   1.556
   58   3HG2  VAL   7          3HG2      VAL   7   5.311  -1.221   2.907
   59    H    ASP   8           H        ASP   8   4.112  -3.515   3.255
   60    HA   ASP   8           HA       ASP   8   2.440  -2.668   5.498
   61   1HB   ASP   8          2HB       ASP   8   3.229  -4.955   5.310
   62   2HB   ASP   8          1HB       ASP   8   4.904  -4.412   5.209
   63    H    TYR   9           H        TYR   9   5.918  -2.970   5.850
   64    HA   TYR   9           HA       TYR   9   6.176  -0.048   6.411
   65   1HB   TYR   9          2HB       TYR   9   6.171  -2.306   8.280
   66   2HB   TYR   9          1HB       TYR   9   7.627  -1.321   8.418
   67    HD1  TYR   9           1HD      TYR   9   7.568   0.645   9.682
   68    HD2  TYR   9           2HD      TYR   9   3.903  -0.979   8.138
   69    HE1  TYR   9           1HE      TYR   9   6.285   2.375  10.911
   70    HE2  TYR   9           2HE      TYR   9   2.621   0.751   9.365
   71    HH   TYR   9           HH       TYR   9   4.257   3.353  11.122
   72    H    TRP  10           H        TRP  10   8.062  -3.088   6.611
   73    HA   TRP  10           HA       TRP  10  10.330  -1.700   5.237
   74   1HB   TRP  10          2HB       TRP  10  10.300  -4.340   6.728
   75   2HB   TRP  10          1HB       TRP  10  11.698  -3.336   6.354
   76    HD1  TRP  10           HD       TRP  10  11.791  -0.899   7.612
   77    HE1  TRP  10           1HE      TRP  10  10.986  -0.252   9.974
   78    HE3  TRP  10           3HE      TRP  10   8.621  -4.788   8.555
   79    HZ2  TRP  10           2HZ      TRP  10   9.228  -1.256  11.998
   80    HZ3  TRP  10           3HZ      TRP  10   7.395  -4.919  10.705
   81    HH2  TRP  10           HH       TRP  10   7.695  -3.160  12.427
   82    H    ASN  11           H        ASN  11   7.831  -2.997   4.005
   83    HA   ASN  11           HA       ASN  11   7.352  -4.322   2.105
   84   1HB   ASN  11          2HB       ASN  11  10.376  -4.139   1.836
   85   2HB   ASN  11          1HB       ASN  11   9.234  -4.475   0.535
   86   1HD2  ASN  11          1HD2      ASN  11  10.977  -1.977   1.984
   87   2HD2  ASN  11          2HD2      ASN  11  10.053  -0.664   1.433
   88    H    CYS  12           H        CYS  12   8.545  -5.484   4.812
   89    HA   CYS  12           HA       CYS  12   9.588  -8.086   3.862
   90   1HB   CYS  12          2HB       CYS  12  10.380  -6.588   5.848
   91   2HB   CYS  12          1HB       CYS  12   9.000  -7.276   6.703
   92    H    LYS  13           H        LYS  13   6.814  -6.795   5.674
   93    HA   LYS  13           HA       LYS  13   5.528  -9.266   6.256
   94   1HB   LYS  13          2HB       LYS  13   4.715  -6.393   5.904
   95   2HB   LYS  13          1HB       LYS  13   3.474  -7.617   6.175
   96   1HG   LYS  13          2HG       LYS  13   5.853  -7.039   7.963
   97   2HG   LYS  13          1HG       LYS  13   4.162  -6.691   8.324
   98   1HD   LYS  13          2HD       LYS  13   4.049  -9.361   7.707
   99   2HD   LYS  13          1HD       LYS  13   5.630  -9.245   8.483
  100   1HE   LYS  13          2HE       LYS  13   4.271  -9.547  10.357
  101   2HE   LYS  13          1HE       LYS  13   4.241  -7.775  10.243
  102   1HZ   LYS  13          1HZ       LYS  13   1.994  -8.467  10.309
  103   2HZ   LYS  13          2HZ       LYS  13   2.254  -9.697   9.166
  104   3HZ   LYS  13          3HZ       LYS  13   2.308  -8.067   8.690
  105    H    ARG  14           H        ARG  14   3.700  -7.162   4.146
  106    HA   ARG  14           HA       ARG  14   3.874  -9.123   1.906
  107   1HB   ARG  14          2HB       ARG  14   1.503  -8.416   3.624
  108   2HB   ARG  14          1HB       ARG  14   1.259  -8.941   1.958
  109   1HG   ARG  14          2HG       ARG  14   3.068 -10.562   3.709
  110   2HG   ARG  14          1HG       ARG  14   1.326 -10.708   3.935
  111   1HD   ARG  14          2HD       ARG  14   1.666 -12.336   2.299
  112   2HD   ARG  14          1HD       ARG  14   1.367 -10.923   1.266
  113    HE   ARG  14           HE       ARG  14   4.149 -11.042   1.999
  114   1HH1  ARG  14          1HH1      ARG  14   2.047 -11.228  -0.565
  115   2HH1  ARG  14          2HH1      ARG  14   3.022 -12.276  -1.540
  116   1HH2  ARG  14          1HH2      ARG  14   5.292 -12.959   0.992
  117   2HH2  ARG  14          2HH2      ARG  14   4.859 -13.257  -0.659
  118    H    ILE  15           H        ILE  15   4.674  -7.579   0.431
  119    HA   ILE  15           HA       ILE  15   4.157  -4.866   0.171
  120    HB   ILE  15           HB       ILE  15   5.604  -6.486  -1.215
  121   1HG1  ILE  15          2HG1      ILE  15   4.157  -4.707  -3.117
  122   2HG1  ILE  15          1HG1      ILE  15   4.847  -3.946  -1.686
  123   1HG2  ILE  15          1HG2      ILE  15   3.114  -6.627  -2.929
  124   2HG2  ILE  15          2HG2      ILE  15   3.580  -7.914  -1.817
  125   3HG2  ILE  15          3HG2      ILE  15   4.636  -7.486  -3.162
  126   1HD1  ILE  15          1HD1      ILE  15   6.698  -5.849  -2.886
  127   2HD1  ILE  15          2HD1      ILE  15   6.950  -4.151  -2.480
  128   3HD1  ILE  15          3HD1      ILE  15   6.224  -4.590  -4.026
  129    H    CYS  16           H        CYS  16   2.012  -7.533  -0.510
  130    HA   CYS  16           HA       CYS  16  -0.293  -5.714  -0.731
  131   1HB   CYS  16          2HB       CYS  16   0.578  -5.703  -2.977
  132   2HB   CYS  16          1HB       CYS  16   0.728  -7.455  -2.990
  133    H    TRP  17           H        TRP  17  -1.467  -6.797   0.862
  134    HA   TRP  17           HA       TRP  17  -1.430  -9.555   1.466
  135   1HB   TRP  17          2HB       TRP  17  -3.016  -7.180   2.013
  136   2HB   TRP  17          1HB       TRP  17  -4.041  -8.611   1.920
  137    HD1  TRP  17           HD       TRP  17  -1.905 -10.705   3.033
  138    HE1  TRP  17           1HE      TRP  17  -1.337 -10.695   5.546
  139    HE3  TRP  17           3HE      TRP  17  -3.384  -5.971   4.252
  140    HZ2  TRP  17           2HZ      TRP  17  -1.491  -8.915   7.780
  141    HZ3  TRP  17           3HZ      TRP  17  -3.160  -5.144   6.578
  142    HH2  TRP  17           HH       TRP  17  -2.216  -6.608   8.342
  143    H    TYR  18           H        TYR  18  -3.838 -10.727   1.194
  144    HA   TYR  18           HA       TYR  18  -4.263 -10.847  -1.774
  145   1HB   TYR  18          2HB       TYR  18  -4.404 -12.902   0.446
  146   2HB   TYR  18          1HB       TYR  18  -4.988 -13.223  -1.188
  147    HD1  TYR  18           1HD      TYR  18  -2.091 -13.005   0.959
  148    HD2  TYR  18           2HD      TYR  18  -3.377 -12.956  -3.139
  149    HE1  TYR  18           1HE      TYR  18   0.225 -13.500   0.226
  150    HE2  TYR  18           2HE      TYR  18  -1.060 -13.452  -3.873
  151    HH   TYR  18           HH       TYR  18   0.982 -14.129  -3.172
  152    H    ASN  19           H        ASN  19  -5.662  -9.031   0.097
  153    HA   ASN  19           HA       ASN  19  -8.444 -10.072  -0.303
  154   1HB   ASN  19          2HB       ASN  19  -6.985  -9.260   2.106
  155   2HB   ASN  19          1HB       ASN  19  -8.519  -8.408   1.923
  156   1HD2  ASN  19          1HD2      ASN  19 -10.409 -10.013   1.212
  157   2HD2  ASN  19          2HD2      ASN  19 -10.452 -11.490   2.047
  158    H    ASN  20           H        ASN  20  -9.936  -8.485  -0.987
  159    HA   ASN  20           HA       ASN  20  -8.787  -6.065  -2.177
  160   1HB   ASN  20          2HB       ASN  20 -11.163  -5.819  -2.966
  161   2HB   ASN  20          1HB       ASN  20 -10.461  -7.393  -3.346
  162   1HD2  ASN  20          1HD2      ASN  20 -13.306  -6.149  -2.353
  163   2HD2  ASN  20          2HD2      ASN  20 -13.846  -7.383  -1.319
  164    H    LYS  21           H        LYS  21  -9.473  -6.680   0.926
  165    HA   LYS  21           HA       LYS  21 -10.568  -3.929   1.411
  166   1HB   LYS  21          2HB       LYS  21 -11.375  -6.625   2.331
  167   2HB   LYS  21          1HB       LYS  21 -11.335  -5.391   3.590
  168   1HG   LYS  21          2HG       LYS  21 -12.597  -4.620   1.007
  169   2HG   LYS  21          1HG       LYS  21 -13.485  -5.764   2.014
  170   1HD   LYS  21          2HD       LYS  21 -12.419  -3.657   3.668
  171   2HD   LYS  21          1HD       LYS  21 -13.331  -2.952   2.333
  172   1HE   LYS  21          2HE       LYS  21 -14.534  -5.291   3.777
  173   2HE   LYS  21          1HE       LYS  21 -14.587  -3.695   4.552
  174   1HZ   LYS  21          1HZ       LYS  21 -15.242  -2.955   2.145
  175   2HZ   LYS  21          2HZ       LYS  21 -16.420  -3.553   3.213
  176   3HZ   LYS  21          3HZ       LYS  21 -15.770  -4.562   2.010
  177    H    TYR  22           H        TYR  22  -8.432  -6.536   2.517
  178    HA   TYR  22           HA       TYR  22  -7.454  -5.461   4.922
  179   1HB   TYR  22          2HB       TYR  22  -6.702  -7.402   2.905
  180   2HB   TYR  22          1HB       TYR  22  -5.270  -6.584   3.530
  181    HD1  TYR  22           1HD      TYR  22  -7.335  -9.330   4.040
  182    HD2  TYR  22           2HD      TYR  22  -5.452  -6.145   6.220
  183    HE1  TYR  22           1HE      TYR  22  -7.473 -10.673   6.120
  184    HE2  TYR  22           2HE      TYR  22  -5.590  -7.487   8.300
  185    HH   TYR  22           HH       TYR  22  -7.440 -10.407   8.482
  186    H    CYS  23           H        CYS  23  -6.596  -4.609   1.582
  187    HA   CYS  23           HA       CYS  23  -4.519  -2.706   2.482
  188   1HB   CYS  23          2HB       CYS  23  -5.120  -4.240   0.186
  189   2HB   CYS  23          1HB       CYS  23  -5.291  -2.555  -0.307
  190    H    ASN  24           H        ASN  24  -7.841  -2.695   1.305
  191    HA   ASN  24           HA       ASN  24  -8.034   0.136   0.742
  192   1HB   ASN  24          2HB       ASN  24  -9.498  -1.950   0.103
  193   2HB   ASN  24          1HB       ASN  24 -10.302  -1.636   1.640
  194   1HD2  ASN  24          1HD2      ASN  24 -12.287  -0.956   0.544
  195   2HD2  ASN  24          2HD2      ASN  24 -12.378   0.536  -0.262
  196    H    ASP  25           H        ASP  25  -9.170  -1.822   3.535
  197    HA   ASP  25           HA       ASP  25 -10.202   0.215   5.151
  198   1HB   ASP  25          2HB       ASP  25 -10.187  -2.275   5.534
  199   2HB   ASP  25          1HB       ASP  25  -8.505  -2.135   6.048
  200    H    LEU  26           H        LEU  26  -6.802  -0.911   5.023
  201    HA   LEU  26           HA       LEU  26  -5.844   1.078   6.902
  202   1HB   LEU  26          2HB       LEU  26  -4.821  -1.066   5.148
  203   2HB   LEU  26          1HB       LEU  26  -3.679   0.247   5.435
  204    HG   LEU  26           HG       LEU  26  -5.175  -0.798   7.792
  205   1HD1  LEU  26          1HD1      LEU  26  -4.233  -2.860   7.834
  206   2HD1  LEU  26          2HD1      LEU  26  -2.683  -2.255   7.249
  207   3HD1  LEU  26          3HD1      LEU  26  -3.973  -2.627   6.104
  208   1HD2  LEU  26          1HD2      LEU  26  -3.451   1.105   7.740
  209   2HD2  LEU  26          2HD2      LEU  26  -2.240  -0.145   7.454
  210   3HD2  LEU  26          3HD2      LEU  26  -3.185  -0.158   8.943
  211    H    CYS  27           H        CYS  27  -5.887   0.839   3.346
  212    HA   CYS  27           HA       CYS  27  -4.383   3.187   2.774
  213   1HB   CYS  27          2HB       CYS  27  -6.493   1.530   1.421
  214   2HB   CYS  27          1HB       CYS  27  -5.971   3.034   0.662
  215    H    LYS  28           H        LYS  28  -7.799   2.726   3.592
  216    HA   LYS  28           HA       LYS  28  -8.729   5.352   2.940
  217   1HB   LYS  28          2HB       LYS  28  -9.661   2.928   4.097
  218   2HB   LYS  28          1HB       LYS  28 -10.047   4.214   5.242
  219   1HG   LYS  28          2HG       LYS  28 -11.829   4.681   3.939
  220   2HG   LYS  28          1HG       LYS  28 -10.680   5.312   2.757
  221   1HD   LYS  28          2HD       LYS  28 -10.957   3.537   1.374
  222   2HD   LYS  28          1HD       LYS  28 -10.922   2.382   2.707
  223   1HE   LYS  28          2HE       LYS  28 -13.165   2.153   2.461
  224   2HE   LYS  28          1HE       LYS  28 -13.340   3.836   2.998
  225   1HZ   LYS  28          1HZ       LYS  28 -12.778   2.950   0.217
  226   2HZ   LYS  28          2HZ       LYS  28 -12.892   4.565   0.731
  227   3HZ   LYS  28          3HZ       LYS  28 -14.258   3.556   0.780
  228    H    GLY  29           H        GLY  29  -7.064   4.039   5.759
  229   1HA   GLY  29          2HA       GLY  29  -7.516   6.221   7.550
  230   2HA   GLY  29          1HA       GLY  29  -6.127   5.129   7.622
  231    H    LEU  30           H        LEU  30  -5.257   5.676   4.918
  232    HA   LEU  30           HA       LEU  30  -3.834   8.223   5.414
  233   1HB   LEU  30          2HB       LEU  30  -3.647   6.098   3.248
  234   2HB   LEU  30          1HB       LEU  30  -2.507   7.427   3.465
  235    HG   LEU  30           HG       LEU  30  -2.927   5.993   5.957
  236   1HD1  LEU  30          1HD1      LEU  30  -2.993   3.874   5.176
  237   2HD1  LEU  30          2HD1      LEU  30  -1.334   4.123   4.630
  238   3HD1  LEU  30          3HD1      LEU  30  -2.678   4.405   3.523
  239   1HD2  LEU  30          1HD2      LEU  30  -0.302   5.816   4.682
  240   2HD2  LEU  30          2HD2      LEU  30  -0.762   6.607   6.190
  241   3HD2  LEU  30          3HD2      LEU  30  -0.947   7.457   4.656
  242    H    LYS  31           H        LYS  31  -6.782   7.859   4.531
  243    HA   LYS  31           HA       LYS  31  -8.274   9.158   3.260
  244   1HB   LYS  31          2HB       LYS  31  -6.469  10.871   3.870
  245   2HB   LYS  31          1HB       LYS  31  -5.805  10.590   2.260
  246   1HG   LYS  31          2HG       LYS  31  -7.283  12.085   1.462
  247   2HG   LYS  31          1HG       LYS  31  -8.568  10.948   1.872
  248   1HD   LYS  31          2HD       LYS  31  -9.287  12.695   3.169
  249   2HD   LYS  31          1HD       LYS  31  -8.131  12.014   4.314
  250   1HE   LYS  31          2HE       LYS  31  -7.232  14.122   4.303
  251   2HE   LYS  31          1HE       LYS  31  -6.512  13.622   2.760
  252   1HZ   LYS  31          1HZ       LYS  31  -7.817  15.660   2.510
  253   2HZ   LYS  31          2HZ       LYS  31  -9.198  14.856   3.086
  254   3HZ   LYS  31          3HZ       LYS  31  -8.491  14.387   1.614
  255    H    ALA  32           H        ALA  32  -6.519   6.793   2.112
  256    HA   ALA  32           HA       ALA  32  -6.641   7.450  -0.777
  257   1HB   ALA  32          1HB       ALA  32  -4.736   6.237   0.390
  258   2HB   ALA  32          2HB       ALA  32  -5.398   5.392  -1.008
  259   3HB   ALA  32          3HB       ALA  32  -5.839   4.881   0.621
  260    H    ASP  33           H        ASP  33  -9.101   7.628  -0.545
  261    HA   ASP  33           HA       ASP  33 -10.956   5.746   0.171
  262   1HB   ASP  33          2HB       ASP  33 -11.395   7.921  -0.926
  263   2HB   ASP  33          1HB       ASP  33 -10.832   7.253  -2.458
  264    H    SER  34           H        SER  34  -9.866   5.790  -3.221
  265    HA   SER  34           HA       SER  34 -10.641   3.035  -3.661
  266   1HB   SER  34          2HB       SER  34  -9.998   5.310  -5.148
  267   2HB   SER  34          1HB       SER  34  -8.710   4.173  -5.530
  268    HG   SER  34           HG       SER  34 -11.362   3.270  -5.469
  269    H    GLY  35           H        GLY  35  -9.403   1.902  -1.977
  270   1HA   GLY  35          2HA       GLY  35  -6.504   1.653  -2.666
  271   2HA   GLY  35          1HA       GLY  35  -7.098   1.541  -1.008
  272    H    TYR  36           H        TYR  36  -6.634  -0.167  -3.975
  273    HA   TYR  36           HA       TYR  36  -7.763  -2.631  -2.691
  274   1HB   TYR  36          2HB       TYR  36  -8.487  -3.295  -4.933
  275   2HB   TYR  36          1HB       TYR  36  -9.123  -1.692  -4.569
  276    HD1  TYR  36           1HD      TYR  36  -8.148   0.323  -5.607
  277    HD2  TYR  36           2HD      TYR  36  -6.760  -3.618  -6.606
  278    HE1  TYR  36           1HE      TYR  36  -7.006   1.232  -7.612
  279    HE2  TYR  36           2HE      TYR  36  -5.618  -2.708  -8.611
  280    HH   TYR  36           HH       TYR  36  -5.441  -0.898  -9.961
  281    H    CYS  37           H        CYS  37  -6.575  -4.590  -3.173
  282    HA   CYS  37           HA       CYS  37  -3.730  -4.069  -3.899
  283   1HB   CYS  37          2HB       CYS  37  -4.988  -5.396  -1.818
  284   2HB   CYS  37          1HB       CYS  37  -4.499  -6.714  -2.881
  285    H    TRP  38           H        TRP  38  -2.713  -5.285  -5.558
  286    HA   TRP  38           HA       TRP  38  -4.494  -6.351  -7.629
  287   1HB   TRP  38          2HB       TRP  38  -2.239  -5.012  -7.762
  288   2HB   TRP  38          1HB       TRP  38  -1.493  -6.599  -7.571
  289    HD1  TRP  38           HD       TRP  38  -1.302  -8.050  -9.655
  290    HE1  TRP  38           1HE      TRP  38  -2.218  -7.929 -12.063
  291    HE3  TRP  38           3HE      TRP  38  -4.491  -4.102  -9.176
  292    HZ2  TRP  38           2HZ      TRP  38  -4.066  -6.358 -13.584
  293    HZ3  TRP  38           3HZ      TRP  38  -5.818  -3.308 -11.115
  294    HH2  TRP  38           HH       TRP  38  -5.610  -4.433 -13.316
  295    H    GLY  39           H        GLY  39  -4.570  -8.579  -8.286
  296   1HA   GLY  39          2HA       GLY  39  -3.587 -10.473  -6.200
  297   2HA   GLY  39          1HA       GLY  39  -4.949 -10.785  -7.274
  298    H    TRP  40           H        TRP  40  -1.565  -9.759  -7.820
  299    HA   TRP  40           HA       TRP  40  -0.967 -12.253  -9.246
  300   1HB   TRP  40          2HB       TRP  40  -2.180 -11.146 -10.979
  301   2HB   TRP  40          1HB       TRP  40  -1.431  -9.597 -10.614
  302    HD1  TRP  40           HD       TRP  40   0.258  -8.979 -12.372
  303    HE1  TRP  40           1HE      TRP  40   1.974 -10.252 -13.812
  304    HE3  TRP  40           3HE      TRP  40  -0.616 -13.739 -10.776
  305    HZ2  TRP  40           2HZ      TRP  40   2.867 -12.944 -14.231
  306    HZ3  TRP  40           3HZ      TRP  40   0.677 -15.642 -11.705
  307    HH2  TRP  40           HH       TRP  40   2.417 -15.249 -13.429
  308    H    THR  41           H        THR  41   0.374  -9.061  -9.946
  309    HA   THR  41           HA       THR  41   2.663  -9.482  -8.121
  310    HB   THR  41           HB       THR  41   4.265  -9.474 -10.018
  311    HG1  THR  41           1HG      THR  41   3.559  -9.387 -12.052
  312   1HG2  THR  41          1HG2      THR  41   3.896 -11.740 -10.728
  313   2HG2  THR  41          2HG2      THR  41   2.166 -11.617 -10.413
  314   3HG2  THR  41          3HG2      THR  41   3.310 -11.615  -9.069
  315    H    LEU  42           H        LEU  42   0.632  -7.387  -8.352
  316    HA   LEU  42           HA       LEU  42   2.354  -5.106  -9.292
  317   1HB   LEU  42          2HB       LEU  42  -0.215  -5.938 -10.049
  318   2HB   LEU  42          1HB       LEU  42  -0.482  -4.532  -9.019
  319    HG   LEU  42           HG       LEU  42   1.515  -4.567 -11.295
  320   1HD1  LEU  42          1HD1      LEU  42  -0.257  -4.483 -12.689
  321   2HD1  LEU  42          2HD1      LEU  42  -0.635  -2.912 -11.980
  322   3HD1  LEU  42          3HD1      LEU  42  -1.390  -4.372 -11.341
  323   1HD2  LEU  42          1HD2      LEU  42   0.187  -2.130 -10.168
  324   2HD2  LEU  42          2HD2      LEU  42   1.796  -2.305 -10.869
  325   3HD2  LEU  42          3HD2      LEU  42   1.479  -2.885  -9.234
  326    H    SER  43           H        SER  43   2.062  -6.472  -6.533
  327    HA   SER  43           HA       SER  43   1.803  -5.812  -4.286
  328   1HB   SER  43          2HB       SER  43   2.849  -3.609  -3.904
  329   2HB   SER  43          1HB       SER  43   3.746  -4.522  -5.110
  330    HG   SER  43           HG       SER  43   1.684  -2.710  -5.794
  331    H    CYS  44           H        CYS  44   0.874  -3.674  -2.975
  332    HA   CYS  44           HA       CYS  44  -1.967  -3.641  -3.557
  333   1HB   CYS  44          2HB       CYS  44  -0.788  -3.480  -1.308
  334   2HB   CYS  44          1HB       CYS  44  -0.340  -1.831  -1.743
  335    H    TYR  45           H        TYR  45  -3.104  -1.385  -3.727
  336    HA   TYR  45           HA       TYR  45  -1.528   0.690  -5.100
  337   1HB   TYR  45          2HB       TYR  45  -2.013  -1.073  -6.806
  338   2HB   TYR  45          1HB       TYR  45  -3.735  -0.831  -6.521
  339    HD1  TYR  45           1HD      TYR  45  -3.421  -0.397  -9.150
  340    HD2  TYR  45           2HD      TYR  45  -2.107   2.258  -6.036
  341    HE1  TYR  45           1HE      TYR  45  -3.425   1.493 -10.755
  342    HE2  TYR  45           2HE      TYR  45  -2.113   4.145  -7.641
  343    HH   TYR  45           HH       TYR  45  -3.612   3.982 -10.662
  344    H    CYS  46           H        CYS  46  -2.319   2.263  -3.678
  345    HA   CYS  46           HA       CYS  46  -5.293   2.684  -3.677
  346   1HB   CYS  46          2HB       CYS  46  -3.214   3.321  -1.552
  347   2HB   CYS  46          1HB       CYS  46  -4.943   3.633  -1.416
  348    H    GLN  47           H        GLN  47  -5.960   4.738  -4.318
  349    HA   GLN  47           HA       GLN  47  -3.790   6.758  -4.810
  350   1HB   GLN  47          2HB       GLN  47  -6.361   6.245  -6.346
  351   2HB   GLN  47          1HB       GLN  47  -5.108   7.408  -6.782
  352   1HG   GLN  47          2HG       GLN  47  -4.299   5.699  -8.052
  353   2HG   GLN  47          1HG       GLN  47  -3.629   5.128  -6.523
  354   1HE2  GLN  47          1HE2      GLN  47  -5.276   3.969  -9.115
  355   2HE2  GLN  47          2HE2      GLN  47  -6.208   2.764  -8.369
  356    H    GLY  48           H        GLY  48  -4.317   8.941  -4.306
  357   1HA   GLY  48          2HA       GLY  48  -5.865  10.699  -3.659
  358   2HA   GLY  48          1HA       GLY  48  -6.992   9.460  -3.106
  359    H    LEU  49           H        LEU  49  -3.597   9.262  -2.321
  360    HA   LEU  49           HA       LEU  49  -4.308   9.779   0.548
  361   1HB   LEU  49          2HB       LEU  49  -1.971   8.481   0.718
  362   2HB   LEU  49          1HB       LEU  49  -3.484   7.610   0.493
  363    HG   LEU  49           HG       LEU  49  -1.920   8.542  -1.902
  364   1HD1  LEU  49          1HD1      LEU  49  -1.228   5.877  -1.532
  365   2HD1  LEU  49          2HD1      LEU  49  -1.081   6.565   0.085
  366   3HD1  LEU  49          3HD1      LEU  49  -0.171   7.262  -1.257
  367   1HD2  LEU  49          1HD2      LEU  49  -4.320   7.152  -1.485
  368   2HD2  LEU  49          2HD2      LEU  49  -3.160   5.906  -1.945
  369   3HD2  LEU  49          3HD2      LEU  49  -3.441   7.286  -3.007
  370    HA   PRO  50           HA       PRO  50  -1.512  13.162   0.793
  371   1HB   PRO  50          2HB       PRO  50   0.015  12.629   3.006
  372   2HB   PRO  50          1HB       PRO  50  -1.685  13.133   3.099
  373   1HG   PRO  50          2HG       PRO  50  -0.513  10.396   3.291
  374   2HG   PRO  50          1HG       PRO  50  -1.806  11.136   4.249
  375   1HD   PRO  50          2HD       PRO  50  -2.316   9.411   2.243
  376   2HD   PRO  50          1HD       PRO  50  -3.404  10.762   2.630
  377    H    ASP  51           H        ASP  51   0.739  13.816   0.439
  378    HA   ASP  51           HA       ASP  51   2.235  12.116  -1.288
  379   1HB   ASP  51          2HB       ASP  51   2.300  14.616  -1.134
  380   2HB   ASP  51          1HB       ASP  51   3.169  14.465   0.394
  381    H    ASN  52           H        ASN  52   2.168  12.366   2.193
  382    HA   ASN  52           HA       ASN  52   4.758  11.010   2.567
  383   1HB   ASN  52          2HB       ASN  52   3.852  12.765   4.092
  384   2HB   ASN  52          1HB       ASN  52   2.510  11.692   4.493
  385   1HD2  ASN  52          1HD2      ASN  52   2.865  10.572   6.407
  386   2HD2  ASN  52          2HD2      ASN  52   4.382  10.078   6.987
  387    H    ALA  53           H        ALA  53   2.036   9.865   1.323
  388    HA   ALA  53           HA       ALA  53   1.199   7.679   2.953
  389   1HB   ALA  53          1HB       ALA  53   0.879   6.888   0.321
  390   2HB   ALA  53          2HB       ALA  53   0.974   8.645   0.191
  391   3HB   ALA  53          3HB       ALA  53  -0.250   7.901   1.220
  392    H    ARG  54           H        ARG  54   2.096   5.663   3.289
  393    HA   ARG  54           HA       ARG  54   4.827   5.142   2.400
  394   1HB   ARG  54          2HB       ARG  54   4.243   4.404   4.573
  395   2HB   ARG  54          1HB       ARG  54   2.708   3.731   4.024
  396   1HG   ARG  54          2HG       ARG  54   4.317   1.927   4.468
  397   2HG   ARG  54          1HG       ARG  54   3.937   1.999   2.748
  398   1HD   ARG  54          2HD       ARG  54   6.375   1.759   3.074
  399   2HD   ARG  54          1HD       ARG  54   6.012   3.353   2.383
  400    HE   ARG  54           HE       ARG  54   6.692   4.327   4.426
  401   1HH1  ARG  54          1HH1      ARG  54   8.451   2.005   4.981
  402   2HH1  ARG  54          2HH1      ARG  54   7.899   1.472   6.534
  403   1HH2  ARG  54          1HH2      ARG  54   4.898   3.199   6.356
  404   2HH2  ARG  54          2HH2      ARG  54   5.888   2.147   7.310
  405    H    ILE  55           H        ILE  55   5.412   3.964   0.599
  406    HA   ILE  55           HA       ILE  55   3.578   1.963  -0.548
  407    HB   ILE  55           HB       ILE  55   3.806   3.252  -2.808
  408   1HG1  ILE  55          2HG1      ILE  55   4.034   5.679  -2.560
  409   2HG1  ILE  55          1HG1      ILE  55   4.253   5.501  -0.818
  410   1HG2  ILE  55          1HG2      ILE  55   1.729   2.951  -1.364
  411   2HG2  ILE  55          2HG2      ILE  55   1.740   4.389  -2.385
  412   3HG2  ILE  55          3HG2      ILE  55   2.094   4.527  -0.663
  413   1HD1  ILE  55          1HD1      ILE  55   6.350   5.697  -2.422
  414   2HD1  ILE  55          2HD1      ILE  55   6.057   3.973  -2.653
  415   3HD1  ILE  55          3HD1      ILE  55   6.379   4.605  -1.037
  416    H    LYS  56           H        LYS  56   4.736   1.391  -2.892
  417    HA   LYS  56           HA       LYS  56   7.045  -0.056  -2.386
  418   1HB   LYS  56          2HB       LYS  56   5.465   0.733  -4.585
  419   2HB   LYS  56          1HB       LYS  56   7.127   1.120  -5.033
  420   1HG   LYS  56          2HG       LYS  56   7.492  -1.326  -3.915
  421   2HG   LYS  56          1HG       LYS  56   5.863  -1.521  -4.564
  422   1HD   LYS  56          2HD       LYS  56   6.817  -1.913  -6.569
  423   2HD   LYS  56          1HD       LYS  56   7.274  -0.209  -6.595
  424   1HE   LYS  56          2HE       LYS  56   9.462  -0.646  -5.962
  425   2HE   LYS  56          1HE       LYS  56   9.014  -2.104  -5.054
  426   1HZ   LYS  56          1HZ       LYS  56   8.495  -3.216  -7.120
  427   2HZ   LYS  56          2HZ       LYS  56  10.097  -2.652  -7.168
  428   3HZ   LYS  56          3HZ       LYS  56   8.876  -1.824  -8.010
  429    H    ARG  57           H        ARG  57   8.563   1.100  -1.083
  430    HA   ARG  57           HA       ARG  57   9.899   3.439  -2.403
  431   1HB   ARG  57          2HB       ARG  57   8.720   3.573  -0.100
  432   2HB   ARG  57          1HB       ARG  57  10.077   2.621   0.501
  433   1HG   ARG  57          2HG       ARG  57  11.106   4.624   0.784
  434   2HG   ARG  57          1HG       ARG  57  11.357   4.565  -0.961
  435   1HD   ARG  57          2HD       ARG  57   9.997   6.354  -1.250
  436   2HD   ARG  57          1HD       ARG  57   8.685   5.533  -0.381
  437    HE   ARG  57           HE       ARG  57  10.751   7.269   0.866
  438   1HH1  ARG  57          1HH1      ARG  57   9.603   4.636   2.228
  439   2HH1  ARG  57          2HH1      ARG  57   8.485   5.371   3.328
  440   1HH2  ARG  57          1HH2      ARG  57   8.618   8.482   1.799
  441   2HH2  ARG  57          2HH2      ARG  57   7.927   7.551   3.085
  442    H    SER  58           H        SER  58  10.332   0.398  -2.687
  443    HA   SER  58           HA       SER  58  12.200  -1.015  -2.990
  444   1HB   SER  58          2HB       SER  58  12.885   1.489  -3.760
  445   2HB   SER  58          1HB       SER  58  14.057   1.250  -2.467
  446    HG   SER  58           HG       SER  58  15.004  -0.287  -3.596
  447    H    GLY  59           H        GLY  59  14.485  -1.459  -1.804
  448   1HA   GLY  59          2HA       GLY  59  15.679  -1.604   0.278
  449   2HA   GLY  59          1HA       GLY  59  14.305  -0.852   1.091
  450    H    ARG  60           H        ARG  60  15.756  -3.841   0.182
  451    HA   ARG  60           HA       ARG  60  13.652  -5.687   0.205
  452   1HB   ARG  60          2HB       ARG  60  15.393  -7.234   1.101
  453   2HB   ARG  60          1HB       ARG  60  16.017  -6.212  -0.194
  454   1HG   ARG  60          2HG       ARG  60  16.817  -4.612   1.616
  455   2HG   ARG  60          1HG       ARG  60  16.433  -5.877   2.784
  456   1HD   ARG  60          2HD       ARG  60  18.039  -6.788   0.468
  457   2HD   ARG  60          1HD       ARG  60  18.865  -5.662   1.564
  458    HE   ARG  60           HE       ARG  60  18.177  -7.203   3.441
  459   1HH1  ARG  60          1HH2      ARG  60  16.352  -8.799   1.516
  460   2HH1  ARG  60          2HH2      ARG  60  17.285 -10.247   1.331
  461   1HH2  ARG  60          1HH1      ARG  60  20.183  -8.859   2.635
  462   2HH2  ARG  60          2HH1      ARG  60  19.456 -10.280   1.966
  463    H    CYS  61           H        CYS  61  13.550  -7.323   2.274
  464    HA   CYS  61           HA       CYS  61  11.866  -6.312   4.204
  465   1HB   CYS  61          2HB       CYS  61  12.393  -8.669   3.959
  466   2HB   CYS  61          1HB       CYS  61  14.067  -8.390   4.440
  467    H    ARG  62           H        ARG  62  12.480  -4.183   4.897
  468    HA   ARG  62           HA       ARG  62  15.093  -3.725   6.164
  469   1HB   ARG  62          2HB       ARG  62  12.813  -2.236   5.130
  470   2HB   ARG  62          1HB       ARG  62  13.347  -1.593   6.683
  471   1HG   ARG  62          2HG       ARG  62  15.566  -2.254   4.878
  472   2HG   ARG  62          1HG       ARG  62  14.496  -1.002   4.244
  473   1HD   ARG  62          2HD       ARG  62  15.122  -0.662   7.103
  474   2HD   ARG  62          1HD       ARG  62  16.534  -0.529   6.035
  475    HE   ARG  62           HE       ARG  62  15.554   1.394   5.041
  476   1HH1  ARG  62          1HH2      ARG  62  14.010   0.883   7.879
  477   2HH1  ARG  62          2HH2      ARG  62  12.478   1.544   7.416
  478   1HH2  ARG  62          1HH1      ARG  62  13.274   1.724   4.046
  479   2HH2  ARG  62          2HH1      ARG  62  12.061   2.020   5.246
  480    H    ALA  63           H        ALA  63  13.654  -5.792   7.506
  481    HA   ALA  63           HA       ALA  63  13.626  -4.730  10.221
  482   1HB   ALA  63          1HB       ALA  63  11.022  -5.831   9.955
  483   2HB   ALA  63          2HB       ALA  63  11.236  -4.709   8.612
  484   3HB   ALA  63          3HB       ALA  63  11.446  -4.149  10.271
  Start of MODEL    3
    1   1H    LYS   1          1HT       LYS   1  -3.178  15.039  -2.416
    2   2H    LYS   1          2HT       LYS   1  -2.374  15.465  -3.849
    3   3H    LYS   1          3HT       LYS   1  -1.662  14.368  -2.766
    4    HA   LYS   1           HA       LYS   1  -3.749  12.937  -3.177
    5   1HB   LYS   1          2HB       LYS   1  -4.770  13.439  -5.368
    6   2HB   LYS   1          1HB       LYS   1  -4.914  14.821  -4.283
    7   1HG   LYS   1          2HG       LYS   1  -2.422  15.057  -5.658
    8   2HG   LYS   1          1HG       LYS   1  -3.672  14.720  -6.857
    9   1HD   LYS   1          2HD       LYS   1  -4.796  16.682  -6.442
   10   2HD   LYS   1          1HD       LYS   1  -4.333  16.709  -4.740
   11   1HE   LYS   1          2HE       LYS   1  -2.486  17.968  -5.166
   12   2HE   LYS   1          1HE       LYS   1  -2.038  16.974  -6.567
   13   1HZ   LYS   1          1HZ       LYS   1  -2.835  19.345  -7.021
   14   2HZ   LYS   1          2HZ       LYS   1  -4.386  18.768  -6.639
   15   3HZ   LYS   1          3HZ       LYS   1  -3.526  18.099  -7.941
   16    H    ILE   2           H        ILE   2  -2.075  11.401  -3.183
   17    HA   ILE   2           HA       ILE   2  -0.455  11.221  -5.703
   18    HB   ILE   2           HB       ILE   2   0.726  11.776  -3.530
   19   1HG1  ILE   2          2HG1      ILE   2   1.389   9.129  -4.857
   20   2HG1  ILE   2          1HG1      ILE   2   1.939  10.723  -5.381
   21   1HG2  ILE   2          1HG2      ILE   2   0.039   8.911  -2.819
   22   2HG2  ILE   2          2HG2      ILE   2  -0.792  10.308  -2.139
   23   3HG2  ILE   2          3HG2      ILE   2   0.926  10.072  -1.831
   24   1HD1  ILE   2          1HD1      ILE   2   2.685   9.222  -2.870
   25   2HD1  ILE   2          2HD1      ILE   2   2.934  10.961  -3.016
   26   3HD1  ILE   2          3HD1      ILE   2   3.753   9.858  -4.121
   27    H    ASP   3           H        ASP   3   0.034   8.979  -6.364
   28    HA   ASP   3           HA       ASP   3  -1.776   6.895  -5.229
   29   1HB   ASP   3          2HB       ASP   3  -2.498   6.366  -7.565
   30   2HB   ASP   3          1HB       ASP   3  -2.975   7.989  -7.066
   31    H    GLY   4           H        GLY   4  -0.910   4.803  -5.412
   32   1HA   GLY   4          2HA       GLY   4   1.135   4.015  -7.235
   33   2HA   GLY   4          1HA       GLY   4   1.908   4.525  -5.733
   34    H    TYR   5           H        TYR   5   2.601   2.395  -5.212
   35    HA   TYR   5           HA       TYR   5   0.387   0.506  -4.475
   36   1HB   TYR   5          2HB       TYR   5   3.230  -0.121  -5.326
   37   2HB   TYR   5          1HB       TYR   5   1.921  -1.278  -5.097
   38    HD1  TYR   5           1HD      TYR   5   0.539  -1.860  -6.902
   39    HD2  TYR   5           2HD      TYR   5   2.826   1.772  -7.075
   40    HE1  TYR   5           1HE      TYR   5  -0.169  -1.525  -9.255
   41    HE2  TYR   5           2HE      TYR   5   2.115   2.107  -9.427
   42    HH   TYR   5           HH       TYR   5  -0.345   0.126 -10.901
   43    HA   PRO   6           HA       PRO   6   2.316   1.374  -0.491
   44   1HB   PRO   6          2HB       PRO   6   0.268   0.330   0.991
   45   2HB   PRO   6          1HB       PRO   6   0.218   1.960   0.291
   46   1HG   PRO   6          2HG       PRO   6  -1.066  -0.544  -0.655
   47   2HG   PRO   6          1HG       PRO   6  -1.668   1.118  -0.689
   48   1HD   PRO   6          2HD       PRO   6  -0.630  -0.177  -2.865
   49   2HD   PRO   6          1HD       PRO   6  -0.639   1.588  -2.667
   50    H    VAL   7           H        VAL   7   3.785  -0.008   0.431
   51    HA   VAL   7           HA       VAL   7   3.650  -2.897  -0.122
   52    HB   VAL   7           HB       VAL   7   5.840  -2.803   1.187
   53   1HG1  VAL   7          1HG1      VAL   7   5.773  -2.616  -1.264
   54   2HG1  VAL   7          2HG1      VAL   7   7.015  -1.555  -0.600
   55   3HG1  VAL   7          3HG1      VAL   7   5.474  -0.884  -1.135
   56   1HG2  VAL   7          1HG2      VAL   7   4.738  -0.348   2.026
   57   2HG2  VAL   7          2HG2      VAL   7   6.080   0.078   0.964
   58   3HG2  VAL   7          3HG2      VAL   7   6.358  -0.953   2.367
   59    H    ASP   8           H        ASP   8   4.460  -4.218   2.027
   60    HA   ASP   8           HA       ASP   8   2.195  -4.324   3.782
   61   1HB   ASP   8          2HB       ASP   8   3.865  -6.135   3.146
   62   2HB   ASP   8          1HB       ASP   8   5.005  -5.366   4.253
   63    H    TYR   9           H        TYR   9   4.769  -4.490   5.895
   64    HA   TYR   9           HA       TYR   9   4.331  -1.666   6.806
   65   1HB   TYR   9          2HB       TYR   9   3.463  -3.866   8.052
   66   2HB   TYR   9          1HB       TYR   9   5.118  -3.880   8.659
   67    HD1  TYR   9           1HD      TYR   9   6.022  -1.556   9.541
   68    HD2  TYR   9           2HD      TYR   9   1.864  -2.576   9.165
   69    HE1  TYR   9           1HE      TYR   9   5.438   0.217  11.175
   70    HE2  TYR   9           2HE      TYR   9   1.282  -0.804  10.799
   71    HH   TYR   9           HH       TYR   9   2.244   0.503  12.511
   72    H    TRP  10           H        TRP  10   6.640  -4.406   7.000
   73    HA   TRP  10           HA       TRP  10   8.868  -2.424   7.254
   74   1HB   TRP  10          2HB       TRP  10   8.964  -5.421   7.671
   75   2HB   TRP  10          1HB       TRP  10  10.054  -4.199   8.327
   76    HD1  TRP  10           HD       TRP  10   9.247  -2.807  10.416
   77    HE1  TRP  10           1HE      TRP  10   7.332  -3.153  12.106
   78    HE3  TRP  10           3HE      TRP  10   6.511  -6.332   7.935
   79    HZ2  TRP  10           2HZ      TRP  10   4.951  -4.720  12.370
   80    HZ3  TRP  10           3HZ      TRP  10   4.426  -7.233   8.926
   81    HH2  TRP  10           HH       TRP  10   3.643  -6.432  11.139
   82    H    ASN  11           H        ASN  11   7.363  -3.450   4.746
   83    HA   ASN  11           HA       ASN  11   7.947  -3.962   2.517
   84   1HB   ASN  11          2HB       ASN  11  10.714  -3.363   3.615
   85   2HB   ASN  11          1HB       ASN  11  10.241  -3.321   1.917
   86   1HD2  ASN  11          1HD2      ASN  11  11.280  -0.987   3.199
   87   2HD2  ASN  11          2HD2      ASN  11  10.037   0.161   3.316
   88    H    CYS  12           H        CYS  12   8.437  -5.935   5.000
   89    HA   CYS  12           HA       CYS  12  10.429  -7.817   4.126
   90   1HB   CYS  12          2HB       CYS  12   8.087  -7.758   6.003
   91   2HB   CYS  12          1HB       CYS  12   8.865  -9.303   5.662
   92    H    LYS  13           H        LYS  13   6.881  -8.169   4.111
   93    HA   LYS  13           HA       LYS  13   6.932 -10.336   2.179
   94   1HB   LYS  13          2HB       LYS  13   4.773  -8.528   3.310
   95   2HB   LYS  13          1HB       LYS  13   4.437  -9.924   2.285
   96   1HG   LYS  13          2HG       LYS  13   6.092 -10.160   4.802
   97   2HG   LYS  13          1HG       LYS  13   4.333 -10.309   4.825
   98   1HD   LYS  13          2HD       LYS  13   4.793 -11.997   2.826
   99   2HD   LYS  13          1HD       LYS  13   6.372 -12.124   3.601
  100   1HE   LYS  13          2HE       LYS  13   5.475 -13.530   5.131
  101   2HE   LYS  13          1HE       LYS  13   4.387 -12.231   5.661
  102   1HZ   LYS  13          1HZ       LYS  13   3.948 -14.252   3.550
  103   2HZ   LYS  13          2HZ       LYS  13   3.088 -12.787   3.548
  104   3HZ   LYS  13          3HZ       LYS  13   2.945 -13.857   4.859
  105    H    ARG  14           H        ARG  14   5.257  -9.934   0.203
  106    HA   ARG  14           HA       ARG  14   6.552  -8.216  -1.666
  107   1HB   ARG  14          2HB       ARG  14   4.217  -9.969  -1.470
  108   2HB   ARG  14          1HB       ARG  14   3.941  -8.610  -2.560
  109   1HG   ARG  14          2HG       ARG  14   6.595  -9.733  -2.937
  110   2HG   ARG  14          1HG       ARG  14   5.345 -10.959  -3.158
  111   1HD   ARG  14          2HD       ARG  14   4.143  -9.323  -4.685
  112   2HD   ARG  14          1HD       ARG  14   5.595  -8.306  -4.610
  113    HE   ARG  14           HE       ARG  14   6.454 -10.941  -5.188
  114   1HH1  ARG  14          1HH2      ARG  14   6.988  -8.418  -6.825
  115   2HH1  ARG  14          2HH2      ARG  14   6.278  -8.853  -8.344
  116   1HH2  ARG  14          1HH1      ARG  14   4.483 -11.520  -7.045
  117   2HH2  ARG  14          2HH1      ARG  14   4.860 -10.608  -8.468
  118    H    ILE  15           H        ILE  15   4.861  -6.578  -2.919
  119    HA   ILE  15           HA       ILE  15   4.379  -4.426  -0.960
  120    HB   ILE  15           HB       ILE  15   3.887  -4.489  -3.950
  121   1HG1  ILE  15          2HG1      ILE  15   6.454  -3.890  -2.443
  122   2HG1  ILE  15          1HG1      ILE  15   6.170  -5.290  -3.477
  123   1HG2  ILE  15          1HG2      ILE  15   3.549  -2.516  -1.944
  124   2HG2  ILE  15          2HG2      ILE  15   3.435  -2.301  -3.690
  125   3HG2  ILE  15          3HG2      ILE  15   4.976  -2.049  -2.870
  126   1HD1  ILE  15          1HD1      ILE  15   5.464  -2.951  -4.956
  127   2HD1  ILE  15          2HD1      ILE  15   6.774  -4.087  -5.278
  128   3HD1  ILE  15          3HD1      ILE  15   7.056  -2.685  -4.247
  129    H    CYS  16           H        CYS  16   2.612  -6.943  -1.186
  130    HA   CYS  16           HA       CYS  16   0.042  -5.522  -0.988
  131   1HB   CYS  16          2HB       CYS  16   0.209  -5.796  -3.370
  132   2HB   CYS  16          1HB       CYS  16   0.754  -7.463  -3.201
  133    H    TRP  17           H        TRP  17  -1.714  -7.078  -0.338
  134    HA   TRP  17           HA       TRP  17  -0.584  -9.443   1.124
  135   1HB   TRP  17          2HB       TRP  17  -2.139  -7.164   1.902
  136   2HB   TRP  17          1HB       TRP  17  -3.134  -8.604   2.110
  137    HD1  TRP  17           HD       TRP  17  -0.845 -10.651   2.873
  138    HE1  TRP  17           1HE      TRP  17   0.291 -10.484   5.181
  139    HE3  TRP  17           3HE      TRP  17  -1.929  -5.800   4.040
  140    HZ2  TRP  17           2HZ      TRP  17   0.689  -8.548   7.248
  141    HZ3  TRP  17           3HZ      TRP  17  -1.160  -4.820   6.182
  142    HH2  TRP  17           HH       TRP  17   0.145  -6.187   7.786
  143    H    TYR  18           H        TYR  18  -3.167 -10.512   1.758
  144    HA   TYR  18           HA       TYR  18  -4.122 -11.349  -0.963
  145   1HB   TYR  18          2HB       TYR  18  -3.120 -12.780   1.354
  146   2HB   TYR  18          1HB       TYR  18  -4.752 -13.317   0.955
  147    HD1  TYR  18           1HD      TYR  18  -4.966 -15.019  -0.617
  148    HD2  TYR  18           2HD      TYR  18  -1.563 -12.404  -0.814
  149    HE1  TYR  18           1HE      TYR  18  -4.069 -16.330  -2.521
  150    HE2  TYR  18           2HE      TYR  18  -0.667 -13.716  -2.717
  151    HH   TYR  18           HH       TYR  18  -1.443 -15.221  -4.439
  152    H    ASN  19           H        ASN  19  -4.959  -9.680   1.824
  153    HA   ASN  19           HA       ASN  19  -7.832 -10.477   1.722
  154   1HB   ASN  19          2HB       ASN  19  -5.917  -9.497   3.692
  155   2HB   ASN  19          1HB       ASN  19  -7.406  -8.551   3.711
  156   1HD2  ASN  19          1HD2      ASN  19  -9.491  -9.883   3.852
  157   2HD2  ASN  19          2HD2      ASN  19  -9.447 -11.336   4.728
  158    H    ASN  20           H        ASN  20  -9.332  -9.108   0.806
  159    HA   ASN  20           HA       ASN  20  -8.591  -6.894  -0.819
  160   1HB   ASN  20          2HB       ASN  20 -10.911  -8.384  -0.044
  161   2HB   ASN  20          1HB       ASN  20 -11.302  -6.667   0.052
  162   1HD2  ASN  20          1HD2      ASN  20 -12.585  -6.614  -1.897
  163   2HD2  ASN  20          2HD2      ASN  20 -11.905  -6.847  -3.435
  164    H    LYS  21           H        LYS  21 -10.037  -6.939   2.462
  165    HA   LYS  21           HA       LYS  21  -9.993  -4.032   2.701
  166   1HB   LYS  21          2HB       LYS  21 -10.614  -6.421   4.404
  167   2HB   LYS  21          1HB       LYS  21 -10.393  -4.859   5.193
  168   1HG   LYS  21          2HG       LYS  21 -12.482  -4.280   4.603
  169   2HG   LYS  21          1HG       LYS  21 -12.029  -4.425   2.904
  170   1HD   LYS  21          2HD       LYS  21 -12.786  -6.634   2.753
  171   2HD   LYS  21          1HD       LYS  21 -12.685  -6.891   4.495
  172   1HE   LYS  21          2HE       LYS  21 -14.519  -4.714   3.855
  173   2HE   LYS  21          1HE       LYS  21 -15.006  -6.237   3.084
  174   1HZ   LYS  21          1HZ       LYS  21 -15.841  -6.146   5.345
  175   2HZ   LYS  21          2HZ       LYS  21 -14.272  -5.881   5.944
  176   3HZ   LYS  21          3HZ       LYS  21 -14.667  -7.362   5.211
  177    H    TYR  22           H        TYR  22  -7.641  -6.503   3.077
  178    HA   TYR  22           HA       TYR  22  -6.063  -5.401   5.212
  179   1HB   TYR  22          2HB       TYR  22  -5.897  -7.441   3.103
  180   2HB   TYR  22          1HB       TYR  22  -4.333  -6.747   3.530
  181    HD1  TYR  22           1HD      TYR  22  -7.227  -7.014   5.828
  182    HD2  TYR  22           2HD      TYR  22  -3.412  -8.637   4.708
  183    HE1  TYR  22           1HE      TYR  22  -7.190  -8.364   7.909
  184    HE2  TYR  22           2HE      TYR  22  -3.374  -9.986   6.788
  185    HH   TYR  22           HH       TYR  22  -6.159 -10.281   8.838
  186    H    CYS  23           H        CYS  23  -6.646  -4.269   2.040
  187    HA   CYS  23           HA       CYS  23  -4.160  -2.590   2.145
  188   1HB   CYS  23          2HB       CYS  23  -5.330  -4.294   0.137
  189   2HB   CYS  23          1HB       CYS  23  -5.303  -2.636  -0.462
  190    H    ASN  24           H        ASN  24  -7.655  -2.650   1.603
  191    HA   ASN  24           HA       ASN  24  -7.799   0.229   0.994
  192   1HB   ASN  24          2HB       ASN  24  -9.318  -1.921   0.382
  193   2HB   ASN  24          1HB       ASN  24 -10.172  -1.383   1.830
  194   1HD2  ASN  24          1HD2      ASN  24  -9.973  -0.895  -1.515
  195   2HD2  ASN  24          2HD2      ASN  24 -10.730   0.622  -1.593
  196    H    ASP  25           H        ASP  25  -8.811  -1.896   3.715
  197    HA   ASP  25           HA       ASP  25  -9.770   0.118   5.458
  198   1HB   ASP  25          2HB       ASP  25  -9.902  -2.374   5.733
  199   2HB   ASP  25          1HB       ASP  25  -8.185  -2.385   6.138
  200    H    LEU  26           H        LEU  26  -6.514  -0.776   4.547
  201    HA   LEU  26           HA       LEU  26  -5.266   0.869   6.664
  202   1HB   LEU  26          2HB       LEU  26  -3.837  -0.879   6.342
  203   2HB   LEU  26          1HB       LEU  26  -4.599  -1.303   4.813
  204    HG   LEU  26           HG       LEU  26  -3.308   0.473   3.681
  205   1HD1  LEU  26          1HD1      LEU  26  -3.088   1.643   6.098
  206   2HD1  LEU  26          2HD1      LEU  26  -1.957   1.966   4.785
  207   3HD1  LEU  26          3HD1      LEU  26  -1.534   0.810   6.049
  208   1HD2  LEU  26          1HD2      LEU  26  -0.993  -0.728   4.833
  209   2HD2  LEU  26          2HD2      LEU  26  -1.808  -1.174   3.334
  210   3HD2  LEU  26          3HD2      LEU  26  -2.275  -1.938   4.853
  211    H    CYS  27           H        CYS  27  -5.474   0.786   3.099
  212    HA   CYS  27           HA       CYS  27  -4.006   3.157   2.563
  213   1HB   CYS  27          2HB       CYS  27  -6.123   1.508   1.221
  214   2HB   CYS  27          1HB       CYS  27  -5.642   3.032   0.481
  215    H    LYS  28           H        LYS  28  -7.413   2.667   3.424
  216    HA   LYS  28           HA       LYS  28  -8.360   5.304   2.858
  217   1HB   LYS  28          2HB       LYS  28  -9.144   3.217   4.921
  218   2HB   LYS  28          1HB       LYS  28 -10.113   4.644   4.554
  219   1HG   LYS  28          2HG       LYS  28  -9.241   2.773   2.358
  220   2HG   LYS  28          1HG       LYS  28 -10.681   2.429   3.317
  221   1HD   LYS  28          2HD       LYS  28 -10.670   5.203   2.496
  222   2HD   LYS  28          1HD       LYS  28 -10.498   4.149   1.092
  223   1HE   LYS  28          2HE       LYS  28 -12.443   2.807   2.437
  224   2HE   LYS  28          1HE       LYS  28 -12.810   4.472   2.928
  225   1HZ   LYS  28          1HZ       LYS  28 -13.719   4.718   0.921
  226   2HZ   LYS  28          2HZ       LYS  28 -13.086   3.246   0.357
  227   3HZ   LYS  28          3HZ       LYS  28 -12.152   4.663   0.278
  228    H    GLY  29           H        GLY  29  -6.612   3.935   5.601
  229   1HA   GLY  29          2HA       GLY  29  -6.944   6.144   7.404
  230   2HA   GLY  29          1HA       GLY  29  -5.603   4.989   7.450
  231    H    LEU  30           H        LEU  30  -4.881   5.486   4.666
  232    HA   LEU  30           HA       LEU  30  -3.257   7.927   5.071
  233   1HB   LEU  30          2HB       LEU  30  -3.376   5.751   2.951
  234   2HB   LEU  30          1HB       LEU  30  -2.193   7.061   2.951
  235    HG   LEU  30           HG       LEU  30  -2.501   5.432   5.442
  236   1HD1  LEU  30          1HD1      LEU  30  -0.716   4.536   3.176
  237   2HD1  LEU  30          2HD1      LEU  30  -2.345   3.893   3.379
  238   3HD1  LEU  30          3HD1      LEU  30  -1.141   3.659   4.646
  239   1HD2  LEU  30          1HD2      LEU  30  -0.206   6.790   3.992
  240   2HD2  LEU  30          2HD2      LEU  30  -0.027   5.881   5.493
  241   3HD2  LEU  30          3HD2      LEU  30  -1.003   7.350   5.463
  242    H    LYS  31           H        LYS  31  -6.286   7.781   4.417
  243    HA   LYS  31           HA       LYS  31  -7.771   9.173   3.226
  244   1HB   LYS  31          2HB       LYS  31  -5.834  10.773   3.725
  245   2HB   LYS  31          1HB       LYS  31  -5.274  10.441   2.086
  246   1HG   LYS  31          2HG       LYS  31  -6.601  12.295   1.689
  247   2HG   LYS  31          1HG       LYS  31  -7.787  11.009   1.465
  248   1HD   LYS  31          2HD       LYS  31  -7.974  11.372   4.150
  249   2HD   LYS  31          1HD       LYS  31  -7.557  13.008   3.641
  250   1HE   LYS  31          2HE       LYS  31  -9.603  11.695   1.953
  251   2HE   LYS  31          1HE       LYS  31 -10.113  12.033   3.620
  252   1HZ   LYS  31          1HZ       LYS  31 -10.473  13.988   2.287
  253   2HZ   LYS  31          2HZ       LYS  31  -8.872  13.955   1.722
  254   3HZ   LYS  31          3HZ       LYS  31  -9.192  14.290   3.356
  255    H    ALA  32           H        ALA  32  -6.169   6.730   1.981
  256    HA   ALA  32           HA       ALA  32  -6.423   7.371  -0.896
  257   1HB   ALA  32          1HB       ALA  32  -5.004   5.530   0.821
  258   2HB   ALA  32          2HB       ALA  32  -4.702   5.910  -0.874
  259   3HB   ALA  32          3HB       ALA  32  -5.846   4.639  -0.444
  260    H    ASP  33           H        ASP  33  -8.817   7.651  -0.827
  261    HA   ASP  33           HA       ASP  33 -10.775   5.923   0.067
  262   1HB   ASP  33          2HB       ASP  33 -10.999   8.075  -1.235
  263   2HB   ASP  33          1HB       ASP  33 -10.675   7.151  -2.702
  264    H    SER  34           H        SER  34  -9.715   5.683  -3.329
  265    HA   SER  34           HA       SER  34 -10.544   2.893  -3.491
  266   1HB   SER  34          2HB       SER  34  -8.985   3.480  -5.708
  267   2HB   SER  34          1HB       SER  34 -10.719   3.763  -5.582
  268    HG   SER  34           HG       SER  34  -9.948   5.731  -6.023
  269    H    GLY  35           H        GLY  35  -9.170   1.911  -1.812
  270   1HA   GLY  35          2HA       GLY  35  -6.338   1.608  -2.723
  271   2HA   GLY  35          1HA       GLY  35  -6.755   1.738  -1.015
  272    H    TYR  36           H        TYR  36  -6.928  -0.349  -3.849
  273    HA   TYR  36           HA       TYR  36  -7.430  -2.632  -1.975
  274   1HB   TYR  36          2HB       TYR  36  -8.993  -3.559  -3.525
  275   2HB   TYR  36          1HB       TYR  36  -9.417  -1.856  -3.386
  276    HD1  TYR  36           1HD      TYR  36  -8.081  -4.471  -5.565
  277    HD2  TYR  36           2HD      TYR  36  -8.840  -0.261  -5.190
  278    HE1  TYR  36           1HE      TYR  36  -7.810  -4.204  -8.016
  279    HE2  TYR  36           2HE      TYR  36  -8.564   0.007  -7.640
  280    HH   TYR  36           HH       TYR  36  -8.629  -1.245  -9.640
  281    H    CYS  37           H        CYS  37  -6.414  -4.631  -2.648
  282    HA   CYS  37           HA       CYS  37  -3.902  -4.192  -4.083
  283   1HB   CYS  37          2HB       CYS  37  -5.042  -5.974  -2.142
  284   2HB   CYS  37          1HB       CYS  37  -4.339  -6.925  -3.450
  285    H    TRP  38           H        TRP  38  -3.212  -5.435  -5.924
  286    HA   TRP  38           HA       TRP  38  -5.321  -5.910  -7.902
  287   1HB   TRP  38          2HB       TRP  38  -2.700  -5.107  -7.929
  288   2HB   TRP  38          1HB       TRP  38  -2.539  -6.800  -8.395
  289    HD1  TRP  38           HD       TRP  38  -2.937  -7.318 -10.858
  290    HE1  TRP  38           1HE      TRP  38  -4.024  -6.090 -12.846
  291    HE3  TRP  38           3HE      TRP  38  -4.796  -3.233  -8.444
  292    HZ2  TRP  38           2HZ      TRP  38  -5.487  -3.681 -13.346
  293    HZ3  TRP  38           3HZ      TRP  38  -6.023  -1.479  -9.697
  294    HH2  TRP  38           HH       TRP  38  -6.376  -1.700 -12.142
  295    H    GLY  39           H        GLY  39  -6.048  -7.979  -8.550
  296   1HA   GLY  39          2HA       GLY  39  -5.451 -10.184  -6.728
  297   2HA   GLY  39          1HA       GLY  39  -6.597 -10.232  -8.064
  298    H    TRP  40           H        TRP  40  -4.298  -9.170  -9.843
  299    HA   TRP  40           HA       TRP  40  -3.375 -11.823 -10.665
  300   1HB   TRP  40          2HB       TRP  40  -3.950 -10.081 -12.283
  301   2HB   TRP  40          1HB       TRP  40  -2.753  -8.998 -11.580
  302    HD1  TRP  40           HD       TRP  40  -0.685  -8.890 -13.015
  303    HE1  TRP  40           1HE      TRP  40   0.660 -10.551 -14.440
  304    HE3  TRP  40           3HE      TRP  40  -3.504 -13.099 -12.374
  305    HZ2  TRP  40           2HZ      TRP  40   0.571 -13.307 -15.210
  306    HZ3  TRP  40           3HZ      TRP  40  -2.852 -15.227 -13.464
  307    HH2  TRP  40           HH       TRP  40  -0.819 -15.337 -14.882
  308    H    THR  41           H        THR  41  -1.362  -8.929 -10.314
  309    HA   THR  41           HA       THR  41   0.266  -9.875  -8.144
  310    HB   THR  41           HB       THR  41   0.688 -11.592  -9.971
  311    HG1  THR  41           1HG      THR  41   2.413 -11.680  -8.793
  312   1HG2  THR  41          1HG2      THR  41   0.823  -9.354 -11.588
  313   2HG2  THR  41          2HG2      THR  41   1.367 -10.971 -12.036
  314   3HG2  THR  41          3HG2      THR  41   2.518  -9.799 -11.393
  315    H    LEU  42           H        LEU  42  -0.836  -7.373  -8.919
  316    HA   LEU  42           HA       LEU  42   1.565  -5.821  -9.829
  317   1HB   LEU  42          2HB       LEU  42  -1.383  -5.620 -10.111
  318   2HB   LEU  42          1HB       LEU  42  -0.523  -4.091  -9.928
  319    HG   LEU  42           HG       LEU  42   1.091  -5.303 -11.728
  320   1HD1  LEU  42          1HD1      LEU  42  -0.108  -6.640 -13.272
  321   2HD1  LEU  42          2HD1      LEU  42  -1.668  -6.171 -12.596
  322   3HD1  LEU  42          3HD1      LEU  42  -0.606  -7.254 -11.696
  323   1HD2  LEU  42          1HD2      LEU  42   0.277  -3.726 -13.224
  324   2HD2  LEU  42          2HD2      LEU  42  -0.381  -3.089 -11.717
  325   3HD2  LEU  42          3HD2      LEU  42  -1.406  -4.036 -12.796
  326    H    SER  43           H        SER  43   1.294  -6.778  -7.065
  327    HA   SER  43           HA       SER  43   1.447  -5.930  -4.863
  328   1HB   SER  43          2HB       SER  43   2.163  -3.530  -6.572
  329   2HB   SER  43          1HB       SER  43   2.443  -3.618  -4.837
  330    HG   SER  43           HG       SER  43   3.557  -5.699  -5.456
  331    H    CYS  44           H        CYS  44   0.699  -3.712  -3.588
  332    HA   CYS  44           HA       CYS  44  -2.201  -3.661  -3.881
  333   1HB   CYS  44          2HB       CYS  44  -0.818  -3.592  -1.742
  334   2HB   CYS  44          1HB       CYS  44  -0.427  -1.922  -2.153
  335    H    TYR  45           H        TYR  45  -3.425  -1.595  -4.154
  336    HA   TYR  45           HA       TYR  45  -1.905   0.553  -5.554
  337   1HB   TYR  45          2HB       TYR  45  -2.894  -1.322  -7.063
  338   2HB   TYR  45          1HB       TYR  45  -4.451  -0.580  -6.698
  339    HD1  TYR  45           1HD      TYR  45  -3.529  -0.655  -9.481
  340    HD2  TYR  45           2HD      TYR  45  -2.671   2.202  -6.388
  341    HE1  TYR  45           1HE      TYR  45  -3.109   1.084 -11.200
  342    HE2  TYR  45           2HE      TYR  45  -2.250   3.937  -8.107
  343    HH   TYR  45           HH       TYR  45  -3.164   4.189 -10.726
  344    H    CYS  46           H        CYS  46  -2.435   2.302  -4.281
  345    HA   CYS  46           HA       CYS  46  -5.346   2.790  -3.759
  346   1HB   CYS  46          2HB       CYS  46  -3.002   3.377  -1.914
  347   2HB   CYS  46          1HB       CYS  46  -4.704   3.650  -1.552
  348    H    GLN  47           H        GLN  47  -5.989   4.847  -4.379
  349    HA   GLN  47           HA       GLN  47  -3.816   6.820  -5.020
  350   1HB   GLN  47          2HB       GLN  47  -5.497   7.474  -6.884
  351   2HB   GLN  47          1HB       GLN  47  -4.605   5.967  -7.090
  352   1HG   GLN  47          2HG       GLN  47  -6.513   4.705  -6.169
  353   2HG   GLN  47          1HG       GLN  47  -7.407   6.210  -5.954
  354   1HE2  GLN  47          1HE2      GLN  47  -8.353   4.079  -7.657
  355   2HE2  GLN  47          2HE2      GLN  47  -8.337   4.643  -9.257
  356    H    GLY  48           H        GLY  48  -4.263   8.973  -4.439
  357   1HA   GLY  48          2HA       GLY  48  -5.819  10.773  -3.864
  358   2HA   GLY  48          1HA       GLY  48  -6.951   9.551  -3.282
  359    H    LEU  49           H        LEU  49  -3.556   9.333  -2.516
  360    HA   LEU  49           HA       LEU  49  -4.247   9.854   0.350
  361   1HB   LEU  49          2HB       LEU  49  -1.878   8.643   0.524
  362   2HB   LEU  49          1HB       LEU  49  -3.347   7.711   0.255
  363    HG   LEU  49           HG       LEU  49  -1.827   8.752  -2.117
  364   1HD1  LEU  49          1HD1      LEU  49  -0.904   6.174  -1.811
  365   2HD1  LEU  49          2HD1      LEU  49  -0.869   6.780  -0.154
  366   3HD1  LEU  49          3HD1      LEU  49   0.019   7.627  -1.422
  367   1HD2  LEU  49          1HD2      LEU  49  -2.994   7.106  -3.261
  368   2HD2  LEU  49          2HD2      LEU  49  -4.143   7.440  -1.966
  369   3HD2  LEU  49          3HD2      LEU  49  -3.074   6.042  -1.857
  370    HA   PRO  50           HA       PRO  50  -1.588  13.340   0.501
  371   1HB   PRO  50          2HB       PRO  50  -0.242  13.031   2.861
  372   2HB   PRO  50          1HB       PRO  50  -1.965  13.451   2.783
  373   1HG   PRO  50          2HG       PRO  50  -0.679  10.831   3.339
  374   2HG   PRO  50          1HG       PRO  50  -2.145  11.540   4.031
  375   1HD   PRO  50          2HD       PRO  50  -2.143   9.610   2.084
  376   2HD   PRO  50          1HD       PRO  50  -3.467  10.764   2.344
  377    H    ASP  51           H        ASP  51   0.710  14.045   0.404
  378    HA   ASP  51           HA       ASP  51   2.393  12.324  -1.118
  379   1HB   ASP  51          2HB       ASP  51   2.382  14.864  -0.895
  380   2HB   ASP  51          1HB       ASP  51   3.234  14.650   0.634
  381    H    ASN  52           H        ASN  52   1.885  12.589   2.307
  382    HA   ASN  52           HA       ASN  52   4.429  11.356   3.088
  383   1HB   ASN  52          2HB       ASN  52   3.456  12.865   4.632
  384   2HB   ASN  52          1HB       ASN  52   1.848  12.174   4.423
  385   1HD2  ASN  52          1HD2      ASN  52   4.964  11.726   6.038
  386   2HD2  ASN  52          2HD2      ASN  52   4.453  10.476   7.066
  387    H    ALA  53           H        ALA  53   1.860  10.114   1.481
  388    HA   ALA  53           HA       ALA  53   0.974   7.820   2.846
  389   1HB   ALA  53          1HB       ALA  53   1.092   6.976   0.288
  390   2HB   ALA  53          2HB       ALA  53   1.375   8.698   0.031
  391   3HB   ALA  53          3HB       ALA  53  -0.096   8.156   0.840
  392    H    ARG  54           H        ARG  54   1.757   5.615   2.835
  393    HA   ARG  54           HA       ARG  54   4.726   5.415   2.531
  394   1HB   ARG  54          2HB       ARG  54   3.901   4.930   4.739
  395   2HB   ARG  54          1HB       ARG  54   2.629   3.890   4.098
  396   1HG   ARG  54          2HG       ARG  54   4.194   2.222   3.422
  397   2HG   ARG  54          1HG       ARG  54   5.562   3.311   3.653
  398   1HD   ARG  54          2HD       ARG  54   5.185   1.579   5.514
  399   2HD   ARG  54          1HD       ARG  54   5.294   3.267   6.052
  400    HE   ARG  54           HE       ARG  54   2.888   3.302   6.321
  401   1HH1  ARG  54          1HH2      ARG  54   3.660   0.621   4.406
  402   2HH1  ARG  54          2HH2      ARG  54   2.469  -0.426   5.103
  403   1HH2  ARG  54          1HH1      ARG  54   1.562   1.821   7.584
  404   2HH2  ARG  54          2HH1      ARG  54   1.281   0.253   6.902
  405    H    ILE  55           H        ILE  55   4.750   4.970   0.239
  406    HA   ILE  55           HA       ILE  55   4.007   2.171  -0.424
  407    HB   ILE  55           HB       ILE  55   2.681   2.843  -2.313
  408   1HG1  ILE  55          2HG1      ILE  55   4.190   4.759  -2.932
  409   2HG1  ILE  55          1HG1      ILE  55   2.474   5.150  -3.040
  410   1HG2  ILE  55          1HG2      ILE  55   1.914   4.799  -0.140
  411   2HG2  ILE  55          2HG2      ILE  55   1.682   3.061   0.035
  412   3HG2  ILE  55          3HG2      ILE  55   0.850   3.935  -1.249
  413   1HD1  ILE  55          1HD1      ILE  55   3.013   5.807  -0.434
  414   2HD1  ILE  55          2HD1      ILE  55   3.032   6.954  -1.773
  415   3HD1  ILE  55          3HD1      ILE  55   4.536   6.218  -1.222
  416    H    LYS  56           H        LYS  56   5.128   1.424  -2.371
  417    HA   LYS  56           HA       LYS  56   7.180   1.214  -3.549
  418   1HB   LYS  56          2HB       LYS  56   5.938   3.889  -4.136
  419   2HB   LYS  56          1HB       LYS  56   7.464   3.455  -4.906
  420   1HG   LYS  56          2HG       LYS  56   5.338   1.380  -4.957
  421   2HG   LYS  56          1HG       LYS  56   5.059   2.806  -5.958
  422   1HD   LYS  56          2HD       LYS  56   6.641   2.187  -7.446
  423   2HD   LYS  56          1HD       LYS  56   7.805   1.835  -6.168
  424   1HE   LYS  56          2HE       LYS  56   5.656  -0.136  -6.204
  425   2HE   LYS  56          1HE       LYS  56   6.511  -0.066  -7.758
  426   1HZ   LYS  56          1HZ       LYS  56   7.532  -1.479  -5.890
  427   2HZ   LYS  56          2HZ       LYS  56   7.995   0.007  -5.206
  428   3HZ   LYS  56          3HZ       LYS  56   8.554  -0.432  -6.749
  429    H    ARG  57           H        ARG  57   7.879   1.594  -0.953
  430    HA   ARG  57           HA       ARG  57   9.724   3.924  -0.804
  431   1HB   ARG  57          2HB       ARG  57   8.231   2.165   1.013
  432   2HB   ARG  57          1HB       ARG  57   9.887   2.462   1.549
  433   1HG   ARG  57          2HG       ARG  57   9.472   4.643   2.008
  434   2HG   ARG  57          1HG       ARG  57   8.509   4.860   0.547
  435   1HD   ARG  57          2HD       ARG  57   6.631   4.775   1.808
  436   2HD   ARG  57          1HD       ARG  57   7.053   3.119   2.292
  437    HE   ARG  57           HE       ARG  57   7.475   5.503   3.900
  438   1HH1  ARG  57          1HH1      ARG  57   7.430   2.234   4.091
  439   2HH1  ARG  57          2HH1      ARG  57   8.805   2.059   5.130
  440   1HH2  ARG  57          1HH2      ARG  57   9.804   5.362   4.801
  441   2HH2  ARG  57          2HH2      ARG  57  10.150   3.831   5.532
  442    H    SER  58           H        SER  58   9.707   0.503  -1.339
  443    HA   SER  58           HA       SER  58  11.466  -1.005  -1.806
  444   1HB   SER  58          2HB       SER  58  12.516   0.235  -3.397
  445   2HB   SER  58          1HB       SER  58  12.344   1.719  -2.465
  446    HG   SER  58           HG       SER  58  14.482   0.118  -2.741
  447    H    GLY  59           H        GLY  59  13.954  -1.346  -1.013
  448   1HA   GLY  59          2HA       GLY  59  15.490  -0.970   0.892
  449   2HA   GLY  59          1HA       GLY  59  14.074  -0.609   1.882
  450    H    ARG  60           H        ARG  60  15.454  -2.433   3.092
  451    HA   ARG  60           HA       ARG  60  14.528  -5.126   2.171
  452   1HB   ARG  60          2HB       ARG  60  16.381  -5.955   3.471
  453   2HB   ARG  60          1HB       ARG  60  16.979  -4.568   2.559
  454   1HG   ARG  60          2HG       ARG  60  16.637  -3.121   4.527
  455   2HG   ARG  60          1HG       ARG  60  16.038  -4.504   5.442
  456   1HD   ARG  60          2HD       ARG  60  18.687  -4.870   4.137
  457   2HD   ARG  60          1HD       ARG  60  18.635  -3.752   5.515
  458    HE   ARG  60           HE       ARG  60  17.296  -6.388   5.818
  459   1HH1  ARG  60          1HH1      ARG  60  18.675  -3.929   7.522
  460   2HH1  ARG  60          2HH1      ARG  60  19.725  -4.911   8.488
  461   1HH2  ARG  60          1HH2      ARG  60  19.164  -7.794   6.646
  462   2HH2  ARG  60          2HH2      ARG  60  20.000  -7.099   7.994
  463    H    CYS  61           H        CYS  61  14.321  -6.594   4.343
  464    HA   CYS  61           HA       CYS  61  11.915  -5.992   5.625
  465   1HB   CYS  61          2HB       CYS  61  14.235  -7.754   5.987
  466   2HB   CYS  61          1HB       CYS  61  13.405  -7.403   7.503
  467    H    ARG  62           H        ARG  62  11.374  -4.369   7.023
  468    HA   ARG  62           HA       ARG  62  13.432  -2.673   8.243
  469   1HB   ARG  62          2HB       ARG  62  10.729  -2.513   7.431
  470   2HB   ARG  62          1HB       ARG  62  10.726  -2.249   9.176
  471   1HG   ARG  62          2HG       ARG  62  11.941  -0.305   9.025
  472   2HG   ARG  62          1HG       ARG  62  12.833  -0.848   7.604
  473   1HD   ARG  62          2HD       ARG  62  11.452   0.560   6.448
  474   2HD   ARG  62          1HD       ARG  62  10.227  -0.706   6.664
  475    HE   ARG  62           HE       ARG  62  10.110   1.822   7.935
  476   1HH1  ARG  62          1HH1      ARG  62   7.901  -0.204   8.032
  477   2HH1  ARG  62          2HH1      ARG  62   7.831  -0.586   9.719
  478   1HH2  ARG  62          1HH2      ARG  62  10.945   0.767  10.426
  479   2HH2  ARG  62          2HH2      ARG  62   9.554  -0.037  11.075
  480    H    ALA  63           H        ALA  63  13.721  -5.280   9.257
  481    HA   ALA  63           HA       ALA  63  13.489  -4.819  12.112
  482   1HB   ALA  63          1HB       ALA  63  11.141  -5.310  11.535
  483   2HB   ALA  63          2HB       ALA  63  11.817  -6.606  12.522
  484   3HB   ALA  63          3HB       ALA  63  11.638  -6.825  10.782
  Start of MODEL    4
    1   1H    LYS   1          1HT       LYS   1  -2.748  12.915  -1.846
    2   2H    LYS   1          2HT       LYS   1  -3.605  14.380  -1.902
    3   3H    LYS   1          3HT       LYS   1  -2.024  14.293  -2.515
    4    HA   LYS   1           HA       LYS   1  -4.380  12.859  -3.639
    5   1HB   LYS   1          2HB       LYS   1  -3.891  15.512  -3.698
    6   2HB   LYS   1          1HB       LYS   1  -2.868  15.008  -5.044
    7   1HG   LYS   1          2HG       LYS   1  -5.451  13.677  -5.131
    8   2HG   LYS   1          1HG       LYS   1  -5.633  15.433  -5.132
    9   1HD   LYS   1          2HD       LYS   1  -3.703  13.983  -6.958
   10   2HD   LYS   1          1HD       LYS   1  -5.358  14.370  -7.428
   11   1HE   LYS   1          2HE       LYS   1  -3.850  16.640  -6.268
   12   2HE   LYS   1          1HE       LYS   1  -3.252  16.062  -7.836
   13   1HZ   LYS   1          1HZ       LYS   1  -4.990  17.559  -8.328
   14   2HZ   LYS   1          2HZ       LYS   1  -6.009  16.901  -7.138
   15   3HZ   LYS   1          3HZ       LYS   1  -5.653  16.014  -8.541
   16    H    ILE   2           H        ILE   2  -2.365  11.187  -3.118
   17    HA   ILE   2           HA       ILE   2  -0.703  11.112  -5.616
   18    HB   ILE   2           HB       ILE   2   0.494  11.523  -3.457
   19   1HG1  ILE   2          2HG1      ILE   2   1.127   8.735  -4.429
   20   2HG1  ILE   2          1HG1      ILE   2   1.414  10.145  -5.450
   21   1HG2  ILE   2          1HG2      ILE   2  -1.324   9.771  -2.403
   22   2HG2  ILE   2          2HG2      ILE   2   0.191  10.215  -1.618
   23   3HG2  ILE   2          3HG2      ILE   2   0.092   8.733  -2.570
   24   1HD1  ILE   2          1HD1      ILE   2   2.754  11.144  -3.566
   25   2HD1  ILE   2          2HD1      ILE   2   3.459   9.675  -4.243
   26   3HD1  ILE   2          3HD1      ILE   2   2.590   9.612  -2.709
   27    H    ASP   3           H        ASP   3  -0.166   8.852  -6.313
   28    HA   ASP   3           HA       ASP   3  -2.100   6.771  -5.400
   29   1HB   ASP   3          2HB       ASP   3  -2.736   6.381  -7.756
   30   2HB   ASP   3          1HB       ASP   3  -3.088   8.046  -7.291
   31    H    GLY   4           H        GLY   4  -0.958   4.882  -5.117
   32   1HA   GLY   4          2HA       GLY   4   1.015   3.978  -7.038
   33   2HA   GLY   4          1HA       GLY   4   1.785   4.565  -5.564
   34    H    TYR   5           H        TYR   5   2.520   2.369  -5.155
   35    HA   TYR   5           HA       TYR   5   0.351   0.471  -4.329
   36   1HB   TYR   5          2HB       TYR   5   3.271   0.014  -5.018
   37   2HB   TYR   5          1HB       TYR   5   2.076  -1.242  -4.701
   38    HD1  TYR   5           1HD      TYR   5   3.245   1.289  -7.097
   39    HD2  TYR   5           2HD      TYR   5   0.292  -1.725  -6.303
   40    HE1  TYR   5           1HE      TYR   5   2.578   1.315  -9.484
   41    HE2  TYR   5           2HE      TYR   5  -0.376  -1.702  -8.691
   42    HH   TYR   5           HH       TYR   5   1.462  -0.376 -11.099
   43    HA   PRO   6           HA       PRO   6   2.094   1.539  -0.303
   44   1HB   PRO   6          2HB       PRO   6  -0.124   0.817   1.124
   45   2HB   PRO   6          1HB       PRO   6   0.026   2.384   0.306
   46   1HG   PRO   6          2HG       PRO   6  -1.510  -0.019  -0.484
   47   2HG   PRO   6          1HG       PRO   6  -1.861   1.692  -0.763
   48   1HD   PRO   6          2HD       PRO   6  -0.821  -0.072  -2.641
   49   2HD   PRO   6          1HD       PRO   6  -0.770   1.699  -2.747
   50    H    VAL   7           H        VAL   7   3.558  -0.059   0.309
   51    HA   VAL   7           HA       VAL   7   2.703  -2.902   0.331
   52    HB   VAL   7           HB       VAL   7   5.192  -3.201   0.790
   53   1HG1  VAL   7          1HG1      VAL   7   5.776  -2.803  -1.489
   54   2HG1  VAL   7          2HG1      VAL   7   4.623  -1.476  -1.630
   55   3HG1  VAL   7          3HG1      VAL   7   4.044  -3.137  -1.503
   56   1HG2  VAL   7          1HG2      VAL   7   5.021  -0.523   1.503
   57   2HG2  VAL   7          2HG2      VAL   7   5.775  -0.466  -0.090
   58   3HG2  VAL   7          3HG2      VAL   7   6.516  -1.411   1.202
   59    H    ASP   8           H        ASP   8   4.200  -4.000   2.302
   60    HA   ASP   8           HA       ASP   8   2.695  -3.619   4.679
   61   1HB   ASP   8          2HB       ASP   8   4.350  -5.484   3.742
   62   2HB   ASP   8          1HB       ASP   8   5.515  -4.622   4.748
   63    H    TYR   9           H        TYR   9   4.883  -3.512   6.613
   64    HA   TYR   9           HA       TYR   9   5.249  -0.558   6.674
   65   1HB   TYR   9          2HB       TYR   9   5.641  -2.729   8.761
   66   2HB   TYR   9          1HB       TYR   9   5.678  -0.991   9.065
   67    HD1  TYR   9           1HD      TYR   9   3.713  -3.425   9.965
   68    HD2  TYR   9           2HD      TYR   9   3.472  -0.098   7.260
   69    HE1  TYR   9           1HE      TYR   9   1.244  -3.409  10.203
   70    HE2  TYR   9           2HE      TYR   9   1.004  -0.081   7.498
   71    HH   TYR   9           HH       TYR   9  -0.650  -2.417   9.630
   72    H    TRP  10           H        TRP  10   7.028  -3.410   5.964
   73    HA   TRP  10           HA       TRP  10   9.587  -1.865   6.267
   74   1HB   TRP  10          2HB       TRP  10   9.552  -4.848   6.517
   75   2HB   TRP  10          1HB       TRP  10  10.584  -3.676   7.329
   76    HD1  TRP  10           HD       TRP  10   9.488  -2.332   9.424
   77    HE1  TRP  10           1HE      TRP  10   7.620  -3.036  11.059
   78    HE3  TRP  10           3HE      TRP  10   7.420  -6.164   6.780
   79    HZ2  TRP  10           2HZ      TRP  10   5.517  -4.977  11.215
   80    HZ3  TRP  10           3HZ      TRP  10   5.486  -7.428   7.686
   81    HH2  TRP  10           HH       TRP  10   4.533  -6.839   9.899
   82    H    ASN  11           H        ASN  11   7.468  -3.121   4.098
   83    HA   ASN  11           HA       ASN  11   7.662  -3.763   1.830
   84   1HB   ASN  11          2HB       ASN  11  10.469  -2.692   2.276
   85   2HB   ASN  11          1HB       ASN  11   9.629  -2.812   0.728
   86   1HD2  ASN  11          1HD2      ASN  11   9.237  -0.636   0.173
   87   2HD2  ASN  11          2HD2      ASN  11   8.455   0.480   1.185
   88    H    CYS  12           H        CYS  12   8.839  -5.438   4.242
   89    HA   CYS  12           HA       CYS  12  10.965  -7.044   3.139
   90   1HB   CYS  12          2HB       CYS  12  10.137  -6.630   5.575
   91   2HB   CYS  12          1HB       CYS  12   8.980  -7.917   5.230
   92    H    LYS  13           H        LYS  13   7.598  -8.003   3.863
   93    HA   LYS  13           HA       LYS  13   7.330  -9.310   1.243
   94   1HB   LYS  13          2HB       LYS  13   8.684 -10.950   2.321
   95   2HB   LYS  13          1HB       LYS  13   7.789 -10.800   3.834
   96   1HG   LYS  13          2HG       LYS  13   6.036 -11.484   1.612
   97   2HG   LYS  13          1HG       LYS  13   7.318 -12.678   1.824
   98   1HD   LYS  13          2HD       LYS  13   6.415 -11.989   4.420
   99   2HD   LYS  13          1HD       LYS  13   4.974 -12.259   3.437
  100   1HE   LYS  13          2HE       LYS  13   5.940 -14.441   2.678
  101   2HE   LYS  13          1HE       LYS  13   7.304 -14.184   3.782
  102   1HZ   LYS  13          1HZ       LYS  13   4.577 -14.906   4.381
  103   2HZ   LYS  13          2HZ       LYS  13   5.162 -13.625   5.332
  104   3HZ   LYS  13          3HZ       LYS  13   5.978 -15.115   5.311
  105    H    ARG  14           H        ARG  14   5.464  -7.804   1.344
  106    HA   ARG  14           HA       ARG  14   2.999  -9.053   1.968
  107   1HB   ARG  14          2HB       ARG  14   4.440  -7.864   4.202
  108   2HB   ARG  14          1HB       ARG  14   2.854  -7.119   3.998
  109   1HG   ARG  14          2HG       ARG  14   1.718  -9.093   4.411
  110   2HG   ARG  14          1HG       ARG  14   3.041 -10.099   3.822
  111   1HD   ARG  14          2HD       ARG  14   4.350  -9.199   5.894
  112   2HD   ARG  14          1HD       ARG  14   2.743  -8.775   6.514
  113    HE   ARG  14           HE       ARG  14   2.942 -11.496   5.430
  114   1HH1  ARG  14          1HH2      ARG  14   4.877 -11.526   7.644
  115   2HH1  ARG  14          2HH2      ARG  14   3.889 -11.852   9.029
  116   1HH2  ARG  14          1HH1      ARG  14   0.925 -11.002   7.442
  117   2HH2  ARG  14          2HH1      ARG  14   1.651 -11.556   8.914
  118    H    ILE  15           H        ILE  15   4.270  -7.279   0.006
  119    HA   ILE  15           HA       ILE  15   3.471  -4.584   0.073
  120    HB   ILE  15           HB       ILE  15   3.589  -4.798  -2.397
  121   1HG1  ILE  15          2HG1      ILE  15   3.808  -7.777  -1.874
  122   2HG1  ILE  15          1HG1      ILE  15   2.330  -6.993  -2.430
  123   1HG2  ILE  15          1HG2      ILE  15   5.830  -4.918  -2.192
  124   2HG2  ILE  15          2HG2      ILE  15   5.748  -6.637  -1.804
  125   3HG2  ILE  15          3HG2      ILE  15   5.592  -5.436  -0.522
  126   1HD1  ILE  15          1HD1      ILE  15   3.117  -6.738  -4.544
  127   2HD1  ILE  15          2HD1      ILE  15   4.288  -7.975  -4.087
  128   3HD1  ILE  15          3HD1      ILE  15   4.723  -6.268  -3.985
  129    H    CYS  16           H        CYS  16   1.548  -7.466  -0.578
  130    HA   CYS  16           HA       CYS  16  -0.896  -5.741  -0.636
  131   1HB   CYS  16          2HB       CYS  16  -0.394  -6.172  -2.933
  132   2HB   CYS  16          1HB       CYS  16   0.019  -7.853  -2.602
  133    H    TRP  17           H        TRP  17  -2.422  -6.529   0.750
  134    HA   TRP  17           HA       TRP  17  -2.003  -8.984   2.244
  135   1HB   TRP  17          2HB       TRP  17  -3.650  -6.612   2.257
  136   2HB   TRP  17          1HB       TRP  17  -4.665  -8.033   2.499
  137    HD1  TRP  17           HD       TRP  17  -2.308  -9.728   3.997
  138    HE1  TRP  17           1HE      TRP  17  -1.812  -9.153   6.462
  139    HE3  TRP  17           3HE      TRP  17  -4.301  -5.032   4.227
  140    HZ2  TRP  17           2HZ      TRP  17  -2.210  -6.986   8.289
  141    HZ3  TRP  17           3HZ      TRP  17  -4.230  -3.736   6.338
  142    HH2  TRP  17           HH       TRP  17  -3.187  -4.706   8.368
  143    H    TYR  18           H        TYR  18  -3.860 -10.643   2.365
  144    HA   TYR  18           HA       TYR  18  -4.491 -11.558  -0.372
  145   1HB   TYR  18          2HB       TYR  18  -4.249 -12.638   2.357
  146   2HB   TYR  18          1HB       TYR  18  -5.575 -13.346   1.433
  147    HD1  TYR  18           1HD      TYR  18  -5.113 -14.354  -0.830
  148    HD2  TYR  18           2HD      TYR  18  -1.974 -13.139   1.836
  149    HE1  TYR  18           1HE      TYR  18  -3.493 -15.725  -2.112
  150    HE2  TYR  18           2HE      TYR  18  -0.353 -14.509   0.553
  151    HH   TYR  18           HH       TYR  18  -0.052 -15.863  -1.172
  152    H    ASN  19           H        ASN  19  -5.922  -9.283  -0.050
  153    HA   ASN  19           HA       ASN  19  -8.695 -10.211  -0.121
  154   1HB   ASN  19          2HB       ASN  19  -7.753  -9.758   2.355
  155   2HB   ASN  19          1HB       ASN  19  -8.190  -8.101   1.932
  156   1HD2  ASN  19          1HD2      ASN  19  -9.450 -10.797   3.402
  157   2HD2  ASN  19          2HD2      ASN  19 -11.099 -10.555   3.077
  158    H    ASN  20           H        ASN  20 -10.122  -8.498  -0.920
  159    HA   ASN  20           HA       ASN  20  -8.676  -6.468  -2.502
  160   1HB   ASN  20          2HB       ASN  20 -10.913  -6.159  -3.506
  161   2HB   ASN  20          1HB       ASN  20 -10.497  -7.872  -3.432
  162   1HD2  ASN  20          1HD2      ASN  20 -12.900  -8.282  -3.453
  163   2HD2  ASN  20          2HD2      ASN  20 -13.776  -8.127  -2.008
  164    H    LYS  21           H        LYS  21  -9.857  -6.584   0.617
  165    HA   LYS  21           HA       LYS  21 -10.330  -3.621   0.634
  166   1HB   LYS  21          2HB       LYS  21 -11.901  -5.930   1.654
  167   2HB   LYS  21          1HB       LYS  21 -11.818  -4.522   2.713
  168   1HG   LYS  21          2HG       LYS  21 -12.259  -3.565   0.070
  169   2HG   LYS  21          1HG       LYS  21 -13.406  -4.875   0.355
  170   1HD   LYS  21          2HD       LYS  21 -12.959  -2.532   2.227
  171   2HD   LYS  21          1HD       LYS  21 -14.299  -2.669   1.088
  172   1HE   LYS  21          2HE       LYS  21 -14.155  -5.106   2.602
  173   2HE   LYS  21          1HE       LYS  21 -14.169  -3.731   3.726
  174   1HZ   LYS  21          1HZ       LYS  21 -15.949  -2.802   2.146
  175   2HZ   LYS  21          2HZ       LYS  21 -16.405  -4.020   3.240
  176   3HZ   LYS  21          3HZ       LYS  21 -16.114  -4.403   1.610
  177    H    TYR  22           H        TYR  22  -8.446  -6.190   1.776
  178    HA   TYR  22           HA       TYR  22  -7.970  -5.508   4.495
  179   1HB   TYR  22          2HB       TYR  22  -6.553  -6.929   2.282
  180   2HB   TYR  22          1HB       TYR  22  -5.611  -6.524   3.718
  181    HD1  TYR  22           1HD      TYR  22  -9.231  -7.079   3.949
  182    HD2  TYR  22           2HD      TYR  22  -5.360  -8.893   4.360
  183    HE1  TYR  22           1HE      TYR  22 -10.254  -8.981   5.166
  184    HE2  TYR  22           2HE      TYR  22  -6.383 -10.797   5.579
  185    HH   TYR  22           HH       TYR  22  -9.839 -11.206   5.776
  186    H    CYS  23           H        CYS  23  -5.670  -4.774   1.828
  187    HA   CYS  23           HA       CYS  23  -4.417  -2.659   3.346
  188   1HB   CYS  23          2HB       CYS  23  -3.014  -2.483   1.457
  189   2HB   CYS  23          1HB       CYS  23  -3.538  -4.163   1.416
  190    H    ASN  24           H        ASN  24  -7.381  -2.784   1.770
  191    HA   ASN  24           HA       ASN  24  -7.497  -0.076   0.684
  192   1HB   ASN  24          2HB       ASN  24  -8.878  -2.191   0.112
  193   2HB   ASN  24          1HB       ASN  24  -9.798  -1.832   1.574
  194   1HD2  ASN  24          1HD2      ASN  24 -11.751  -1.216   0.444
  195   2HD2  ASN  24          2HD2      ASN  24 -11.838   0.190  -0.504
  196    H    ASP  25           H        ASP  25  -9.184  -1.603   3.459
  197    HA   ASP  25           HA       ASP  25 -10.199   0.688   4.698
  198   1HB   ASP  25          2HB       ASP  25  -9.840  -2.045   5.241
  199   2HB   ASP  25          1HB       ASP  25  -9.092  -1.211   6.603
  200    H    LEU  26           H        LEU  26  -6.987  -0.810   5.232
  201    HA   LEU  26           HA       LEU  26  -6.052   1.185   7.074
  202   1HB   LEU  26          2HB       LEU  26  -4.420  -0.382   7.182
  203   2HB   LEU  26          1HB       LEU  26  -5.195  -1.236   5.853
  204    HG   LEU  26           HG       LEU  26  -3.925   0.396   4.307
  205   1HD1  LEU  26          1HD1      LEU  26  -2.183   0.669   6.768
  206   2HD1  LEU  26          2HD1      LEU  26  -3.326   1.913   6.260
  207   3HD1  LEU  26          3HD1      LEU  26  -1.979   1.472   5.211
  208   1HD2  LEU  26          1HD2      LEU  26  -3.042  -1.991   5.754
  209   2HD2  LEU  26          2HD2      LEU  26  -1.692  -1.012   5.181
  210   3HD2  LEU  26          3HD2      LEU  26  -2.899  -1.605   4.039
  211    H    CYS  27           H        CYS  27  -5.933   0.907   3.533
  212    HA   CYS  27           HA       CYS  27  -4.203   3.125   3.017
  213   1HB   CYS  27          2HB       CYS  27  -6.233   1.483   1.597
  214   2HB   CYS  27          1HB       CYS  27  -5.884   3.059   0.885
  215    H    LYS  28           H        LYS  28  -7.723   2.896   3.504
  216    HA   LYS  28           HA       LYS  28  -8.414   5.588   2.879
  217   1HB   LYS  28          2HB       LYS  28  -9.638   3.253   3.792
  218   2HB   LYS  28          1HB       LYS  28  -9.875   4.390   5.120
  219   1HG   LYS  28          2HG       LYS  28 -11.382   5.591   3.944
  220   2HG   LYS  28          1HG       LYS  28 -10.337   5.637   2.523
  221   1HD   LYS  28          2HD       LYS  28 -11.286   3.761   1.591
  222   2HD   LYS  28          1HD       LYS  28 -11.635   3.032   3.158
  223   1HE   LYS  28          2HE       LYS  28 -13.494   4.619   3.504
  224   2HE   LYS  28          1HE       LYS  28 -13.145   5.370   1.933
  225   1HZ   LYS  28          1HZ       LYS  28 -13.937   2.556   2.446
  226   2HZ   LYS  28          2HZ       LYS  28 -13.344   3.102   0.951
  227   3HZ   LYS  28          3HZ       LYS  28 -14.801   3.720   1.567
  228    H    GLY  29           H        GLY  29  -7.022   4.127   5.769
  229   1HA   GLY  29          2HA       GLY  29  -7.447   6.281   7.587
  230   2HA   GLY  29          1HA       GLY  29  -6.114   5.125   7.695
  231    H    LEU  30           H        LEU  30  -4.993   5.696   5.113
  232    HA   LEU  30           HA       LEU  30  -3.542   8.182   5.778
  233   1HB   LEU  30          2HB       LEU  30  -3.274   6.073   3.609
  234   2HB   LEU  30          1HB       LEU  30  -2.143   7.407   3.838
  235    HG   LEU  30           HG       LEU  30  -2.775   5.749   6.233
  236   1HD1  LEU  30          1HD1      LEU  30  -1.583   3.870   5.593
  237   2HD1  LEU  30          2HD1      LEU  30  -0.645   4.749   4.386
  238   3HD1  LEU  30          3HD1      LEU  30  -2.316   4.298   4.047
  239   1HD2  LEU  30          1HD2      LEU  30  -0.025   6.469   5.330
  240   2HD2  LEU  30          2HD2      LEU  30  -0.728   6.527   6.947
  241   3HD2  LEU  30          3HD2      LEU  30  -1.091   7.800   5.781
  242    H    LYS  31           H        LYS  31  -6.430   7.916   4.615
  243    HA   LYS  31           HA       LYS  31  -7.749   9.439   3.374
  244   1HB   LYS  31          2HB       LYS  31  -5.657  10.918   3.859
  245   2HB   LYS  31          1HB       LYS  31  -5.204  10.544   2.195
  246   1HG   LYS  31          2HG       LYS  31  -6.539  12.254   1.577
  247   2HG   LYS  31          1HG       LYS  31  -7.899  11.217   2.011
  248   1HD   LYS  31          2HD       LYS  31  -8.290  12.320   3.978
  249   2HD   LYS  31          1HD       LYS  31  -6.576  12.637   4.257
  250   1HE   LYS  31          2HE       LYS  31  -6.875  14.220   2.131
  251   2HE   LYS  31          1HE       LYS  31  -8.562  14.233   2.683
  252   1HZ   LYS  31          1HZ       LYS  31  -7.402  14.496   5.003
  253   2HZ   LYS  31          2HZ       LYS  31  -7.695  15.852   4.022
  254   3HZ   LYS  31          3HZ       LYS  31  -6.147  15.154   4.071
  255    H    ALA  32           H        ALA  32  -6.079   6.889   2.330
  256    HA   ALA  32           HA       ALA  32  -6.394   7.370  -0.582
  257   1HB   ALA  32          1HB       ALA  32  -5.467   4.861   0.822
  258   2HB   ALA  32          2HB       ALA  32  -4.404   6.256   0.636
  259   3HB   ALA  32          3HB       ALA  32  -5.039   5.434  -0.788
  260    H    ASP  33           H        ASP  33  -8.789   7.441  -0.489
  261    HA   ASP  33           HA       ASP  33 -10.506   5.504   0.601
  262   1HB   ASP  33          2HB       ASP  33 -10.670   7.129  -1.951
  263   2HB   ASP  33          1HB       ASP  33 -12.045   6.304  -1.214
  264    H    SER  34           H        SER  34  -9.918   5.605  -2.905
  265    HA   SER  34           HA       SER  34 -10.630   2.850  -3.306
  266   1HB   SER  34          2HB       SER  34 -10.723   4.738  -4.960
  267   2HB   SER  34          1HB       SER  34  -8.964   4.710  -5.032
  268    HG   SER  34           HG       SER  34  -9.168   2.481  -5.669
  269    H    GLY  35           H        GLY  35  -9.282   1.546  -1.908
  270   1HA   GLY  35          2HA       GLY  35  -6.451   1.354  -2.841
  271   2HA   GLY  35          1HA       GLY  35  -6.848   1.265  -1.127
  272    H    TYR  36           H        TYR  36  -7.081  -0.416  -4.209
  273    HA   TYR  36           HA       TYR  36  -8.195  -2.817  -2.831
  274   1HB   TYR  36          2HB       TYR  36  -8.587  -3.591  -5.125
  275   2HB   TYR  36          1HB       TYR  36  -9.196  -1.948  -4.937
  276    HD1  TYR  36           1HD      TYR  36  -8.505  -0.273  -6.414
  277    HD2  TYR  36           2HD      TYR  36  -6.129  -3.827  -5.995
  278    HE1  TYR  36           1HE      TYR  36  -7.046   0.484  -8.270
  279    HE2  TYR  36           2HE      TYR  36  -4.668  -3.069  -7.850
  280    HH   TYR  36           HH       TYR  36  -4.761  -1.583  -9.768
  281    H    CYS  37           H        CYS  37  -7.146  -4.928  -4.050
  282    HA   CYS  37           HA       CYS  37  -4.170  -4.611  -3.929
  283   1HB   CYS  37          2HB       CYS  37  -5.819  -5.769  -2.019
  284   2HB   CYS  37          1HB       CYS  37  -5.235  -7.154  -2.943
  285    H    TRP  38           H        TRP  38  -3.139  -5.557  -5.647
  286    HA   TRP  38           HA       TRP  38  -4.732  -7.054  -7.632
  287   1HB   TRP  38          2HB       TRP  38  -2.718  -5.218  -7.745
  288   2HB   TRP  38          1HB       TRP  38  -1.797  -6.712  -7.919
  289    HD1  TRP  38           HD       TRP  38  -1.531  -7.424 -10.330
  290    HE1  TRP  38           1HE      TRP  38  -2.909  -7.202 -12.497
  291    HE3  TRP  38           3HE      TRP  38  -5.592  -4.908  -8.535
  292    HZ2  TRP  38           2HZ      TRP  38  -5.408  -6.102 -13.356
  293    HZ3  TRP  38           3HZ      TRP  38  -7.457  -4.286 -10.046
  294    HH2  TRP  38           HH       TRP  38  -7.370  -4.880 -12.452
  295    H    GLY  39           H        GLY  39  -4.858  -9.264  -7.530
  296   1HA   GLY  39          2HA       GLY  39  -3.118 -10.775  -5.732
  297   2HA   GLY  39          1HA       GLY  39  -4.405 -11.447  -6.735
  298    H    TRP  40           H        TRP  40  -2.869  -9.718  -8.941
  299    HA   TRP  40           HA       TRP  40  -1.408 -12.021 -10.004
  300   1HB   TRP  40          2HB       TRP  40  -2.708 -10.562 -11.450
  301   2HB   TRP  40          1HB       TRP  40  -1.817  -9.151 -10.894
  302    HD1  TRP  40           HD       TRP  40  -0.193  -8.400 -12.666
  303    HE1  TRP  40           1HE      TRP  40   1.369  -9.557 -14.349
  304    HE3  TRP  40           3HE      TRP  40  -1.302 -13.284 -11.692
  305    HZ2  TRP  40           2HZ      TRP  40   2.070 -12.207 -15.179
  306    HZ3  TRP  40           3HZ      TRP  40  -0.176 -15.105 -12.941
  307    HH2  TRP  40           HH       TRP  40   1.508 -14.573 -14.683
  308    H    THR  41           H        THR  41  -0.016  -8.829 -10.358
  309    HA   THR  41           HA       THR  41   2.145  -9.381  -8.408
  310    HB   THR  41           HB       THR  41   3.863  -9.512 -10.066
  311    HG1  THR  41           1HG      THR  41   2.194  -9.236 -12.245
  312   1HG2  THR  41          1HG2      THR  41   1.498 -11.031 -11.197
  313   2HG2  THR  41          2HG2      THR  41   2.468 -11.568  -9.825
  314   3HG2  THR  41          3HG2      THR  41   3.203 -11.421 -11.422
  315    H    LEU  42           H        LEU  42   0.417  -7.300  -8.150
  316    HA   LEU  42           HA       LEU  42   2.029  -4.943  -9.067
  317   1HB   LEU  42          2HB       LEU  42  -0.789  -5.696  -9.474
  318   2HB   LEU  42          1HB       LEU  42  -0.566  -4.041  -8.906
  319    HG   LEU  42           HG       LEU  42   0.859  -5.268 -11.286
  320   1HD1  LEU  42          1HD1      LEU  42  -1.737  -3.936 -10.966
  321   2HD1  LEU  42          2HD1      LEU  42  -1.113  -4.868 -12.328
  322   3HD1  LEU  42          3HD1      LEU  42  -0.704  -3.160 -12.167
  323   1HD2  LEU  42          1HD2      LEU  42   1.008  -2.518 -11.464
  324   2HD2  LEU  42          2HD2      LEU  42   2.295  -3.558 -10.853
  325   3HD2  LEU  42          3HD2      LEU  42   1.173  -2.787  -9.730
  326    H    SER  43           H        SER  43   1.232  -6.641  -6.404
  327    HA   SER  43           HA       SER  43   1.082  -6.081  -4.104
  328   1HB   SER  43          2HB       SER  43   3.050  -4.856  -4.244
  329   2HB   SER  43          1HB       SER  43   2.426  -3.809  -5.512
  330    HG   SER  43           HG       SER  43   2.564  -2.676  -3.565
  331    H    CYS  44           H        CYS  44   0.168  -3.994  -2.697
  332    HA   CYS  44           HA       CYS  44  -2.623  -3.763  -3.461
  333   1HB   CYS  44          2HB       CYS  44  -1.990  -3.846  -1.132
  334   2HB   CYS  44          1HB       CYS  44  -0.877  -2.491  -1.333
  335    H    TYR  45           H        TYR  45  -3.709  -1.713  -3.976
  336    HA   TYR  45           HA       TYR  45  -1.888   0.429  -5.006
  337   1HB   TYR  45          2HB       TYR  45  -2.595  -1.216  -6.774
  338   2HB   TYR  45          1HB       TYR  45  -4.268  -0.760  -6.457
  339    HD1  TYR  45           1HD      TYR  45  -5.209   1.175  -7.440
  340    HD2  TYR  45           2HD      TYR  45  -0.952   0.625  -7.468
  341    HE1  TYR  45           1HE      TYR  45  -4.969   3.125  -8.952
  342    HE2  TYR  45           2HE      TYR  45  -0.710   2.573  -8.980
  343    HH   TYR  45           HH       TYR  45  -3.220   3.895 -10.690
  344    H    CYS  46           H        CYS  46  -2.505   2.217  -3.845
  345    HA   CYS  46           HA       CYS  46  -5.446   2.697  -3.523
  346   1HB   CYS  46          2HB       CYS  46  -3.177   3.415  -1.633
  347   2HB   CYS  46          1HB       CYS  46  -4.891   3.703  -1.348
  348    H    GLN  47           H        GLN  47  -6.130   4.755  -4.120
  349    HA   GLN  47           HA       GLN  47  -4.004   6.665  -5.039
  350   1HB   GLN  47          2HB       GLN  47  -5.685   7.339  -6.727
  351   2HB   GLN  47          1HB       GLN  47  -5.371   5.605  -6.817
  352   1HG   GLN  47          2HG       GLN  47  -7.591   5.289  -6.588
  353   2HG   GLN  47          1HG       GLN  47  -7.419   5.849  -4.924
  354   1HE2  GLN  47          1HE2      GLN  47  -8.354   6.852  -8.196
  355   2HE2  GLN  47          2HE2      GLN  47  -9.075   8.317  -7.727
  356    H    GLY  48           H        GLY  48  -4.136   8.757  -4.229
  357   1HA   GLY  48          2HA       GLY  48  -5.402  10.667  -3.387
  358   2HA   GLY  48          1HA       GLY  48  -6.618   9.543  -2.779
  359    H    LEU  49           H        LEU  49  -3.156   9.070  -2.374
  360    HA   LEU  49           HA       LEU  49  -3.576   9.228   0.582
  361   1HB   LEU  49          2HB       LEU  49  -0.981   8.252   0.006
  362   2HB   LEU  49          1HB       LEU  49  -2.368   7.311   0.529
  363    HG   LEU  49           HG       LEU  49  -1.726   7.946  -2.370
  364   1HD1  LEU  49          1HD1      LEU  49  -0.873   5.770  -0.531
  365   2HD1  LEU  49          2HD1      LEU  49  -0.052   6.438  -1.941
  366   3HD1  LEU  49          3HD1      LEU  49  -1.369   5.285  -2.152
  367   1HD2  LEU  49          1HD2      LEU  49  -3.406   5.633  -1.676
  368   2HD2  LEU  49          2HD2      LEU  49  -3.664   6.879  -2.898
  369   3HD2  LEU  49          3HD2      LEU  49  -4.118   7.181  -1.221
  370    HA   PRO  50           HA       PRO  50  -0.799  12.650   0.857
  371   1HB   PRO  50          2HB       PRO  50   0.868  12.034   2.933
  372   2HB   PRO  50          1HB       PRO  50  -0.853  12.397   3.156
  373   1HG   PRO  50          2HG       PRO  50   0.556   9.826   3.309
  374   2HG   PRO  50          1HG       PRO  50  -0.975  10.322   4.039
  375   1HD   PRO  50          2HD       PRO  50  -0.604   8.726   1.725
  376   2HD   PRO  50          1HD       PRO  50  -2.134   9.339   2.376
  377    H    ASP  51           H        ASP  51   1.456  13.440   0.524
  378    HA   ASP  51           HA       ASP  51   2.909  11.992  -1.448
  379   1HB   ASP  51          2HB       ASP  51   3.165  14.352  -1.281
  380   2HB   ASP  51          1HB       ASP  51   3.539  14.267   0.440
  381    H    ASN  52           H        ASN  52   2.891  11.736   2.006
  382    HA   ASN  52           HA       ASN  52   5.480  10.273   2.069
  383   1HB   ASN  52          2HB       ASN  52   4.521  12.084   3.729
  384   2HB   ASN  52          1HB       ASN  52   3.622  10.719   4.393
  385   1HD2  ASN  52          1HD2      ASN  52   6.925  11.933   3.788
  386   2HD2  ASN  52          2HD2      ASN  52   7.683  10.898   4.898
  387    H    ALA  53           H        ALA  53   2.741   9.339   0.900
  388    HA   ALA  53           HA       ALA  53   1.575   7.301   2.452
  389   1HB   ALA  53          1HB       ALA  53   2.090   6.910  -0.475
  390   2HB   ALA  53          2HB       ALA  53   1.156   8.317   0.036
  391   3HB   ALA  53          3HB       ALA  53   0.594   6.694   0.433
  392    H    ARG  54           H        ARG  54   2.255   5.287   3.087
  393    HA   ARG  54           HA       ARG  54   5.010   4.461   2.732
  394   1HB   ARG  54          2HB       ARG  54   2.776   3.900   4.363
  395   2HB   ARG  54          1HB       ARG  54   3.172   2.381   3.559
  396   1HG   ARG  54          2HG       ARG  54   5.654   3.106   4.227
  397   2HG   ARG  54          1HG       ARG  54   4.789   3.979   5.493
  398   1HD   ARG  54          2HD       ARG  54   4.714   0.996   4.933
  399   2HD   ARG  54          1HD       ARG  54   5.244   1.810   6.417
  400    HE   ARG  54           HE       ARG  54   2.945   2.319   6.928
  401   1HH1  ARG  54          1HH2      ARG  54   3.239  -0.345   5.002
  402   2HH1  ARG  54          2HH2      ARG  54   1.648  -0.282   4.322
  403   1HH2  ARG  54          1HH1      ARG  54   0.947   2.870   5.581
  404   2HH2  ARG  54          2HH1      ARG  54   0.351   1.538   4.648
  405    H    ILE  55           H        ILE  55   5.196   4.292   0.354
  406    HA   ILE  55           HA       ILE  55   3.824   1.856  -0.734
  407    HB   ILE  55           HB       ILE  55   4.043   3.147  -2.947
  408   1HG1  ILE  55          2HG1      ILE  55   4.203   5.612  -2.690
  409   2HG1  ILE  55          1HG1      ILE  55   4.547   5.401  -0.974
  410   1HG2  ILE  55          1HG2      ILE  55   1.932   2.879  -1.611
  411   2HG2  ILE  55          2HG2      ILE  55   1.995   4.381  -2.532
  412   3HG2  ILE  55          3HG2      ILE  55   2.308   4.397  -0.797
  413   1HD1  ILE  55          1HD1      ILE  55   6.642   4.431  -1.382
  414   2HD1  ILE  55          2HD1      ILE  55   6.547   5.679  -2.625
  415   3HD1  ILE  55          3HD1      ILE  55   6.222   3.995  -3.038
  416    H    LYS  56           H        LYS  56   5.204   1.602  -3.084
  417    HA   LYS  56           HA       LYS  56   7.613   0.287  -2.321
  418   1HB   LYS  56          2HB       LYS  56   7.942   0.164  -4.780
  419   2HB   LYS  56          1HB       LYS  56   6.272  -0.191  -4.334
  420   1HG   LYS  56          2HG       LYS  56   5.833   2.327  -4.712
  421   2HG   LYS  56          1HG       LYS  56   7.387   2.339  -5.546
  422   1HD   LYS  56          2HD       LYS  56   5.313   0.277  -6.252
  423   2HD   LYS  56          1HD       LYS  56   5.224   1.900  -6.941
  424   1HE   LYS  56          2HE       LYS  56   6.624   1.031  -8.536
  425   2HE   LYS  56          1HE       LYS  56   7.883   1.293  -7.312
  426   1HZ   LYS  56          1HZ       LYS  56   7.247  -0.923  -6.385
  427   2HZ   LYS  56          2HZ       LYS  56   7.978  -0.988  -7.917
  428   3HZ   LYS  56          3HZ       LYS  56   6.296  -1.174  -7.767
  429    H    ARG  57           H        ARG  57   8.435   2.303  -1.004
  430    HA   ARG  57           HA       ARG  57  10.034   4.087  -2.808
  431   1HB   ARG  57          2HB       ARG  57   8.343   5.215  -1.417
  432   2HB   ARG  57          1HB       ARG  57   9.016   4.462   0.029
  433   1HG   ARG  57          2HG       ARG  57   9.929   6.680  -0.071
  434   2HG   ARG  57          1HG       ARG  57  11.223   5.582  -0.555
  435   1HD   ARG  57          2HD       ARG  57  11.306   7.266  -2.216
  436   2HD   ARG  57          1HD       ARG  57  10.319   6.009  -2.988
  437    HE   ARG  57           HE       ARG  57   8.512   7.515  -2.881
  438   1HH1  ARG  57          1HH1      ARG  57  10.840   9.479  -1.921
  439   2HH1  ARG  57          2HH1      ARG  57   9.993  10.275  -0.637
  440   1HH2  ARG  57          1HH2      ARG  57   7.395   7.978  -0.572
  441   2HH2  ARG  57          2HH2      ARG  57   8.042   9.424   0.126
  442    H    SER  58           H        SER  58  10.153   1.622  -0.415
  443    HA   SER  58           HA       SER  58  13.112   2.005  -0.156
  444   1HB   SER  58          2HB       SER  58  11.972   0.667   2.111
  445   2HB   SER  58          1HB       SER  58  12.793   2.223   2.064
  446    HG   SER  58           HG       SER  58  10.922   3.205   2.069
  447    H    GLY  59           H        GLY  59  14.256   0.173  -0.704
  448   1HA   GLY  59          2HA       GLY  59  12.693  -2.343  -1.096
  449   2HA   GLY  59          1HA       GLY  59  14.176  -1.942  -1.964
  450    H    ARG  60           H        ARG  60  13.739  -1.468   1.505
  451    HA   ARG  60           HA       ARG  60  15.753  -3.647   1.966
  452   1HB   ARG  60          2HB       ARG  60  16.458  -2.110   3.885
  453   2HB   ARG  60          1HB       ARG  60  16.793  -1.504   2.261
  454   1HG   ARG  60          2HG       ARG  60  14.126  -0.812   3.349
  455   2HG   ARG  60          1HG       ARG  60  15.496  -0.056   4.162
  456   1HD   ARG  60          2HD       ARG  60  15.268  -0.050   1.145
  457   2HD   ARG  60          1HD       ARG  60  14.530   1.221   2.143
  458    HE   ARG  60           HE       ARG  60  17.395   0.560   2.600
  459   1HH1  ARG  60          1HH1      ARG  60  15.510   2.411   0.527
  460   2HH1  ARG  60          2HH1      ARG  60  16.263   3.923   0.908
  461   1HH2  ARG  60          1HH2      ARG  60  18.131   2.638   3.530
  462   2HH2  ARG  60          2HH2      ARG  60  17.745   4.052   2.607
  463    H    CYS  61           H        CYS  61  14.527  -5.291   2.853
  464    HA   CYS  61           HA       CYS  61  12.107  -5.133   4.256
  465   1HB   CYS  61          2HB       CYS  61  12.919  -7.249   3.557
  466   2HB   CYS  61          1HB       CYS  61  14.483  -6.999   4.330
  467    H    ARG  62           H        ARG  62  11.825  -3.689   5.945
  468    HA   ARG  62           HA       ARG  62  13.963  -3.227   7.925
  469   1HB   ARG  62          2HB       ARG  62  11.699  -1.881   6.847
  470   2HB   ARG  62          1HB       ARG  62  11.418  -2.059   8.578
  471   1HG   ARG  62          2HG       ARG  62  12.698  -0.175   8.718
  472   2HG   ARG  62          1HG       ARG  62  14.034  -1.321   8.592
  473   1HD   ARG  62          2HD       ARG  62  14.406   0.431   6.948
  474   2HD   ARG  62          1HD       ARG  62  13.906  -1.024   6.065
  475    HE   ARG  62           HE       ARG  62  12.078   0.289   5.357
  476   1HH1  ARG  62          1HH1      ARG  62  13.397   1.996   7.909
  477   2HH1  ARG  62          2HH1      ARG  62  11.902   2.660   8.478
  478   1HH2  ARG  62          1HH2      ARG  62   9.936   0.713   6.384
  479   2HH2  ARG  62          2HH2      ARG  62   9.939   1.933   7.613
  480    H    ALA  63           H        ALA  63  13.191  -5.911   8.046
  481    HA   ALA  63           HA       ALA  63  12.335  -6.160  10.807
  482   1HB   ALA  63          1HB       ALA  63  10.322  -5.781   8.928
  483   2HB   ALA  63          2HB       ALA  63  10.104  -6.483  10.530
  484   3HB   ALA  63          3HB       ALA  63  10.355  -7.532   9.134
  Start of MODEL    5
    1   1H    LYS   1          1HT       LYS   1  -1.349  15.152  -2.516
    2   2H    LYS   1          2HT       LYS   1  -1.844  14.023  -1.348
    3   3H    LYS   1          3HT       LYS   1  -2.827  15.360  -1.713
    4    HA   LYS   1           HA       LYS   1  -3.560  13.181  -2.722
    5   1HB   LYS   1          2HB       LYS   1  -4.464  15.243  -3.492
    6   2HB   LYS   1          1HB       LYS   1  -2.932  15.730  -4.220
    7   1HG   LYS   1          2HG       LYS   1  -3.157  14.200  -6.005
    8   2HG   LYS   1          1HG       LYS   1  -4.384  13.257  -5.157
    9   1HD   LYS   1          2HD       LYS   1  -5.876  15.308  -5.263
   10   2HD   LYS   1          1HD       LYS   1  -4.686  16.021  -6.354
   11   1HE   LYS   1          2HE       LYS   1  -5.330  13.313  -7.190
   12   2HE   LYS   1          1HE       LYS   1  -6.793  14.315  -7.094
   13   1HZ   LYS   1          1HZ       LYS   1  -4.266  15.233  -8.350
   14   2HZ   LYS   1          2HZ       LYS   1  -5.786  15.989  -8.412
   15   3HZ   LYS   1          3HZ       LYS   1  -5.530  14.521  -9.229
   16    H    ILE   2           H        ILE   2  -2.304  11.372  -3.157
   17    HA   ILE   2           HA       ILE   2  -0.518  11.512  -5.531
   18    HB   ILE   2           HB       ILE   2   0.896  11.938  -3.580
   19   1HG1  ILE   2          2HG1      ILE   2   1.115   9.097  -4.620
   20   2HG1  ILE   2          1HG1      ILE   2   1.880  10.530  -5.309
   21   1HG2  ILE   2          1HG2      ILE   2   1.032  10.039  -1.853
   22   2HG2  ILE   2          2HG2      ILE   2  -0.509   9.492  -2.509
   23   3HG2  ILE   2          3HG2      ILE   2  -0.384  11.087  -1.770
   24   1HD1  ILE   2          1HD1      ILE   2   3.293  10.808  -3.400
   25   2HD1  ILE   2          2HD1      ILE   2   3.375   9.098  -3.824
   26   3HD1  ILE   2          3HD1      ILE   2   2.378   9.624  -2.468
   27    H    ASP   3           H        ASP   3  -0.062   9.332  -6.388
   28    HA   ASP   3           HA       ASP   3  -1.947   7.219  -5.398
   29   1HB   ASP   3          2HB       ASP   3  -1.325   8.041  -8.257
   30   2HB   ASP   3          1HB       ASP   3  -2.423   6.745  -7.780
   31    H    GLY   4           H        GLY   4  -0.986   5.190  -5.243
   32   1HA   GLY   4          2HA       GLY   4   1.123   4.228  -6.894
   33   2HA   GLY   4          1HA       GLY   4   1.847   4.908  -5.435
   34    H    TYR   5           H        TYR   5   2.531   2.648  -4.995
   35    HA   TYR   5           HA       TYR   5   0.299   0.912  -4.017
   36   1HB   TYR   5          2HB       TYR   5   3.187   0.164  -4.526
   37   2HB   TYR   5          1HB       TYR   5   1.795  -0.913  -4.433
   38    HD1  TYR   5           1HD      TYR   5   0.205  -1.091  -6.282
   39    HD2  TYR   5           2HD      TYR   5   3.595   1.537  -6.511
   40    HE1  TYR   5           1HE      TYR   5  -0.143  -0.859  -8.722
   41    HE2  TYR   5           2HE      TYR   5   3.247   1.770  -8.954
   42    HH   TYR   5           HH       TYR   5   0.425   0.871 -10.503
   43    HA   PRO   6           HA       PRO   6   2.072   2.171  -0.086
   44   1HB   PRO   6          2HB       PRO   6  -0.145   1.581   1.398
   45   2HB   PRO   6          1HB       PRO   6   0.023   3.081   0.464
   46   1HG   PRO   6          2HG       PRO   6  -1.566   0.662  -0.122
   47   2HG   PRO   6          1HG       PRO   6  -1.862   2.348  -0.565
   48   1HD   PRO   6          2HD       PRO   6  -0.842   0.356  -2.243
   49   2HD   PRO   6          1HD       PRO   6  -0.811   2.105  -2.552
   50    H    VAL   7           H        VAL   7   3.559   0.574   0.490
   51    HA   VAL   7           HA       VAL   7   2.753  -2.241   0.813
   52    HB   VAL   7           HB       VAL   7   5.203  -2.413   1.465
   53   1HG1  VAL   7          1HG1      VAL   7   5.748  -2.503  -0.743
   54   2HG1  VAL   7          2HG1      VAL   7   5.250  -0.837  -1.035
   55   3HG1  VAL   7          3HG1      VAL   7   4.046  -2.126  -0.999
   56   1HG2  VAL   7          1HG2      VAL   7   6.325  -0.548   2.047
   57   2HG2  VAL   7          2HG2      VAL   7   4.839   0.381   1.846
   58   3HG2  VAL   7          3HG2      VAL   7   5.952   0.191   0.490
   59    H    ASP   8           H        ASP   8   4.056  -3.116   3.024
   60    HA   ASP   8           HA       ASP   8   2.365  -2.254   5.208
   61   1HB   ASP   8          2HB       ASP   8   3.890  -3.854   6.461
   62   2HB   ASP   8          1HB       ASP   8   3.139  -4.535   5.018
   63    H    TYR   9           H        TYR   9   5.348  -2.632   6.635
   64    HA   TYR   9           HA       TYR   9   5.735   0.337   6.818
   65   1HB   TYR   9          2HB       TYR   9   5.333  -1.765   8.741
   66   2HB   TYR   9          1HB       TYR   9   6.926  -1.054   8.996
   67    HD1  TYR   9           1HD      TYR   9   3.443   0.095   8.163
   68    HD2  TYR   9           2HD      TYR   9   7.034   0.785  10.417
   69    HE1  TYR   9           1HE      TYR   9   2.391   2.069   9.235
   70    HE2  TYR   9           2HE      TYR   9   5.981   2.757  11.489
   71    HH   TYR   9           HH       TYR   9   2.742   3.861  10.532
   72    H    TRP  10           H        TRP  10   7.554  -2.735   7.215
   73    HA   TRP  10           HA       TRP  10  10.034  -1.333   6.330
   74   1HB   TRP  10          2HB       TRP  10   9.723  -4.167   7.343
   75   2HB   TRP  10          1HB       TRP  10  11.157  -3.147   7.401
   76    HD1  TRP  10           HD       TRP  10  11.342  -1.374   9.330
   77    HE1  TRP  10           1HE      TRP  10   9.995  -0.989  11.495
   78    HE3  TRP  10           3HE      TRP  10   7.300  -4.334   8.384
   79    HZ2  TRP  10           2HZ      TRP  10   7.524  -1.830  12.669
   80    HZ3  TRP  10           3HZ      TRP  10   5.462  -4.528  10.040
   81    HH2  TRP  10           HH       TRP  10   5.570  -3.280  12.179
   82    H    ASN  11           H        ASN  11   7.615  -2.560   4.667
   83    HA   ASN  11           HA       ASN  11   7.415  -3.591   2.550
   84   1HB   ASN  11          2HB       ASN  11  10.425  -3.184   2.584
   85   2HB   ASN  11          1HB       ASN  11   9.409  -3.369   1.154
   86   1HD2  ASN  11          1HD2      ASN  11  10.657  -1.087   0.902
   87   2HD2  ASN  11          2HD2      ASN  11   9.764   0.258   1.422
   88    H    CYS  12           H        CYS  12   8.531  -5.063   5.160
   89    HA   CYS  12           HA       CYS  12   9.777  -7.446   3.937
   90   1HB   CYS  12          2HB       CYS  12  10.366  -6.247   6.156
   91   2HB   CYS  12          1HB       CYS  12   8.923  -7.025   6.804
   92    H    LYS  13           H        LYS  13   6.686  -6.412   5.271
   93    HA   LYS  13           HA       LYS  13   5.597  -9.150   5.342
   94   1HB   LYS  13          2HB       LYS  13   4.481  -6.372   5.823
   95   2HB   LYS  13          1HB       LYS  13   3.537  -7.848   6.031
   96   1HG   LYS  13          2HG       LYS  13   6.203  -7.622   7.390
   97   2HG   LYS  13          1HG       LYS  13   4.810  -6.800   8.092
   98   1HD   LYS  13          2HD       LYS  13   3.906  -9.379   7.383
   99   2HD   LYS  13          1HD       LYS  13   5.473  -9.611   8.159
  100   1HE   LYS  13          2HE       LYS  13   4.102  -9.557  10.043
  101   2HE   LYS  13          1HE       LYS  13   4.449  -7.823   9.885
  102   1HZ   LYS  13          1HZ       LYS  13   2.082  -9.307   8.897
  103   2HZ   LYS  13          2HZ       LYS  13   2.490  -7.763   8.317
  104   3HZ   LYS  13          3HZ       LYS  13   2.116  -7.984   9.958
  105    H    ARG  14           H        ARG  14   6.482  -8.364   2.717
  106    HA   ARG  14           HA       ARG  14   5.649  -8.570   0.506
  107   1HB   ARG  14          2HB       ARG  14   3.773  -9.746   2.258
  108   2HB   ARG  14          1HB       ARG  14   2.830  -8.732   1.165
  109   1HG   ARG  14          2HG       ARG  14   4.085  -9.790  -0.757
  110   2HG   ARG  14          1HG       ARG  14   4.780 -10.921   0.404
  111   1HD   ARG  14          2HD       ARG  14   1.801 -10.579   0.401
  112   2HD   ARG  14          1HD       ARG  14   2.541 -11.544  -0.892
  113    HE   ARG  14           HE       ARG  14   3.509 -12.145   1.823
  114   1HH1  ARG  14          1HH1      ARG  14   3.296 -13.850  -0.797
  115   2HH1  ARG  14          2HH1      ARG  14   2.149 -15.039  -0.276
  116   1HH2  ARG  14          1HH2      ARG  14   1.177 -13.255   2.535
  117   2HH2  ARG  14          2HH2      ARG  14   0.949 -14.702   1.610
  118    H    ILE  15           H        ILE  15   5.009  -7.014  -1.001
  119    HA   ILE  15           HA       ILE  15   4.370  -4.342  -0.040
  120    HB   ILE  15           HB       ILE  15   4.470  -3.820  -2.439
  121   1HG1  ILE  15          2HG1      ILE  15   4.302  -6.833  -2.713
  122   2HG1  ILE  15          1HG1      ILE  15   3.213  -5.627  -3.398
  123   1HG2  ILE  15          1HG2      ILE  15   6.721  -4.144  -2.541
  124   2HG2  ILE  15          2HG2      ILE  15   6.573  -5.889  -2.327
  125   3HG2  ILE  15          3HG2      ILE  15   6.519  -4.820  -0.925
  126   1HD1  ILE  15          1HD1      ILE  15   4.852  -6.571  -5.058
  127   2HD1  ILE  15          2HD1      ILE  15   6.151  -5.848  -4.111
  128   3HD1  ILE  15          3HD1      ILE  15   4.945  -4.819  -4.886
  129    H    CYS  16           H        CYS  16   2.469  -7.068  -0.606
  130    HA   CYS  16           HA       CYS  16   0.004  -5.408  -0.639
  131   1HB   CYS  16          2HB       CYS  16   0.351  -5.758  -2.954
  132   2HB   CYS  16          1HB       CYS  16   0.908  -7.411  -2.711
  133    H    TRP  17           H        TRP  17  -1.852  -6.589   0.146
  134    HA   TRP  17           HA       TRP  17  -1.159  -8.816   1.949
  135   1HB   TRP  17          2HB       TRP  17  -2.906  -6.650   1.947
  136   2HB   TRP  17          1HB       TRP  17  -3.971  -8.031   1.688
  137    HD1  TRP  17           HD       TRP  17  -2.197 -10.124   3.381
  138    HE1  TRP  17           1HE      TRP  17  -2.261  -9.984   5.953
  139    HE3  TRP  17           3HE      TRP  17  -3.831  -5.323   3.959
  140    HZ2  TRP  17           2HZ      TRP  17  -2.918  -8.082   7.990
  141    HZ3  TRP  17           3HZ      TRP  17  -4.166  -4.372   6.223
  142    HH2  TRP  17           HH       TRP  17  -3.713  -5.744   8.237
  143    H    TYR  18           H        TYR  18  -3.591 -10.228   1.914
  144    HA   TYR  18           HA       TYR  18  -3.392 -11.623  -0.727
  145   1HB   TYR  18          2HB       TYR  18  -2.828 -12.864   1.348
  146   2HB   TYR  18          1HB       TYR  18  -4.442 -12.526   1.976
  147    HD1  TYR  18           1HD      TYR  18  -2.471 -14.821   0.116
  148    HD2  TYR  18           2HD      TYR  18  -6.441 -13.210   0.412
  149    HE1  TYR  18           1HE      TYR  18  -3.360 -16.788  -1.103
  150    HE2  TYR  18           2HE      TYR  18  -7.331 -15.176  -0.807
  151    HH   TYR  18           HH       TYR  18  -6.422 -17.724  -1.095
  152    H    ASN  19           H        ASN  19  -5.583  -9.959   1.445
  153    HA   ASN  19           HA       ASN  19  -7.966 -10.780  -0.120
  154   1HB   ASN  19          2HB       ASN  19  -7.309  -9.685   2.522
  155   2HB   ASN  19          1HB       ASN  19  -8.704  -8.896   1.783
  156   1HD2  ASN  19          1HD2      ASN  19 -10.361  -9.922   3.027
  157   2HD2  ASN  19          2HD2      ASN  19 -10.646 -11.595   2.986
  158    H    ASN  20           H        ASN  20  -9.289  -9.199  -1.210
  159    HA   ASN  20           HA       ASN  20  -7.771  -6.994  -2.406
  160   1HB   ASN  20          2HB       ASN  20 -10.503  -8.236  -2.696
  161   2HB   ASN  20          1HB       ASN  20 -10.112  -6.730  -3.530
  162   1HD2  ASN  20          1HD2      ASN  20  -9.201 -10.172  -3.275
  163   2HD2  ASN  20          2HD2      ASN  20  -8.363 -10.230  -4.751
  164    H    LYS  21           H        LYS  21  -9.676  -7.354   0.386
  165    HA   LYS  21           HA       LYS  21 -10.502  -4.479   0.380
  166   1HB   LYS  21          2HB       LYS  21 -12.011  -6.594   0.839
  167   2HB   LYS  21          1HB       LYS  21 -11.273  -6.528   2.440
  168   1HG   LYS  21          2HG       LYS  21 -11.973  -4.133   2.617
  169   2HG   LYS  21          1HG       LYS  21 -12.818  -4.303   1.077
  170   1HD   LYS  21          2HD       LYS  21 -13.899  -6.403   2.306
  171   2HD   LYS  21          1HD       LYS  21 -13.486  -5.474   3.747
  172   1HE   LYS  21          2HE       LYS  21 -15.666  -4.710   3.221
  173   2HE   LYS  21          1HE       LYS  21 -14.629  -3.479   2.474
  174   1HZ   LYS  21          1HZ       LYS  21 -16.007  -5.754   1.192
  175   2HZ   LYS  21          2HZ       LYS  21 -14.625  -5.070   0.480
  176   3HZ   LYS  21          3HZ       LYS  21 -16.010  -4.120   0.739
  177    H    TYR  22           H        TYR  22  -8.754  -6.929   2.287
  178    HA   TYR  22           HA       TYR  22  -8.089  -5.575   4.609
  179   1HB   TYR  22          2HB       TYR  22  -6.909  -7.615   2.856
  180   2HB   TYR  22          1HB       TYR  22  -5.710  -6.768   3.833
  181    HD1  TYR  22           1HD      TYR  22  -9.051  -8.443   4.100
  182    HD2  TYR  22           2HD      TYR  22  -5.386  -7.381   6.074
  183    HE1  TYR  22           1HE      TYR  22  -9.740  -9.757   6.087
  184    HE2  TYR  22           2HE      TYR  22  -6.075  -8.696   8.060
  185    HH   TYR  22           HH       TYR  22  -8.745  -9.440   8.934
  186    H    CYS  23           H        CYS  23  -6.786  -5.001   1.361
  187    HA   CYS  23           HA       CYS  23  -4.733  -3.130   2.271
  188   1HB   CYS  23          2HB       CYS  23  -5.496  -4.549  -0.081
  189   2HB   CYS  23          1HB       CYS  23  -5.468  -2.835  -0.494
  190    H    ASN  24           H        ASN  24  -8.080  -2.932   1.216
  191    HA   ASN  24           HA       ASN  24  -8.149  -0.086   0.684
  192   1HB   ASN  24          2HB       ASN  24  -9.989  -1.143  -0.214
  193   2HB   ASN  24          1HB       ASN  24  -9.972  -2.410   1.007
  194   1HD2  ASN  24          1HD2      ASN  24 -12.068  -2.345   1.867
  195   2HD2  ASN  24          2HD2      ASN  24 -12.814  -0.946   2.476
  196    H    ASP  25           H        ASP  25  -8.832  -2.088   3.561
  197    HA   ASP  25           HA       ASP  25  -9.756  -0.002   5.277
  198   1HB   ASP  25          2HB       ASP  25  -9.266  -2.756   5.342
  199   2HB   ASP  25          1HB       ASP  25  -8.195  -2.095   6.579
  200    H    LEU  26           H        LEU  26  -6.478  -1.298   4.702
  201    HA   LEU  26           HA       LEU  26  -5.201   0.501   6.598
  202   1HB   LEU  26          2HB       LEU  26  -3.739  -1.210   6.287
  203   2HB   LEU  26          1HB       LEU  26  -4.600  -1.740   4.846
  204    HG   LEU  26           HG       LEU  26  -3.388  -0.041   3.512
  205   1HD1  LEU  26          1HD1      LEU  26  -2.396   1.681   4.570
  206   2HD1  LEU  26          2HD1      LEU  26  -1.241   0.555   5.283
  207   3HD1  LEU  26          3HD1      LEU  26  -2.738   0.939   6.133
  208   1HD2  LEU  26          1HD2      LEU  26  -2.451  -2.281   3.619
  209   2HD2  LEU  26          2HD2      LEU  26  -1.681  -1.929   5.166
  210   3HD2  LEU  26          3HD2      LEU  26  -1.122  -1.124   3.699
  211    H    CYS  27           H        CYS  27  -5.595   0.438   3.054
  212    HA   CYS  27           HA       CYS  27  -4.049   2.762   2.481
  213   1HB   CYS  27          2HB       CYS  27  -6.187   1.117   1.213
  214   2HB   CYS  27          1HB       CYS  27  -5.909   2.714   0.521
  215    H    LYS  28           H        LYS  28  -7.357   2.342   3.655
  216    HA   LYS  28           HA       LYS  28  -8.259   5.037   3.192
  217   1HB   LYS  28          2HB       LYS  28  -9.187   2.599   4.326
  218   2HB   LYS  28          1HB       LYS  28  -9.381   3.839   5.567
  219   1HG   LYS  28          2HG       LYS  28 -11.339   4.225   4.437
  220   2HG   LYS  28          1HG       LYS  28 -10.283   5.218   3.432
  221   1HD   LYS  28          2HD       LYS  28 -10.802   2.292   2.869
  222   2HD   LYS  28          1HD       LYS  28 -11.766   3.588   2.161
  223   1HE   LYS  28          2HE       LYS  28  -9.978   4.395   0.877
  224   2HE   LYS  28          1HE       LYS  28  -8.761   3.653   1.933
  225   1HZ   LYS  28          1HZ       LYS  28  -9.188   1.560   1.127
  226   2HZ   LYS  28          2HZ       LYS  28  -9.401   2.488  -0.280
  227   3HZ   LYS  28          3HZ       LYS  28 -10.751   1.951   0.600
  228    H    GLY  29           H        GLY  29  -6.244   3.521   5.631
  229   1HA   GLY  29          2HA       GLY  29  -6.398   5.564   7.637
  230   2HA   GLY  29          1HA       GLY  29  -5.029   4.466   7.413
  231    H    LEU  30           H        LEU  30  -4.591   5.172   4.656
  232    HA   LEU  30           HA       LEU  30  -3.114   7.715   5.058
  233   1HB   LEU  30          2HB       LEU  30  -3.194   5.562   2.921
  234   2HB   LEU  30          1HB       LEU  30  -2.199   7.011   2.780
  235    HG   LEU  30           HG       LEU  30  -2.047   5.228   5.209
  236   1HD1  LEU  30          1HD1      LEU  30   0.182   4.857   3.440
  237   2HD1  LEU  30          2HD1      LEU  30  -1.304   4.526   2.550
  238   3HD1  LEU  30          3HD1      LEU  30  -0.953   3.647   4.039
  239   1HD2  LEU  30          1HD2      LEU  30  -1.084   7.491   5.371
  240   2HD2  LEU  30          2HD2      LEU  30  -0.132   7.196   3.917
  241   3HD2  LEU  30          3HD2      LEU  30   0.192   6.274   5.384
  242    H    LYS  31           H        LYS  31  -6.141   7.393   4.645
  243    HA   LYS  31           HA       LYS  31  -7.842   8.609   3.576
  244   1HB   LYS  31          2HB       LYS  31  -6.308  10.449   4.211
  245   2HB   LYS  31          1HB       LYS  31  -5.446  10.241   2.686
  246   1HG   LYS  31          2HG       LYS  31  -6.935  11.578   1.665
  247   2HG   LYS  31          1HG       LYS  31  -8.225  10.450   2.082
  248   1HD   LYS  31          2HD       LYS  31  -7.211  12.347   4.175
  249   2HD   LYS  31          1HD       LYS  31  -8.330  12.938   2.944
  250   1HE   LYS  31          2HE       LYS  31 -10.094  11.742   3.790
  251   2HE   LYS  31          1HE       LYS  31  -9.070  10.358   4.226
  252   1HZ   LYS  31          1HZ       LYS  31  -9.981  12.029   6.045
  253   2HZ   LYS  31          2HZ       LYS  31  -8.582  12.887   5.605
  254   3HZ   LYS  31          3HZ       LYS  31  -8.458  11.295   6.187
  255    H    ALA  32           H        ALA  32  -6.182   6.443   2.100
  256    HA   ALA  32           HA       ALA  32  -6.365   7.321  -0.710
  257   1HB   ALA  32          1HB       ALA  32  -5.260   5.251  -1.136
  258   2HB   ALA  32          2HB       ALA  32  -5.828   4.553   0.380
  259   3HB   ALA  32          3HB       ALA  32  -4.597   5.815   0.399
  260    H    ASP  33           H        ASP  33  -8.693   7.689  -0.811
  261    HA   ASP  33           HA       ASP  33 -10.833   6.134  -0.096
  262   1HB   ASP  33          2HB       ASP  33 -10.927   8.238  -1.359
  263   2HB   ASP  33          1HB       ASP  33 -10.293   7.427  -2.789
  264    H    SER  34           H        SER  34 -10.045   5.747  -3.512
  265    HA   SER  34           HA       SER  34 -10.840   2.971  -3.504
  266   1HB   SER  34          2HB       SER  34  -9.258   4.577  -5.537
  267   2HB   SER  34          1HB       SER  34 -10.166   3.102  -5.859
  268    HG   SER  34           HG       SER  34 -11.021   5.659  -5.717
  269    H    GLY  35           H        GLY  35  -9.458   1.838  -2.017
  270   1HA   GLY  35          2HA       GLY  35  -6.646   1.562  -2.988
  271   2HA   GLY  35          1HA       GLY  35  -7.013   1.658  -1.265
  272    H    TYR  36           H        TYR  36  -6.499  -0.466  -3.809
  273    HA   TYR  36           HA       TYR  36  -7.425  -2.739  -2.133
  274   1HB   TYR  36          2HB       TYR  36  -8.589  -3.688  -4.145
  275   2HB   TYR  36          1HB       TYR  36  -9.316  -2.186  -3.573
  276    HD1  TYR  36           1HD      TYR  36  -7.214  -3.725  -6.188
  277    HD2  TYR  36           2HD      TYR  36  -9.147  -0.131  -4.849
  278    HE1  TYR  36           1HE      TYR  36  -6.833  -2.691  -8.407
  279    HE2  TYR  36           2HE      TYR  36  -8.767   0.903  -7.071
  280    HH   TYR  36           HH       TYR  36  -8.067  -0.753  -9.768
  281    H    CYS  37           H        CYS  37  -6.441  -4.794  -2.867
  282    HA   CYS  37           HA       CYS  37  -3.771  -4.333  -4.068
  283   1HB   CYS  37          2HB       CYS  37  -5.002  -6.047  -2.107
  284   2HB   CYS  37          1HB       CYS  37  -4.203  -7.039  -3.328
  285    H    TRP  38           H        TRP  38  -3.070  -5.390  -5.972
  286    HA   TRP  38           HA       TRP  38  -5.175  -6.179  -7.855
  287   1HB   TRP  38          2HB       TRP  38  -2.802  -4.950  -8.097
  288   2HB   TRP  38          1HB       TRP  38  -2.258  -6.606  -8.362
  289    HD1  TRP  38           HD       TRP  38  -2.489  -7.478 -10.733
  290    HE1  TRP  38           1HE      TRP  38  -3.823  -6.802 -12.832
  291    HE3  TRP  38           3HE      TRP  38  -5.295  -3.673  -8.806
  292    HZ2  TRP  38           2HZ      TRP  38  -5.814  -4.896 -13.594
  293    HZ3  TRP  38           3HZ      TRP  38  -6.900  -2.442 -10.244
  294    HH2  TRP  38           HH       TRP  38  -7.162  -3.050 -12.630
  295    H    GLY  39           H        GLY  39  -6.052  -8.207  -7.586
  296   1HA   GLY  39          2HA       GLY  39  -4.723 -10.371  -6.259
  297   2HA   GLY  39          1HA       GLY  39  -6.189 -10.519  -7.225
  298    H    TRP  40           H        TRP  40  -2.729  -9.837  -7.814
  299    HA   TRP  40           HA       TRP  40  -2.523 -12.142  -9.615
  300   1HB   TRP  40          2HB       TRP  40  -3.663 -10.409 -10.978
  301   2HB   TRP  40          1HB       TRP  40  -2.342  -9.295 -10.642
  302    HD1  TRP  40           HD       TRP  40  -1.083  -9.093 -12.839
  303    HE1  TRP  40           1HE      TRP  40  -0.032 -10.751 -14.503
  304    HE3  TRP  40           3HE      TRP  40  -2.747 -13.497 -10.868
  305    HZ2  TRP  40           2HZ      TRP  40   0.094 -13.576 -14.945
  306    HZ3  TRP  40           3HZ      TRP  40  -2.146 -15.657 -11.929
  307    HH2  TRP  40           HH       TRP  40  -0.730 -15.700 -13.963
  308    H    THR  41           H        THR  41  -0.888  -8.991  -9.448
  309    HA   THR  41           HA       THR  41   1.320  -9.821  -7.825
  310    HB   THR  41           HB       THR  41   1.613 -11.333  -9.804
  311    HG1  THR  41           1HG      THR  41   3.781 -10.859 -10.037
  312   1HG2  THR  41          1HG2      THR  41   2.232  -8.811 -11.350
  313   2HG2  THR  41          2HG2      THR  41   0.652  -9.594 -11.411
  314   3HG2  THR  41          3HG2      THR  41   2.085 -10.456 -11.971
  315    H    LEU  42           H        LEU  42  -0.415  -7.479  -8.409
  316    HA   LEU  42           HA       LEU  42   1.624  -5.507  -9.380
  317   1HB   LEU  42          2HB       LEU  42  -1.109  -5.986  -9.930
  318   2HB   LEU  42          1HB       LEU  42  -1.048  -4.473  -9.026
  319    HG   LEU  42           HG       LEU  42   0.862  -4.973 -11.300
  320   1HD1  LEU  42          1HD1      LEU  42  -0.842  -3.623 -12.669
  321   2HD1  LEU  42          2HD1      LEU  42  -2.016  -4.059 -11.427
  322   3HD1  LEU  42          3HD1      LEU  42  -1.229  -5.318 -12.378
  323   1HD2  LEU  42          1HD2      LEU  42   1.472  -3.052 -10.098
  324   2HD2  LEU  42          2HD2      LEU  42  -0.203  -2.615  -9.756
  325   3HD2  LEU  42          3HD2      LEU  42   0.456  -2.386 -11.377
  326    H    SER  43           H        SER  43   1.502  -6.631  -6.578
  327    HA   SER  43           HA       SER  43   1.536  -5.810  -4.357
  328   1HB   SER  43          2HB       SER  43   2.864  -3.882  -4.250
  329   2HB   SER  43          1HB       SER  43   3.187  -4.436  -5.891
  330    HG   SER  43           HG       SER  43   2.064  -2.807  -6.670
  331    H    CYS  44           H        CYS  44   0.709  -3.641  -3.072
  332    HA   CYS  44           HA       CYS  44  -2.190  -3.583  -3.473
  333   1HB   CYS  44          2HB       CYS  44  -0.866  -3.563  -1.280
  334   2HB   CYS  44          1HB       CYS  44  -0.475  -1.882  -1.646
  335    H    TYR  45           H        TYR  45  -3.373  -1.853  -4.374
  336    HA   TYR  45           HA       TYR  45  -1.764   0.496  -5.326
  337   1HB   TYR  45          2HB       TYR  45  -2.430  -1.351  -7.007
  338   2HB   TYR  45          1HB       TYR  45  -4.078  -0.752  -6.815
  339    HD1  TYR  45           1HD      TYR  45  -0.863   1.163  -6.811
  340    HD2  TYR  45           2HD      TYR  45  -4.553   0.340  -8.850
  341    HE1  TYR  45           1HE      TYR  45  -0.390   3.000  -8.408
  342    HE2  TYR  45           2HE      TYR  45  -4.081   2.178 -10.446
  343    HH   TYR  45           HH       TYR  45  -1.051   3.604 -10.757
  344    H    CYS  46           H        CYS  46  -2.544   2.308  -4.358
  345    HA   CYS  46           HA       CYS  46  -5.505   2.605  -4.040
  346   1HB   CYS  46          2HB       CYS  46  -3.353   3.292  -2.007
  347   2HB   CYS  46          1HB       CYS  46  -5.089   3.517  -1.790
  348    H    GLN  47           H        GLN  47  -6.209   4.833  -4.157
  349    HA   GLN  47           HA       GLN  47  -4.094   6.800  -4.969
  350   1HB   GLN  47          2HB       GLN  47  -6.538   5.808  -6.387
  351   2HB   GLN  47          1HB       GLN  47  -6.063   7.489  -6.624
  352   1HG   GLN  47          2HG       GLN  47  -4.425   6.863  -8.029
  353   2HG   GLN  47          1HG       GLN  47  -3.726   5.824  -6.786
  354   1HE2  GLN  47          1HE2      GLN  47  -3.927   5.173  -9.661
  355   2HE2  GLN  47          2HE2      GLN  47  -4.899   3.784  -9.774
  356    H    GLY  48           H        GLY  48  -4.554   8.966  -4.378
  357   1HA   GLY  48          2HA       GLY  48  -6.000  10.736  -3.581
  358   2HA   GLY  48          1HA       GLY  48  -7.146   9.513  -3.028
  359    H    LEU  49           H        LEU  49  -3.698   9.279  -2.397
  360    HA   LEU  49           HA       LEU  49  -4.302   9.623   0.522
  361   1HB   LEU  49          2HB       LEU  49  -1.901   8.404   0.497
  362   2HB   LEU  49          1HB       LEU  49  -3.405   7.502   0.371
  363    HG   LEU  49           HG       LEU  49  -2.020   8.522  -2.103
  364   1HD1  LEU  49          1HD1      LEU  49  -0.289   7.118  -1.784
  365   2HD1  LEU  49          2HD1      LEU  49  -1.424   5.770  -1.723
  366   3HD1  LEU  49          3HD1      LEU  49  -0.964   6.605  -0.238
  367   1HD2  LEU  49          1HD2      LEU  49  -3.493   7.159  -3.202
  368   2HD2  LEU  49          2HD2      LEU  49  -4.432   7.321  -1.718
  369   3HD2  LEU  49          3HD2      LEU  49  -3.408   5.906  -1.962
  370    HA   PRO  50           HA       PRO  50  -1.641  13.082   0.855
  371   1HB   PRO  50          2HB       PRO  50  -0.014  12.509   2.982
  372   2HB   PRO  50          1HB       PRO  50  -1.731  12.921   3.157
  373   1HG   PRO  50          2HG       PRO  50  -0.421  10.245   3.176
  374   2HG   PRO  50          1HG       PRO  50  -1.727  10.868   4.198
  375   1HD   PRO  50          2HD       PRO  50  -2.180   9.218   2.107
  376   2HD   PRO  50          1HD       PRO  50  -3.343  10.462   2.613
  377    H    ASP  51           H        ASP  51   0.539  13.870   0.454
  378    HA   ASP  51           HA       ASP  51   2.058  12.377  -1.427
  379   1HB   ASP  51          2HB       ASP  51   1.935  14.904  -0.870
  380   2HB   ASP  51          1HB       ASP  51   3.138  14.553   0.370
  381    H    ASN  52           H        ASN  52   2.127  12.414   2.069
  382    HA   ASN  52           HA       ASN  52   4.767  11.109   2.245
  383   1HB   ASN  52          2HB       ASN  52   3.569  12.807   3.847
  384   2HB   ASN  52          1HB       ASN  52   2.735  11.377   4.453
  385   1HD2  ASN  52          1HD2      ASN  52   3.824  11.256   6.498
  386   2HD2  ASN  52          2HD2      ASN  52   5.487  10.942   6.632
  387    H    ALA  53           H        ALA  53   2.068   9.953   1.040
  388    HA   ALA  53           HA       ALA  53   1.203   7.732   2.558
  389   1HB   ALA  53          1HB       ALA  53  -0.077   8.195   0.687
  390   2HB   ALA  53          2HB       ALA  53   0.888   6.866   0.046
  391   3HB   ALA  53          3HB       ALA  53   1.329   8.534  -0.319
  392    H    ARG  54           H        ARG  54   2.532   6.166   3.387
  393    HA   ARG  54           HA       ARG  54   5.145   5.489   2.468
  394   1HB   ARG  54          2HB       ARG  54   4.527   4.888   4.666
  395   2HB   ARG  54          1HB       ARG  54   3.002   4.177   4.136
  396   1HG   ARG  54          2HG       ARG  54   3.982   2.192   3.522
  397   2HG   ARG  54          1HG       ARG  54   5.496   2.965   3.050
  398   1HD   ARG  54          2HD       ARG  54   4.596   2.703   5.936
  399   2HD   ARG  54          1HD       ARG  54   5.693   1.559   5.139
  400    HE   ARG  54           HE       ARG  54   6.433   4.184   6.051
  401   1HH1  ARG  54          1HH1      ARG  54   7.588   1.475   4.532
  402   2HH1  ARG  54          2HH1      ARG  54   8.768   2.283   3.556
  403   1HH2  ARG  54          1HH2      ARG  54   7.607   5.462   4.316
  404   2HH2  ARG  54          2HH2      ARG  54   8.779   4.541   3.434
  405    H    ILE  55           H        ILE  55   5.589   4.597   0.460
  406    HA   ILE  55           HA       ILE  55   3.836   2.367  -0.476
  407    HB   ILE  55           HB       ILE  55   4.095   3.497  -2.794
  408   1HG1  ILE  55          2HG1      ILE  55   4.401   5.954  -2.674
  409   2HG1  ILE  55          1HG1      ILE  55   4.740   5.821  -0.948
  410   1HG2  ILE  55          1HG2      ILE  55   2.143   4.929  -2.367
  411   2HG2  ILE  55          2HG2      ILE  55   2.463   4.867  -0.633
  412   3HG2  ILE  55          3HG2      ILE  55   1.984   3.405  -1.494
  413   1HD1  ILE  55          1HD1      ILE  55   6.327   4.218  -2.939
  414   2HD1  ILE  55          2HD1      ILE  55   6.774   4.706  -1.304
  415   3HD1  ILE  55          3HD1      ILE  55   6.749   5.896  -2.605
  416    H    LYS  56           H        LYS  56   4.942   1.401  -2.570
  417    HA   LYS  56           HA       LYS  56   7.262   0.059  -1.976
  418   1HB   LYS  56          2HB       LYS  56   7.568  -0.018  -4.492
  419   2HB   LYS  56          1HB       LYS  56   5.938  -0.402  -3.942
  420   1HG   LYS  56          2HG       LYS  56   5.101   1.308  -5.135
  421   2HG   LYS  56          1HG       LYS  56   6.156   2.441  -4.292
  422   1HD   LYS  56          2HD       LYS  56   7.211   2.729  -6.270
  423   2HD   LYS  56          1HD       LYS  56   7.877   1.114  -6.030
  424   1HE   LYS  56          2HE       LYS  56   5.299   0.636  -7.011
  425   2HE   LYS  56          1HE       LYS  56   5.898   1.998  -7.979
  426   1HZ   LYS  56          1HZ       LYS  56   6.808   0.161  -9.040
  427   2HZ   LYS  56          2HZ       LYS  56   7.116  -0.664  -7.587
  428   3HZ   LYS  56          3HZ       LYS  56   8.073   0.668  -8.031
  429    H    ARG  57           H        ARG  57   8.813   1.358  -0.865
  430    HA   ARG  57           HA       ARG  57  10.213   3.395  -2.568
  431   1HB   ARG  57          2HB       ARG  57   8.897   3.904  -0.303
  432   2HB   ARG  57          1HB       ARG  57  10.405   3.342   0.421
  433   1HG   ARG  57          2HG       ARG  57  11.452   4.977  -1.417
  434   2HG   ARG  57          1HG       ARG  57   9.887   5.769  -1.240
  435   1HD   ARG  57          2HD       ARG  57  11.356   6.792   0.379
  436   2HD   ARG  57          1HD       ARG  57  10.303   5.696   1.296
  437    HE   ARG  57           HE       ARG  57  12.717   4.386   0.313
  438   1HH1  ARG  57          1HH2      ARG  57  13.042   6.991   2.130
  439   2HH1  ARG  57          2HH2      ARG  57  13.402   6.212   3.636
  440   1HH2  ARG  57          1HH1      ARG  57  12.435   3.066   2.541
  441   2HH2  ARG  57          2HH1      ARG  57  13.058   3.989   3.868
  442    H    SER  58           H        SER  58  10.454   0.467  -0.736
  443    HA   SER  58           HA       SER  58  13.293   0.180  -1.518
  444   1HB   SER  58          2HB       SER  58  12.691   1.304   0.897
  445   2HB   SER  58          1HB       SER  58  12.750  -0.401   1.333
  446    HG   SER  58           HG       SER  58  14.764   0.584  -0.322
  447    H    GLY  59           H        GLY  59  14.000  -2.055  -1.330
  448   1HA   GLY  59          2HA       GLY  59  11.735  -3.978  -0.955
  449   2HA   GLY  59          1HA       GLY  59  13.001  -4.209  -2.164
  450    H    ARG  60           H        ARG  60  14.116  -2.862   0.762
  451    HA   ARG  60           HA       ARG  60  15.435  -5.442   1.444
  452   1HB   ARG  60          2HB       ARG  60  16.011  -2.561   1.585
  453   2HB   ARG  60          1HB       ARG  60  16.487  -3.443   3.037
  454   1HG   ARG  60          2HG       ARG  60  18.291  -3.362   1.297
  455   2HG   ARG  60          1HG       ARG  60  17.805  -5.004   1.721
  456   1HD   ARG  60          2HD       ARG  60  16.820  -5.388  -0.334
  457   2HD   ARG  60          1HD       ARG  60  16.354  -3.687  -0.541
  458    HE   ARG  60           HE       ARG  60  19.201  -3.832  -0.493
  459   1HH1  ARG  60          1HH1      ARG  60  17.439  -2.510  -2.610
  460   2HH1  ARG  60          2HH1      ARG  60  17.878  -3.415  -4.019
  461   1HH2  ARG  60          1HH2      ARG  60  19.376  -5.981  -2.229
  462   2HH2  ARG  60          2HH2      ARG  60  18.975  -5.381  -3.804
  463    H    CYS  61           H        CYS  61  13.887  -6.543   2.697
  464    HA   CYS  61           HA       CYS  61  11.982  -5.705   4.491
  465   1HB   CYS  61          2HB       CYS  61  12.331  -8.024   4.078
  466   2HB   CYS  61          1HB       CYS  61  14.020  -7.940   4.573
  467    H    ARG  62           H        ARG  62  12.240  -4.007   5.924
  468    HA   ARG  62           HA       ARG  62  14.789  -3.639   7.383
  469   1HB   ARG  62          2HB       ARG  62  12.551  -2.070   6.473
  470   2HB   ARG  62          1HB       ARG  62  12.761  -1.826   8.206
  471   1HG   ARG  62          2HG       ARG  62  14.409  -0.375   7.677
  472   2HG   ARG  62          1HG       ARG  62  15.364  -1.785   7.214
  473   1HD   ARG  62          2HD       ARG  62  15.391  -0.954   5.103
  474   2HD   ARG  62          1HD       ARG  62  13.649  -1.286   5.023
  475    HE   ARG  62           HE       ARG  62  14.739   1.319   5.183
  476   1HH1  ARG  62          1HH1      ARG  62  11.806   0.651   4.810
  477   2HH1  ARG  62          2HH1      ARG  62  11.108   1.372   6.222
  478   1HH2  ARG  62          1HH2      ARG  62  14.136   1.680   7.885
  479   2HH2  ARG  62          2HH2      ARG  62  12.427   1.955   7.963
  480    H    ALA  63           H        ALA  63  13.703  -6.025   8.222
  481    HA   ALA  63           HA       ALA  63  13.344  -5.628  11.051
  482   1HB   ALA  63          1HB       ALA  63  11.136  -4.909   9.736
  483   2HB   ALA  63          2HB       ALA  63  11.037  -5.753  11.282
  484   3HB   ALA  63          3HB       ALA  63  10.835  -6.646   9.774
  Start of MODEL    6
    1   1H    LYS   1          1HT       LYS   1  -2.476  15.143  -3.099
    2   2H    LYS   1          2HT       LYS   1  -2.435  13.785  -2.080
    3   3H    LYS   1          3HT       LYS   1  -3.780  14.822  -2.065
    4    HA   LYS   1           HA       LYS   1  -4.363  12.850  -3.292
    5   1HB   LYS   1          2HB       LYS   1  -3.896  15.476  -4.697
    6   2HB   LYS   1          1HB       LYS   1  -4.679  14.142  -5.545
    7   1HG   LYS   1          2HG       LYS   1  -6.053  14.106  -3.194
    8   2HG   LYS   1          1HG       LYS   1  -5.696  15.829  -3.333
    9   1HD   LYS   1          2HD       LYS   1  -6.498  15.519  -5.811
   10   2HD   LYS   1          1HD       LYS   1  -7.288  14.074  -5.182
   11   1HE   LYS   1          2HE       LYS   1  -8.666  15.320  -3.712
   12   2HE   LYS   1          1HE       LYS   1  -7.631  16.758  -3.827
   13   1HZ   LYS   1          1HZ       LYS   1  -8.153  16.447  -6.367
   14   2HZ   LYS   1          2HZ       LYS   1  -9.216  17.305  -5.356
   15   3HZ   LYS   1          3HZ       LYS   1  -9.548  15.691  -5.771
   16    H    ILE   2           H        ILE   2  -2.624  11.286  -3.379
   17    HA   ILE   2           HA       ILE   2  -1.028  11.413  -5.911
   18    HB   ILE   2           HB       ILE   2   0.295  12.044  -3.883
   19   1HG1  ILE   2          2HG1      ILE   2   0.961   9.361  -5.138
   20   2HG1  ILE   2          1HG1      ILE   2   1.450  10.948  -5.735
   21   1HG2  ILE   2          1HG2      ILE   2  -0.336   9.213  -2.997
   22   2HG2  ILE   2          2HG2      ILE   2  -1.032  10.668  -2.284
   23   3HG2  ILE   2          3HG2      ILE   2   0.701  10.363  -2.154
   24   1HD1  ILE   2          1HD1      ILE   2   3.284  10.828  -4.439
   25   2HD1  ILE   2          2HD1      ILE   2   2.727   9.307  -3.742
   26   3HD1  ILE   2          3HD1      ILE   2   2.239  10.839  -3.018
   27    H    ASP   3           H        ASP   3  -0.281   9.175  -6.563
   28    HA   ASP   3           HA       ASP   3  -2.033   7.003  -5.472
   29   1HB   ASP   3          2HB       ASP   3  -2.249   6.330  -7.945
   30   2HB   ASP   3          1HB       ASP   3  -3.127   7.779  -7.451
   31    H    GLY   4           H        GLY   4  -0.827   5.204  -5.001
   32   1HA   GLY   4          2HA       GLY   4   1.365   4.325  -6.687
   33   2HA   GLY   4          1HA       GLY   4   1.949   5.020  -5.174
   34    H    TYR   5           H        TYR   5   2.682   2.567  -5.201
   35    HA   TYR   5           HA       TYR   5   0.535   0.796  -4.143
   36   1HB   TYR   5          2HB       TYR   5   3.438   0.199  -4.780
   37   2HB   TYR   5          1HB       TYR   5   2.124  -0.965  -4.608
   38    HD1  TYR   5           1HD      TYR   5   3.933  -0.688  -7.047
   39    HD2  TYR   5           2HD      TYR   5   0.130   1.059  -6.078
   40    HE1  TYR   5           1HE      TYR   5   3.421  -0.467  -9.463
   41    HE2  TYR   5           2HE      TYR   5  -0.383   1.280  -8.495
   42    HH   TYR   5           HH       TYR   5   0.449  -0.020 -10.676
   43    HA   PRO   6           HA       PRO   6   2.316   1.914  -0.165
   44   1HB   PRO   6          2HB       PRO   6   0.155   1.118   1.306
   45   2HB   PRO   6          1HB       PRO   6   0.229   2.681   0.470
   46   1HG   PRO   6          2HG       PRO   6  -1.227   0.215  -0.265
   47   2HG   PRO   6          1HG       PRO   6  -1.640   1.908  -0.565
   48   1HD   PRO   6          2HD       PRO   6  -0.560   0.145  -2.428
   49   2HD   PRO   6          1HD       PRO   6  -0.587   1.915  -2.570
   50    H    VAL   7           H        VAL   7   3.653   0.522   0.957
   51    HA   VAL   7           HA       VAL   7   3.236  -2.404   0.673
   52    HB   VAL   7           HB       VAL   7   5.554  -2.465   1.557
   53   1HG1  VAL   7          1HG1      VAL   7   4.774  -0.711  -0.732
   54   2HG1  VAL   7          2HG1      VAL   7   5.716  -2.202  -0.730
   55   3HG1  VAL   7          3HG1      VAL   7   6.463  -0.685  -0.230
   56   1HG2  VAL   7          1HG2      VAL   7   6.684  -0.501   2.281
   57   2HG2  VAL   7          2HG2      VAL   7   5.103  -0.418   3.058
   58   3HG2  VAL   7          3HG2      VAL   7   5.433   0.557   1.626
   59    H    ASP   8           H        ASP   8   4.296  -3.429   2.947
   60    HA   ASP   8           HA       ASP   8   2.196  -3.033   4.923
   61   1HB   ASP   8          2HB       ASP   8   3.103  -5.222   4.621
   62   2HB   ASP   8          1HB       ASP   8   4.759  -4.630   4.745
   63    H    TYR   9           H        TYR   9   5.532  -3.256   5.954
   64    HA   TYR   9           HA       TYR   9   5.433  -0.465   7.015
   65   1HB   TYR   9          2HB       TYR   9   4.620  -2.191   8.676
   66   2HB   TYR   9          1HB       TYR   9   6.216  -2.932   8.603
   67    HD1  TYR   9           1HD      TYR   9   7.494  -2.413  10.475
   68    HD2  TYR   9           2HD      TYR   9   4.975   0.611   8.753
   69    HE1  TYR   9           1HE      TYR   9   8.332  -0.771  12.134
   70    HE2  TYR   9           2HE      TYR   9   5.813   2.253  10.413
   71    HH   TYR   9           HH       TYR   9   7.848   2.555  11.831
   72    H    TRP  10           H        TRP  10   7.658  -3.193   7.536
   73    HA   TRP  10           HA       TRP  10   9.958  -1.528   6.687
   74   1HB   TRP  10          2HB       TRP  10   9.487  -4.172   8.040
   75   2HB   TRP  10          1HB       TRP  10  11.082  -3.781   7.411
   76    HD1  TRP  10           HD       TRP  10  11.493  -4.052  10.198
   77    HE1  TRP  10           1HE      TRP  10  11.612  -2.163  11.941
   78    HE3  TRP  10           3HE      TRP  10   9.087  -0.341   7.666
   79    HZ2  TRP  10           2HZ      TRP  10  10.810   0.562  12.223
   80    HZ3  TRP  10           3HZ      TRP  10   8.780   1.892   8.683
   81    HH2  TRP  10           HH       TRP  10   9.640   2.349  10.962
   82    H    ASN  11           H        ASN  11   7.825  -2.723   4.824
   83    HA   ASN  11           HA       ASN  11   7.798  -3.605   2.638
   84   1HB   ASN  11          2HB       ASN  11  10.801  -3.364   2.966
   85   2HB   ASN  11          1HB       ASN  11   9.906  -3.378   1.446
   86   1HD2  ASN  11          1HD2      ASN  11   9.671  -1.306   0.608
   87   2HD2  ASN  11          2HD2      ASN  11   9.489   0.108   1.530
   88    H    CYS  12           H        CYS  12   8.250  -5.384   5.130
   89    HA   CYS  12           HA       CYS  12   9.760  -7.640   3.942
   90   1HB   CYS  12          2HB       CYS  12  10.020  -6.897   6.321
   91   2HB   CYS  12          1HB       CYS  12   8.343  -7.365   6.606
   92    H    LYS  13           H        LYS  13   6.459  -6.811   4.925
   93    HA   LYS  13           HA       LYS  13   5.422  -9.457   4.156
   94   1HB   LYS  13          2HB       LYS  13   4.140  -6.842   5.015
   95   2HB   LYS  13          1HB       LYS  13   3.266  -8.361   4.813
   96   1HG   LYS  13          2HG       LYS  13   5.444  -7.725   6.813
   97   2HG   LYS  13          1HG       LYS  13   3.783  -8.223   7.141
   98   1HD   LYS  13          2HD       LYS  13   4.385 -10.382   5.844
   99   2HD   LYS  13          1HD       LYS  13   6.063  -9.885   6.074
  100   1HE   LYS  13          2HE       LYS  13   5.564  -9.699   8.562
  101   2HE   LYS  13          1HE       LYS  13   4.014 -10.497   8.224
  102   1HZ   LYS  13          1HZ       LYS  13   5.240 -12.277   7.105
  103   2HZ   LYS  13          2HZ       LYS  13   5.693 -12.146   8.737
  104   3HZ   LYS  13          3HZ       LYS  13   6.709 -11.537   7.519
  105    H    ARG  14           H        ARG  14   6.743  -8.189   1.987
  106    HA   ARG  14           HA       ARG  14   6.391  -7.601  -0.273
  107   1HB   ARG  14          2HB       ARG  14   4.588  -9.571   0.553
  108   2HB   ARG  14          1HB       ARG  14   3.582  -8.394  -0.293
  109   1HG   ARG  14          2HG       ARG  14   4.449 -10.068  -1.873
  110   2HG   ARG  14          1HG       ARG  14   5.125  -8.478  -2.228
  111   1HD   ARG  14          2HD       ARG  14   7.075  -9.753  -2.261
  112   2HD   ARG  14          1HD       ARG  14   7.028  -9.335  -0.536
  113    HE   ARG  14           HE       ARG  14   5.418 -11.643  -0.895
  114   1HH1  ARG  14          1HH1      ARG  14   8.633 -10.529  -0.527
  115   2HH1  ARG  14          2HH1      ARG  14   9.325 -12.115  -0.422
  116   1HH2  ARG  14          1HH2      ARG  14   6.327 -13.750  -1.030
  117   2HH2  ARG  14          2HH2      ARG  14   8.018 -13.938  -0.708
  118    H    ILE  15           H        ILE  15   5.062  -6.129  -1.683
  119    HA   ILE  15           HA       ILE  15   4.182  -3.785  -0.145
  120    HB   ILE  15           HB       ILE  15   5.584  -3.479  -2.085
  121   1HG1  ILE  15          2HG1      ILE  15   2.761  -2.759  -2.917
  122   2HG1  ILE  15          1HG1      ILE  15   3.679  -1.861  -1.708
  123   1HG2  ILE  15          1HG2      ILE  15   3.521  -5.228  -3.421
  124   2HG2  ILE  15          2HG2      ILE  15   5.272  -5.433  -3.376
  125   3HG2  ILE  15          3HG2      ILE  15   4.559  -4.163  -4.367
  126   1HD1  ILE  15          1HD1      ILE  15   3.923  -1.833  -4.627
  127   2HD1  ILE  15          2HD1      ILE  15   5.468  -2.073  -3.811
  128   3HD1  ILE  15          3HD1      ILE  15   4.487  -0.655  -3.443
  129    H    CYS  16           H        CYS  16   2.642  -6.579  -1.024
  130    HA   CYS  16           HA       CYS  16  -0.013  -5.216  -1.013
  131   1HB   CYS  16          2HB       CYS  16   0.540  -5.602  -3.337
  132   2HB   CYS  16          1HB       CYS  16   1.017  -7.266  -2.997
  133    H    TRP  17           H        TRP  17  -1.299  -6.195   0.493
  134    HA   TRP  17           HA       TRP  17  -0.474  -8.545   1.949
  135   1HB   TRP  17          2HB       TRP  17  -2.326  -6.430   2.132
  136   2HB   TRP  17          1HB       TRP  17  -3.300  -7.899   2.121
  137    HD1  TRP  17           HD       TRP  17  -1.982  -9.925   3.787
  138    HE1  TRP  17           1HE      TRP  17  -1.302  -9.571   6.247
  139    HE3  TRP  17           3HE      TRP  17  -1.797  -4.824   3.927
  140    HZ2  TRP  17           2HZ      TRP  17  -0.753  -7.411   8.039
  141    HZ3  TRP  17           3HZ      TRP  17  -1.194  -3.645   6.022
  142    HH2  TRP  17           HH       TRP  17  -0.672  -4.931   8.076
  143    H    TYR  18           H        TYR  18  -3.173  -9.749   2.080
  144    HA   TYR  18           HA       TYR  18  -3.437 -10.969  -0.634
  145   1HB   TYR  18          2HB       TYR  18  -1.977 -12.118   1.345
  146   2HB   TYR  18          1HB       TYR  18  -3.572 -12.767   1.727
  147    HD1  TYR  18           1HD      TYR  18  -0.767 -12.848  -0.589
  148    HD2  TYR  18           2HD      TYR  18  -4.856 -14.032  -0.017
  149    HE1  TYR  18           1HE      TYR  18  -0.555 -14.478  -2.446
  150    HE2  TYR  18           2HE      TYR  18  -4.644 -15.661  -1.874
  151    HH   TYR  18           HH       TYR  18  -3.283 -16.062  -3.822
  152    H    ASN  19           H        ASN  19  -5.178  -9.068   0.659
  153    HA   ASN  19           HA       ASN  19  -7.654 -10.706   0.777
  154   1HB   ASN  19          2HB       ASN  19  -6.265  -9.474   3.025
  155   2HB   ASN  19          1HB       ASN  19  -7.908  -8.851   2.868
  156   1HD2  ASN  19          1HD2      ASN  19  -9.676 -10.573   2.698
  157   2HD2  ASN  19          2HD2      ASN  19  -9.443 -12.039   3.519
  158    H    ASN  20           H        ASN  20  -9.605  -9.279   0.603
  159    HA   ASN  20           HA       ASN  20  -9.047  -6.965  -1.150
  160   1HB   ASN  20          2HB       ASN  20 -11.488  -8.531  -0.289
  161   2HB   ASN  20          1HB       ASN  20 -11.616  -7.080  -1.284
  162   1HD2  ASN  20          1HD2      ASN  20 -12.511  -8.827  -2.878
  163   2HD2  ASN  20          2HD2      ASN  20 -11.372  -9.605  -3.867
  164    H    LYS  21           H        LYS  21  -8.462  -6.842   1.787
  165    HA   LYS  21           HA       LYS  21  -9.844  -4.290   2.332
  166   1HB   LYS  21          2HB       LYS  21 -11.052  -6.569   3.161
  167   2HB   LYS  21          1HB       LYS  21  -9.976  -6.294   4.532
  168   1HG   LYS  21          2HG       LYS  21 -11.047  -4.364   5.164
  169   2HG   LYS  21          1HG       LYS  21 -11.478  -3.936   3.508
  170   1HD   LYS  21          2HD       LYS  21 -13.562  -4.564   4.270
  171   2HD   LYS  21          1HD       LYS  21 -12.977  -6.138   3.729
  172   1HE   LYS  21          2HE       LYS  21 -12.011  -5.731   6.392
  173   2HE   LYS  21          1HE       LYS  21 -13.752  -5.385   6.376
  174   1HZ   LYS  21          1HZ       LYS  21 -13.255  -7.780   6.627
  175   2HZ   LYS  21          2HZ       LYS  21 -12.498  -7.761   5.107
  176   3HZ   LYS  21          3HZ       LYS  21 -14.161  -7.440   5.234
  177    H    TYR  22           H        TYR  22  -7.634  -6.837   3.496
  178    HA   TYR  22           HA       TYR  22  -6.263  -5.563   5.549
  179   1HB   TYR  22          2HB       TYR  22  -5.885  -7.711   3.710
  180   2HB   TYR  22          1HB       TYR  22  -4.374  -6.803   3.775
  181    HD1  TYR  22           1HD      TYR  22  -4.225  -5.807   6.485
  182    HD2  TYR  22           2HD      TYR  22  -5.669  -9.600   5.078
  183    HE1  TYR  22           1HE      TYR  22  -3.709  -6.822   8.689
  184    HE2  TYR  22           2HE      TYR  22  -5.153 -10.615   7.282
  185    HH   TYR  22           HH       TYR  22  -3.267  -9.002   9.650
  186    H    CYS  23           H        CYS  23  -6.176  -4.810   2.116
  187    HA   CYS  23           HA       CYS  23  -3.952  -2.866   2.526
  188   1HB   CYS  23          2HB       CYS  23  -4.712  -4.660   0.501
  189   2HB   CYS  23          1HB       CYS  23  -5.078  -3.063  -0.149
  190    H    ASN  24           H        ASN  24  -7.237  -2.975   1.089
  191    HA   ASN  24           HA       ASN  24  -7.585  -0.201   0.603
  192   1HB   ASN  24          2HB       ASN  24  -9.690  -2.137   1.626
  193   2HB   ASN  24          1HB       ASN  24  -9.924  -0.778   0.527
  194   1HD2  ASN  24          1HD2      ASN  24 -10.885  -2.972  -0.603
  195   2HD2  ASN  24          2HD2      ASN  24  -9.812  -3.690  -1.705
  196    H    ASP  25           H        ASP  25  -8.820  -2.018   3.453
  197    HA   ASP  25           HA       ASP  25  -9.739   0.041   5.046
  198   1HB   ASP  25          2HB       ASP  25  -9.373  -2.569   5.373
  199   2HB   ASP  25          1HB       ASP  25  -7.945  -2.035   6.261
  200    H    LEU  26           H        LEU  26  -6.328  -1.075   4.978
  201    HA   LEU  26           HA       LEU  26  -5.321   0.959   6.733
  202   1HB   LEU  26          2HB       LEU  26  -4.393  -1.207   5.024
  203   2HB   LEU  26          1HB       LEU  26  -3.289   0.168   4.960
  204    HG   LEU  26           HG       LEU  26  -4.304  -1.096   7.523
  205   1HD1  LEU  26          1HD1      LEU  26  -2.527  -2.509   7.505
  206   2HD1  LEU  26          2HD1      LEU  26  -1.444  -1.276   6.861
  207   3HD1  LEU  26          3HD1      LEU  26  -2.482  -2.192   5.770
  208   1HD2  LEU  26          1HD2      LEU  26  -3.231   0.576   8.623
  209   2HD2  LEU  26          2HD2      LEU  26  -3.282   1.436   7.085
  210   3HD2  LEU  26          3HD2      LEU  26  -1.846   0.516   7.533
  211    H    CYS  27           H        CYS  27  -5.510   0.767   3.176
  212    HA   CYS  27           HA       CYS  27  -4.134   3.181   2.561
  213   1HB   CYS  27          2HB       CYS  27  -6.135   1.358   1.288
  214   2HB   CYS  27          1HB       CYS  27  -5.835   2.914   0.514
  215    H    LYS  28           H        LYS  28  -7.563   2.565   3.272
  216    HA   LYS  28           HA       LYS  28  -8.568   5.165   2.670
  217   1HB   LYS  28          2HB       LYS  28  -9.523   3.354   4.900
  218   2HB   LYS  28          1HB       LYS  28 -10.491   4.408   3.871
  219   1HG   LYS  28          2HG       LYS  28  -9.062   2.637   2.158
  220   2HG   LYS  28          1HG       LYS  28  -9.786   1.663   3.438
  221   1HD   LYS  28          2HD       LYS  28 -11.839   3.367   2.848
  222   2HD   LYS  28          1HD       LYS  28 -11.083   3.178   1.265
  223   1HE   LYS  28          2HE       LYS  28 -12.047   1.143   1.060
  224   2HE   LYS  28          1HE       LYS  28 -11.190   0.597   2.514
  225   1HZ   LYS  28          1HZ       LYS  28 -13.695   2.198   2.515
  226   2HZ   LYS  28          2HZ       LYS  28 -12.883   1.602   3.883
  227   3HZ   LYS  28          3HZ       LYS  28 -13.619   0.527   2.793
  228    H    GLY  29           H        GLY  29  -6.915   3.873   5.504
  229   1HA   GLY  29          2HA       GLY  29  -7.476   6.067   7.274
  230   2HA   GLY  29          1HA       GLY  29  -6.118   4.948   7.437
  231    H    LEU  30           H        LEU  30  -5.219   5.527   4.672
  232    HA   LEU  30           HA       LEU  30  -3.696   7.995   5.285
  233   1HB   LEU  30          2HB       LEU  30  -3.523   5.910   3.083
  234   2HB   LEU  30          1HB       LEU  30  -2.355   7.206   3.339
  235    HG   LEU  30           HG       LEU  30  -3.029   5.384   5.622
  236   1HD1  LEU  30          1HD1      LEU  30  -2.534   3.901   3.689
  237   2HD1  LEU  30          2HD1      LEU  30  -1.265   3.829   4.912
  238   3HD1  LEU  30          3HD1      LEU  30  -1.017   4.763   3.436
  239   1HD2  LEU  30          1HD2      LEU  30  -1.600   7.107   6.295
  240   2HD2  LEU  30          2HD2      LEU  30  -0.766   7.157   4.743
  241   3HD2  LEU  30          3HD2      LEU  30  -0.446   5.842   5.873
  242    H    LYS  31           H        LYS  31  -6.639   7.739   4.331
  243    HA   LYS  31           HA       LYS  31  -8.042   9.179   3.086
  244   1HB   LYS  31          2HB       LYS  31  -6.067  10.753   3.607
  245   2HB   LYS  31          1HB       LYS  31  -5.509  10.396   1.972
  246   1HG   LYS  31          2HG       LYS  31  -6.817  12.320   1.664
  247   2HG   LYS  31          1HG       LYS  31  -7.926  11.012   1.248
  248   1HD   LYS  31          2HD       LYS  31  -8.795  11.067   3.595
  249   2HD   LYS  31          1HD       LYS  31  -7.771  12.471   3.902
  250   1HE   LYS  31          2HE       LYS  31  -9.005  13.849   2.436
  251   2HE   LYS  31          1HE       LYS  31  -9.711  12.463   1.584
  252   1HZ   LYS  31          1HZ       LYS  31 -11.138  12.006   3.297
  253   2HZ   LYS  31          2HZ       LYS  31 -11.064  13.698   3.432
  254   3HZ   LYS  31          3HZ       LYS  31 -10.147  12.718   4.475
  255    H    ALA  32           H        ALA  32  -6.393   6.684   1.961
  256    HA   ALA  32           HA       ALA  32  -6.751   7.274  -0.939
  257   1HB   ALA  32          1HB       ALA  32  -5.263   5.464  -1.265
  258   2HB   ALA  32          2HB       ALA  32  -5.649   4.754   0.303
  259   3HB   ALA  32          3HB       ALA  32  -4.669   6.217   0.216
  260    H    ASP  33           H        ASP  33  -9.198   7.180   0.184
  261    HA   ASP  33           HA       ASP  33 -10.583   4.907   0.829
  262   1HB   ASP  33          2HB       ASP  33 -12.447   5.953  -0.574
  263   2HB   ASP  33          1HB       ASP  33 -11.677   7.023   0.598
  264    H    SER  34           H        SER  34  -9.208   5.639  -2.328
  265    HA   SER  34           HA       SER  34 -10.509   3.293  -3.577
  266   1HB   SER  34          2HB       SER  34  -9.541   4.206  -5.597
  267   2HB   SER  34          1HB       SER  34 -10.173   5.558  -4.661
  268    HG   SER  34           HG       SER  34  -7.855   5.518  -5.568
  269    H    GLY  35           H        GLY  35  -9.123   2.093  -1.687
  270   1HA   GLY  35          2HA       GLY  35  -6.412   1.494  -2.767
  271   2HA   GLY  35          1HA       GLY  35  -6.935   1.162  -1.114
  272    H    TYR  36           H        TYR  36  -5.995  -0.511  -3.597
  273    HA   TYR  36           HA       TYR  36  -7.680  -2.831  -2.954
  274   1HB   TYR  36          2HB       TYR  36  -8.619  -3.065  -5.155
  275   2HB   TYR  36          1HB       TYR  36  -8.899  -1.391  -4.680
  276    HD1  TYR  36           1HD      TYR  36  -6.821  -3.632  -6.769
  277    HD2  TYR  36           2HD      TYR  36  -7.773   0.439  -5.779
  278    HE1  TYR  36           1HE      TYR  36  -5.564  -2.852  -8.761
  279    HE2  TYR  36           2HE      TYR  36  -6.516   1.217  -7.770
  280    HH   TYR  36           HH       TYR  36  -5.476   0.590  -9.646
  281    H    CYS  37           H        CYS  37  -6.334  -4.598  -3.046
  282    HA   CYS  37           HA       CYS  37  -3.647  -4.262  -4.220
  283   1HB   CYS  37          2HB       CYS  37  -4.853  -5.613  -2.048
  284   2HB   CYS  37          1HB       CYS  37  -4.218  -6.865  -3.115
  285    H    TRP  38           H        TRP  38  -2.948  -5.268  -6.084
  286    HA   TRP  38           HA       TRP  38  -4.937  -6.594  -7.785
  287   1HB   TRP  38          2HB       TRP  38  -2.851  -4.983  -8.259
  288   2HB   TRP  38          1HB       TRP  38  -2.008  -6.528  -8.394
  289    HD1  TRP  38           HD       TRP  38  -1.941  -7.320 -10.800
  290    HE1  TRP  38           1HE      TRP  38  -3.538  -7.248 -12.822
  291    HE3  TRP  38           3HE      TRP  38  -5.856  -4.767  -8.743
  292    HZ2  TRP  38           2HZ      TRP  38  -6.131  -6.244 -13.480
  293    HZ3  TRP  38           3HZ      TRP  38  -7.877  -4.268 -10.090
  294    HH2  TRP  38           HH       TRP  38  -8.018  -5.002 -12.454
  295    H    GLY  39           H        GLY  39  -5.421  -8.698  -7.289
  296   1HA   GLY  39          2HA       GLY  39  -3.776 -10.458  -5.783
  297   2HA   GLY  39          1HA       GLY  39  -5.138 -10.963  -6.779
  298    H    TRP  40           H        TRP  40  -3.400  -9.470  -9.025
  299    HA   TRP  40           HA       TRP  40  -2.246 -11.969 -10.011
  300   1HB   TRP  40          2HB       TRP  40  -3.373 -10.294 -11.445
  301   2HB   TRP  40          1HB       TRP  40  -2.126  -9.120 -11.044
  302    HD1  TRP  40           HD       TRP  40  -0.702  -8.895 -13.148
  303    HE1  TRP  40           1HE      TRP  40   0.502 -10.539 -14.721
  304    HE3  TRP  40           3HE      TRP  40  -2.393 -13.320 -11.260
  305    HZ2  TRP  40           2HZ      TRP  40   0.726 -13.366 -15.126
  306    HZ3  TRP  40           3HZ      TRP  40  -1.671 -15.473 -12.252
  307    HH2  TRP  40           HH       TRP  40  -0.116 -15.501 -14.182
  308    H    THR  41           H        THR  41  -0.623  -8.817 -10.027
  309    HA   THR  41           HA       THR  41   1.488  -9.551  -8.192
  310    HB   THR  41           HB       THR  41   1.973 -11.129 -10.010
  311    HG1  THR  41           1HG      THR  41   4.075 -10.198 -10.609
  312   1HG2  THR  41          1HG2      THR  41   2.726  -9.205 -12.042
  313   2HG2  THR  41          2HG2      THR  41   1.019  -9.043 -11.630
  314   3HG2  THR  41          3HG2      THR  41   1.652 -10.598 -12.172
  315    H    LEU  42           H        LEU  42  -0.190  -7.242  -8.759
  316    HA   LEU  42           HA       LEU  42   1.810  -5.270  -9.803
  317   1HB   LEU  42          2HB       LEU  42  -1.041  -5.719 -10.084
  318   2HB   LEU  42          1HB       LEU  42  -0.728  -4.088  -9.491
  319    HG   LEU  42           HG       LEU  42   0.955  -5.122 -11.737
  320   1HD1  LEU  42          1HD1      LEU  42  -1.796  -3.926 -12.162
  321   2HD1  LEU  42          2HD1      LEU  42  -1.466  -5.656 -12.272
  322   3HD1  LEU  42          3HD1      LEU  42  -0.692  -4.535 -13.394
  323   1HD2  LEU  42          1HD2      LEU  42   1.044  -2.824 -10.439
  324   2HD2  LEU  42          2HD2      LEU  42  -0.298  -2.403 -11.503
  325   3HD2  LEU  42          3HD2      LEU  42   1.263  -2.856 -12.188
  326    H    SER  43           H        SER  43   1.554  -6.460  -6.970
  327    HA   SER  43           HA       SER  43   1.705  -5.635  -4.761
  328   1HB   SER  43          2HB       SER  43   2.219  -3.024  -6.209
  329   2HB   SER  43          1HB       SER  43   2.838  -3.509  -4.633
  330    HG   SER  43           HG       SER  43   3.800  -4.022  -7.112
  331    H    CYS  44           H        CYS  44   0.848  -3.521  -3.426
  332    HA   CYS  44           HA       CYS  44  -2.046  -3.495  -3.805
  333   1HB   CYS  44          2HB       CYS  44  -0.613  -3.417  -1.638
  334   2HB   CYS  44          1HB       CYS  44  -0.422  -1.700  -1.995
  335    H    TYR  45           H        TYR  45  -3.302  -1.579  -4.364
  336    HA   TYR  45           HA       TYR  45  -1.710   0.681  -5.497
  337   1HB   TYR  45          2HB       TYR  45  -2.478  -1.186  -7.134
  338   2HB   TYR  45          1HB       TYR  45  -4.086  -0.492  -6.928
  339    HD1  TYR  45           1HD      TYR  45  -2.823  -0.492  -9.587
  340    HD2  TYR  45           2HD      TYR  45  -2.467   2.336  -6.371
  341    HE1  TYR  45           1HE      TYR  45  -2.263   1.293 -11.216
  342    HE2  TYR  45           2HE      TYR  45  -1.908   4.119  -8.000
  343    HH   TYR  45           HH       TYR  45  -2.084   4.643 -10.282
  344    H    CYS  46           H        CYS  46  -2.402   2.291  -4.096
  345    HA   CYS  46           HA       CYS  46  -5.367   2.704  -3.851
  346   1HB   CYS  46          2HB       CYS  46  -3.133   3.418  -1.919
  347   2HB   CYS  46          1HB       CYS  46  -4.856   3.659  -1.639
  348    H    GLN  47           H        GLN  47  -6.093   4.793  -4.358
  349    HA   GLN  47           HA       GLN  47  -3.982   6.815  -5.050
  350   1HB   GLN  47          2HB       GLN  47  -6.584   6.467  -6.546
  351   2HB   GLN  47          1HB       GLN  47  -5.099   7.240  -7.097
  352   1HG   GLN  47          2HG       GLN  47  -3.962   5.099  -7.226
  353   2HG   GLN  47          1HG       GLN  47  -5.344   4.277  -6.500
  354   1HE2  GLN  47          1HE2      GLN  47  -7.481   4.544  -7.803
  355   2HE2  GLN  47          2HE2      GLN  47  -7.351   4.532  -9.496
  356    H    GLY  48           H        GLY  48  -4.588   9.011  -4.645
  357   1HA   GLY  48          2HA       GLY  48  -6.159  10.741  -4.006
  358   2HA   GLY  48          1HA       GLY  48  -7.259   9.488  -3.431
  359    H    LEU  49           H        LEU  49  -3.886   9.311  -2.617
  360    HA   LEU  49           HA       LEU  49  -4.608   9.849   0.238
  361   1HB   LEU  49          2HB       LEU  49  -2.141   8.762   0.377
  362   2HB   LEU  49          1HB       LEU  49  -3.591   7.774   0.253
  363    HG   LEU  49           HG       LEU  49  -2.188   8.714  -2.238
  364   1HD1  LEU  49          1HD1      LEU  49  -1.345   6.088  -1.742
  365   2HD1  LEU  49          2HD1      LEU  49  -1.111   6.930  -0.210
  366   3HD1  LEU  49          3HD1      LEU  49  -0.346   7.540  -1.677
  367   1HD2  LEU  49          1HD2      LEU  49  -3.394   6.015  -1.913
  368   2HD2  LEU  49          2HD2      LEU  49  -3.496   7.135  -3.271
  369   3HD2  LEU  49          3HD2      LEU  49  -4.515   7.375  -1.852
  370    HA   PRO  50           HA       PRO  50  -2.098  13.450   0.427
  371   1HB   PRO  50          2HB       PRO  50  -0.460  13.081   2.595
  372   2HB   PRO  50          1HB       PRO  50  -2.195  13.431   2.738
  373   1HG   PRO  50          2HG       PRO  50  -0.772  10.816   2.921
  374   2HG   PRO  50          1HG       PRO  50  -2.106  11.444   3.903
  375   1HD   PRO  50          2HD       PRO  50  -2.489   9.655   1.919
  376   2HD   PRO  50          1HD       PRO  50  -3.701  10.884   2.338
  377    H    ASP  51           H        ASP  51   0.017  14.288  -0.129
  378    HA   ASP  51           HA       ASP  51   1.609  12.689  -1.846
  379   1HB   ASP  51          2HB       ASP  51   1.390  15.220  -1.653
  380   2HB   ASP  51          1HB       ASP  51   2.487  15.127  -0.275
  381    H    ASN  52           H        ASN  52   1.658  13.023   1.620
  382    HA   ASN  52           HA       ASN  52   4.385  11.939   1.921
  383   1HB   ASN  52          2HB       ASN  52   2.839  13.612   3.370
  384   2HB   ASN  52          1HB       ASN  52   2.442  12.093   4.173
  385   1HD2  ASN  52          1HD2      ASN  52   3.658  12.492   6.113
  386   2HD2  ASN  52          2HD2      ASN  52   5.351  12.608   6.122
  387    H    ALA  53           H        ALA  53   1.733  10.495   0.847
  388    HA   ALA  53           HA       ALA  53   1.030   8.348   2.511
  389   1HB   ALA  53          1HB       ALA  53  -0.217   8.499   0.572
  390   2HB   ALA  53          2HB       ALA  53   0.902   7.233   0.069
  391   3HB   ALA  53          3HB       ALA  53   1.184   8.903  -0.419
  392    H    ARG  54           H        ARG  54   1.937   6.315   2.926
  393    HA   ARG  54           HA       ARG  54   4.834   6.029   2.415
  394   1HB   ARG  54          2HB       ARG  54   3.299   5.557   4.555
  395   2HB   ARG  54          1HB       ARG  54   3.149   3.974   3.790
  396   1HG   ARG  54          2HG       ARG  54   5.894   4.757   3.656
  397   2HG   ARG  54          1HG       ARG  54   5.342   4.991   5.314
  398   1HD   ARG  54          2HD       ARG  54   4.904   2.434   3.727
  399   2HD   ARG  54          1HD       ARG  54   6.201   2.668   4.919
  400    HE   ARG  54           HE       ARG  54   4.514   2.873   6.658
  401   1HH1  ARG  54          1HH2      ARG  54   3.685   0.545   4.678
  402   2HH1  ARG  54          2HH2      ARG  54   1.967   0.766   4.701
  403   1HH2  ARG  54          1HH1      ARG  54   2.126   3.898   6.186
  404   2HH2  ARG  54          2HH1      ARG  54   1.084   2.667   5.554
  405    H    ILE  55           H        ILE  55   5.450   5.045   0.523
  406    HA   ILE  55           HA       ILE  55   3.921   2.643  -0.370
  407    HB   ILE  55           HB       ILE  55   4.319   3.652  -2.741
  408   1HG1  ILE  55          2HG1      ILE  55   4.434   6.092  -2.795
  409   2HG1  ILE  55          1HG1      ILE  55   4.460   6.155  -1.031
  410   1HG2  ILE  55          1HG2      ILE  55   2.086   3.790  -2.488
  411   2HG2  ILE  55          2HG2      ILE  55   2.320   5.414  -1.841
  412   3HG2  ILE  55          3HG2      ILE  55   2.248   4.031  -0.749
  413   1HD1  ILE  55          1HD1      ILE  55   6.629   5.346  -0.895
  414   2HD1  ILE  55          2HD1      ILE  55   6.718   6.263  -2.398
  415   3HD1  ILE  55          3HD1      ILE  55   6.524   4.510  -2.444
  416    H    LYS  56           H        LYS  56   5.363   2.093  -2.646
  417    HA   LYS  56           HA       LYS  56   7.495   0.547  -1.977
  418   1HB   LYS  56          2HB       LYS  56   6.563   1.985  -4.308
  419   2HB   LYS  56          1HB       LYS  56   8.325   1.894  -4.315
  420   1HG   LYS  56          2HG       LYS  56   8.184  -0.555  -3.931
  421   2HG   LYS  56          1HG       LYS  56   6.424  -0.446  -3.997
  422   1HD   LYS  56          2HD       LYS  56   6.717  -0.872  -6.215
  423   2HD   LYS  56          1HD       LYS  56   7.111   0.846  -6.304
  424   1HE   LYS  56          2HE       LYS  56   9.032  -0.003  -7.283
  425   2HE   LYS  56          1HE       LYS  56   9.536  -0.119  -5.585
  426   1HZ   LYS  56          1HZ       LYS  56   8.478  -2.227  -7.349
  427   2HZ   LYS  56          2HZ       LYS  56   8.239  -2.339  -5.670
  428   3HZ   LYS  56          3HZ       LYS  56   9.813  -2.279  -6.306
  429    H    ARG  57           H        ARG  57   8.802   1.324  -0.262
  430    HA   ARG  57           HA       ARG  57  10.437   3.771  -0.830
  431   1HB   ARG  57          2HB       ARG  57   8.909   3.508   1.234
  432   2HB   ARG  57          1HB       ARG  57  10.089   2.327   1.804
  433   1HG   ARG  57          2HG       ARG  57  11.769   4.327   1.133
  434   2HG   ARG  57          1HG       ARG  57  10.341   5.277   1.546
  435   1HD   ARG  57          2HD       ARG  57  11.737   3.242   3.320
  436   2HD   ARG  57          1HD       ARG  57  11.631   4.994   3.583
  437    HE   ARG  57           HE       ARG  57   9.300   3.124   3.687
  438   1HH1  ARG  57          1HH2      ARG  57  10.591   4.692   6.028
  439   2HH1  ARG  57          2HH2      ARG  57   9.417   5.949   6.240
  440   1HH2  ARG  57          1HH1      ARG  57   7.870   5.381   3.190
  441   2HH2  ARG  57          2HH1      ARG  57   7.878   6.338   4.634
  442    H    SER  58           H        SER  58  10.518   0.332  -0.396
  443    HA   SER  58           HA       SER  58  13.344   0.206  -1.122
  444   1HB   SER  58          2HB       SER  58  12.361  -0.194   1.695
  445   2HB   SER  58          1HB       SER  58  13.776  -1.076   1.127
  446    HG   SER  58           HG       SER  58  14.337   1.226   0.337
  447    H    GLY  59           H        GLY  59  14.041  -2.100  -1.329
  448   1HA   GLY  59          2HA       GLY  59  11.680  -3.905  -1.670
  449   2HA   GLY  59          1HA       GLY  59  13.108  -3.960  -2.705
  450    H    ARG  60           H        ARG  60  12.857  -3.771   0.856
  451    HA   ARG  60           HA       ARG  60  14.177  -6.452   1.006
  452   1HB   ARG  60          2HB       ARG  60  15.839  -5.551   2.488
  453   2HB   ARG  60          1HB       ARG  60  15.757  -4.451   1.111
  454   1HG   ARG  60          2HG       ARG  60  13.927  -3.248   2.608
  455   2HG   ARG  60          1HG       ARG  60  14.794  -4.051   3.916
  456   1HD   ARG  60          2HD       ARG  60  16.192  -2.375   1.807
  457   2HD   ARG  60          1HD       ARG  60  15.666  -1.730   3.374
  458    HE   ARG  60           HE       ARG  60  17.140  -4.191   3.722
  459   1HH1  ARG  60          1HH2      ARG  60  17.386  -0.796   3.138
  460   2HH1  ARG  60          2HH2      ARG  60  19.000  -0.676   3.751
  461   1HH2  ARG  60          1HH1      ARG  60  19.261  -4.055   4.483
  462   2HH2  ARG  60          2HH1      ARG  60  20.062  -2.519   4.512
  463    H    CYS  61           H        CYS  61  14.155  -7.208   3.392
  464    HA   CYS  61           HA       CYS  61  11.550  -6.414   4.655
  465   1HB   CYS  61          2HB       CYS  61  11.300  -8.633   3.937
  466   2HB   CYS  61          1HB       CYS  61  13.002  -9.004   4.174
  467    H    ARG  62           H        ARG  62  12.248  -4.978   6.291
  468    HA   ARG  62           HA       ARG  62  14.689  -5.573   7.839
  469   1HB   ARG  62          2HB       ARG  62  13.135  -3.328   7.144
  470   2HB   ARG  62          1HB       ARG  62  12.983  -3.486   8.888
  471   1HG   ARG  62          2HG       ARG  62  15.538  -3.813   8.900
  472   2HG   ARG  62          1HG       ARG  62  15.490  -3.154   7.264
  473   1HD   ARG  62          2HD       ARG  62  13.928  -1.597   9.228
  474   2HD   ARG  62          1HD       ARG  62  15.680  -1.605   9.519
  475    HE   ARG  62           HE       ARG  62  15.968  -0.415   7.495
  476   1HH1  ARG  62          1HH2      ARG  62  12.871   0.045   8.123
  477   2HH1  ARG  62          2HH2      ARG  62  12.261  -0.054   6.505
  478   1HH2  ARG  62          1HH1      ARG  62  15.190  -1.381   5.203
  479   2HH2  ARG  62          2HH1      ARG  62  13.576  -0.862   4.849
  480    H    ALA  63           H        ALA  63  12.305  -7.434   7.980
  481    HA   ALA  63           HA       ALA  63  12.270  -7.729  10.895
  482   1HB   ALA  63          1HB       ALA  63   9.547  -7.642  10.404
  483   2HB   ALA  63          2HB       ALA  63  10.164  -6.341   9.385
  484   3HB   ALA  63          3HB       ALA  63  10.487  -6.331  11.118
  Start of MODEL    7
    1   1H    LYS   1          1HT       LYS   1  -1.451  13.748  -2.178
    2   2H    LYS   1          2HT       LYS   1  -2.870  12.997  -1.623
    3   3H    LYS   1          3HT       LYS   1  -2.874  14.654  -1.999
    4    HA   LYS   1           HA       LYS   1  -3.804  12.870  -3.690
    5   1HB   LYS   1          2HB       LYS   1  -3.102  14.612  -5.423
    6   2HB   LYS   1          1HB       LYS   1  -3.912  15.249  -3.991
    7   1HG   LYS   1          2HG       LYS   1  -2.031  16.291  -3.225
    8   2HG   LYS   1          1HG       LYS   1  -0.966  15.000  -3.784
    9   1HD   LYS   1          2HD       LYS   1  -0.501  16.960  -5.120
   10   2HD   LYS   1          1HD       LYS   1  -1.361  15.808  -6.142
   11   1HE   LYS   1          2HE       LYS   1  -3.463  17.005  -5.813
   12   2HE   LYS   1          1HE       LYS   1  -2.684  18.112  -4.665
   13   1HZ   LYS   1          1HZ       LYS   1  -0.994  18.362  -6.630
   14   2HZ   LYS   1          2HZ       LYS   1  -2.419  19.285  -6.594
   15   3HZ   LYS   1          3HZ       LYS   1  -2.326  17.897  -7.570
   16    H    ILE   2           H        ILE   2  -2.120  11.015  -3.172
   17    HA   ILE   2           HA       ILE   2  -0.114  10.990  -5.400
   18    HB   ILE   2           HB       ILE   2   0.829  11.374  -3.082
   19   1HG1  ILE   2          2HG1      ILE   2   1.597   8.712  -4.315
   20   2HG1  ILE   2          1HG1      ILE   2   2.099  10.274  -4.961
   21   1HG2  ILE   2          1HG2      ILE   2   0.833   9.459  -1.535
   22   2HG2  ILE   2          2HG2      ILE   2  -0.164   8.536  -2.660
   23   3HG2  ILE   2          3HG2      ILE   2  -0.818   9.971  -1.873
   24   1HD1  ILE   2          1HD1      ILE   2   2.570   9.868  -2.061
   25   2HD1  ILE   2          2HD1      ILE   2   3.593  10.645  -3.270
   26   3HD1  ILE   2          3HD1      ILE   2   3.556   8.886  -3.144
   27    H    ASP   3           H        ASP   3   0.389   8.787  -6.139
   28    HA   ASP   3           HA       ASP   3  -1.694   6.746  -5.447
   29   1HB   ASP   3          2HB       ASP   3  -1.676   6.278  -7.964
   30   2HB   ASP   3          1HB       ASP   3  -2.412   7.808  -7.482
   31    H    GLY   4           H        GLY   4  -0.710   4.813  -4.950
   32   1HA   GLY   4          2HA       GLY   4   1.471   3.714  -6.446
   33   2HA   GLY   4          1HA       GLY   4   2.105   4.459  -4.981
   34    H    TYR   5           H        TYR   5   2.679   2.029  -4.748
   35    HA   TYR   5           HA       TYR   5   0.405   0.454  -3.627
   36   1HB   TYR   5          2HB       TYR   5   3.263  -0.391  -4.179
   37   2HB   TYR   5          1HB       TYR   5   1.853  -1.432  -4.004
   38    HD1  TYR   5           1HD      TYR   5   3.690  -1.526  -6.387
   39    HD2  TYR   5           2HD      TYR   5   0.150   0.788  -5.644
   40    HE1  TYR   5           1HE      TYR   5   3.277  -1.373  -8.827
   41    HE2  TYR   5           2HE      TYR   5  -0.265   0.941  -8.081
   42    HH   TYR   5           HH       TYR   5   0.455  -0.623 -10.169
   43    HA   PRO   6           HA       PRO   6   2.196   1.745   0.292
   44   1HB   PRO   6          2HB       PRO   6   0.107   0.872   1.828
   45   2HB   PRO   6          1HB       PRO   6   0.078   2.408   0.940
   46   1HG   PRO   6          2HG       PRO   6  -1.204  -0.184   0.278
   47   2HG   PRO   6          1HG       PRO   6  -1.772   1.467  -0.005
   48   1HD   PRO   6          2HD       PRO   6  -0.654  -0.154  -1.930
   49   2HD   PRO   6          1HD       PRO   6  -0.709   1.620  -2.008
   50    H    VAL   7           H        VAL   7   3.377   0.539   1.805
   51    HA   VAL   7           HA       VAL   7   2.886  -2.408   1.972
   52    HB   VAL   7           HB       VAL   7   5.348  -2.711   1.647
   53   1HG1  VAL   7          1HG1      VAL   7   4.774  -1.221  -0.788
   54   2HG1  VAL   7          2HG1      VAL   7   3.383  -2.176  -0.273
   55   3HG1  VAL   7          3HG1      VAL   7   4.935  -2.963  -0.557
   56   1HG2  VAL   7          1HG2      VAL   7   6.786  -0.935   1.245
   57   2HG2  VAL   7          2HG2      VAL   7   5.641  -0.155   2.334
   58   3HG2  VAL   7          3HG2      VAL   7   5.507   0.088   0.593
   59    H    ASP   8           H        ASP   8   4.898  -3.135   3.637
   60    HA   ASP   8           HA       ASP   8   4.145  -2.007   6.190
   61   1HB   ASP   8          2HB       ASP   8   5.882  -3.564   7.009
   62   2HB   ASP   8          1HB       ASP   8   4.877  -4.345   5.790
   63    H    TYR   9           H        TYR   9   6.918  -2.032   7.279
   64    HA   TYR   9           HA       TYR   9   7.647   0.749   6.504
   65   1HB   TYR   9          2HB       TYR   9   7.196  -0.286   8.899
   66   2HB   TYR   9          1HB       TYR   9   8.872  -0.816   8.754
   67    HD1  TYR   9           1HD      TYR   9   6.709   2.217   8.393
   68    HD2  TYR   9           2HD      TYR   9  10.624   0.668   9.242
   69    HE1  TYR   9           1HE      TYR   9   7.483   4.497   8.981
   70    HE2  TYR   9           2HE      TYR   9  11.398   2.949   9.832
   71    HH   TYR   9           HH       TYR   9  10.729   5.057  10.283
   72    H    TRP  10           H        TRP  10   8.694  -2.503   6.059
   73    HA   TRP  10           HA       TRP  10  11.300  -1.498   4.969
   74   1HB   TRP  10          2HB       TRP  10  10.858  -4.102   6.455
   75   2HB   TRP  10          1HB       TRP  10  12.402  -3.396   5.981
   76    HD1  TRP  10           HD       TRP  10  13.261  -1.271   7.349
   77    HE1  TRP  10           1HE      TRP  10  12.665  -0.397   9.699
   78    HE3  TRP  10           3HE      TRP  10   8.958  -3.881   8.189
   79    HZ2  TRP  10           2HZ      TRP  10  10.626  -0.758  11.676
   80    HZ3  TRP  10           3HZ      TRP  10   7.709  -3.600  10.311
   81    HH2  TRP  10           HH       TRP  10   8.537  -2.043  12.053
   82    H    ASN  11           H        ASN  11   8.579  -2.355   3.794
   83    HA   ASN  11           HA       ASN  11   7.873  -3.539   1.871
   84   1HB   ASN  11          2HB       ASN  11  10.822  -3.198   1.712
   85   2HB   ASN  11          1HB       ASN  11  10.125  -4.391   0.616
   86   1HD2  ASN  11          1HD2      ASN  11  10.307  -3.140  -1.328
   87   2HD2  ASN  11          2HD2      ASN  11   9.450  -1.695  -1.572
   88    H    CYS  12           H        CYS  12   8.911  -4.943   4.540
   89    HA   CYS  12           HA       CYS  12   9.541  -7.651   3.609
   90   1HB   CYS  12          2HB       CYS  12   8.901  -6.456   6.322
   91   2HB   CYS  12          1HB       CYS  12   9.514  -8.089   6.065
   92    H    LYS  13           H        LYS  13   7.086  -6.771   6.012
   93    HA   LYS  13           HA       LYS  13   5.282  -8.839   4.883
   94   1HB   LYS  13          2HB       LYS  13   5.787  -7.476   7.458
   95   2HB   LYS  13          1HB       LYS  13   4.097  -7.870   7.139
   96   1HG   LYS  13          2HG       LYS  13   4.461 -10.123   7.257
   97   2HG   LYS  13          1HG       LYS  13   6.055 -10.005   6.508
   98   1HD   LYS  13          2HD       LYS  13   6.788  -8.869   8.711
   99   2HD   LYS  13          1HD       LYS  13   5.298  -9.527   9.386
  100   1HE   LYS  13          2HE       LYS  13   6.040 -11.808   8.529
  101   2HE   LYS  13          1HE       LYS  13   7.618 -11.071   8.190
  102   1HZ   LYS  13          1HZ       LYS  13   6.238 -11.352  10.788
  103   2HZ   LYS  13          2HZ       LYS  13   7.429 -10.162  10.557
  104   3HZ   LYS  13          3HZ       LYS  13   7.820 -11.806  10.378
  105    H    ARG  14           H        ARG  14   2.820  -7.940   5.609
  106    HA   ARG  14           HA       ARG  14   1.035  -6.585   4.887
  107   1HB   ARG  14          2HB       ARG  14   2.287  -4.998   6.319
  108   2HB   ARG  14          1HB       ARG  14   3.259  -4.522   4.926
  109   1HG   ARG  14          2HG       ARG  14   1.636  -2.880   4.831
  110   2HG   ARG  14          1HG       ARG  14   0.859  -4.118   3.843
  111   1HD   ARG  14          2HD       ARG  14  -0.793  -3.383   5.444
  112   2HD   ARG  14          1HD       ARG  14  -0.225  -4.965   6.013
  113    HE   ARG  14           HE       ARG  14   1.471  -2.907   7.069
  114   1HH1  ARG  14          1HH2      ARG  14  -1.217  -4.913   7.639
  115   2HH1  ARG  14          2HH2      ARG  14  -1.620  -4.200   9.164
  116   1HH2  ARG  14          1HH1      ARG  14   0.758  -1.688   8.916
  117   2HH2  ARG  14          2HH1      ARG  14  -0.501  -2.373   9.887
  118    H    ILE  15           H        ILE  15   2.860  -4.288   3.115
  119    HA   ILE  15           HA       ILE  15   3.036  -3.892   0.797
  120    HB   ILE  15           HB       ILE  15   3.266  -6.910   0.988
  121   1HG1  ILE  15          2HG1      ILE  15   5.417  -4.856   0.436
  122   2HG1  ILE  15          1HG1      ILE  15   4.983  -5.334   2.078
  123   1HG2  ILE  15          1HG2      ILE  15   3.889  -7.013  -1.269
  124   2HG2  ILE  15          2HG2      ILE  15   4.215  -5.282  -1.359
  125   3HG2  ILE  15          3HG2      ILE  15   2.552  -5.865  -1.305
  126   1HD1  ILE  15          1HD1      ILE  15   6.458  -6.840   0.007
  127   2HD1  ILE  15          2HD1      ILE  15   5.241  -7.775   0.876
  128   3HD1  ILE  15          3HD1      ILE  15   6.535  -6.972   1.764
  129    H    CYS  16           H        CYS  16   1.406  -7.007   0.484
  130    HA   CYS  16           HA       CYS  16  -1.117  -5.615  -0.318
  131   1HB   CYS  16          2HB       CYS  16   0.191  -6.073  -2.326
  132   2HB   CYS  16          1HB       CYS  16   0.433  -7.745  -1.826
  133    H    TRP  17           H        TRP  17  -2.643  -6.451   1.063
  134    HA   TRP  17           HA       TRP  17  -2.359  -8.936   2.486
  135   1HB   TRP  17          2HB       TRP  17  -4.014  -6.656   2.443
  136   2HB   TRP  17          1HB       TRP  17  -5.095  -8.018   2.151
  137    HD1  TRP  17           HD       TRP  17  -3.214 -10.075   3.895
  138    HE1  TRP  17           1HE      TRP  17  -3.417  -9.968   6.463
  139    HE3  TRP  17           3HE      TRP  17  -5.240  -5.416   4.429
  140    HZ2  TRP  17           2HZ      TRP  17  -4.320  -8.149   8.477
  141    HZ3  TRP  17           3HZ      TRP  17  -5.761  -4.523   6.682
  142    HH2  TRP  17           HH       TRP  17  -5.304  -5.882   8.705
  143    H    TYR  18           H        TYR  18  -5.132  -9.875   2.003
  144    HA   TYR  18           HA       TYR  18  -4.945 -10.918  -0.790
  145   1HB   TYR  18          2HB       TYR  18  -4.200 -12.293   1.556
  146   2HB   TYR  18          1HB       TYR  18  -5.769 -12.958   1.101
  147    HD1  TYR  18           1HD      TYR  18  -5.653 -14.841  -0.259
  148    HD2  TYR  18           2HD      TYR  18  -2.700 -11.754  -0.706
  149    HE1  TYR  18           1HE      TYR  18  -4.580 -16.130  -2.086
  150    HE2  TYR  18           2HE      TYR  18  -1.627 -13.043  -2.532
  151    HH   TYR  18           HH       TYR  18  -2.217 -16.257  -3.103
  152    H    ASN  19           H        ASN  19  -6.753  -9.024  -0.365
  153    HA   ASN  19           HA       ASN  19  -9.326 -10.448  -0.469
  154   1HB   ASN  19          2HB       ASN  19  -8.304  -9.217   1.928
  155   2HB   ASN  19          1HB       ASN  19  -9.739  -8.341   1.390
  156   1HD2  ASN  19          1HD2      ASN  19  -8.791 -10.980   3.238
  157   2HD2  ASN  19          2HD2      ASN  19 -10.233 -11.874   3.181
  158    H    ASN  20           H        ASN  20 -11.119  -8.537  -0.595
  159    HA   ASN  20           HA       ASN  20 -10.209  -6.799  -2.807
  160   1HB   ASN  20          2HB       ASN  20 -12.264  -8.186  -2.921
  161   2HB   ASN  20          1HB       ASN  20 -12.930  -7.287  -1.558
  162   1HD2  ASN  20          1HD2      ASN  20 -13.911  -5.267  -1.998
  163   2HD2  ASN  20          2HD2      ASN  20 -13.945  -4.551  -3.538
  164    H    LYS  21           H        LYS  21 -11.664  -6.452   0.443
  165    HA   LYS  21           HA       LYS  21 -11.172  -3.500   0.265
  166   1HB   LYS  21          2HB       LYS  21 -13.172  -5.288   1.581
  167   2HB   LYS  21          1HB       LYS  21 -12.782  -3.767   2.386
  168   1HG   LYS  21          2HG       LYS  21 -13.103  -2.774  -0.049
  169   2HG   LYS  21          1HG       LYS  21 -14.082  -4.224  -0.273
  170   1HD   LYS  21          2HD       LYS  21 -14.523  -2.632   2.215
  171   2HD   LYS  21          1HD       LYS  21 -15.132  -1.966   0.700
  172   1HE   LYS  21          2HE       LYS  21 -16.952  -3.294   1.076
  173   2HE   LYS  21          1HE       LYS  21 -15.906  -4.630   0.552
  174   1HZ   LYS  21          1HZ       LYS  21 -16.394  -3.662   3.308
  175   2HZ   LYS  21          2HZ       LYS  21 -15.046  -4.619   2.920
  176   3HZ   LYS  21          3HZ       LYS  21 -16.616  -5.227   2.694
  177    H    TYR  22           H        TYR  22  -9.767  -6.258   1.525
  178    HA   TYR  22           HA       TYR  22  -9.136  -5.629   4.212
  179   1HB   TYR  22          2HB       TYR  22  -8.145  -7.309   2.018
  180   2HB   TYR  22          1HB       TYR  22  -6.875  -6.838   3.149
  181    HD1  TYR  22           1HD      TYR  22  -6.491  -8.439   4.786
  182    HD2  TYR  22           2HD      TYR  22 -10.514  -7.725   3.463
  183    HE1  TYR  22           1HE      TYR  22  -7.324 -10.099   6.430
  184    HE2  TYR  22           2HE      TYR  22 -11.350  -9.385   5.106
  185    HH   TYR  22           HH       TYR  22 -10.752 -11.009   6.543
  186    H    CYS  23           H        CYS  23  -7.247  -4.853   1.261
  187    HA   CYS  23           HA       CYS  23  -5.403  -3.125   2.727
  188   1HB   CYS  23          2HB       CYS  23  -5.172  -4.566   0.526
  189   2HB   CYS  23          1HB       CYS  23  -5.805  -3.116  -0.253
  190    H    ASN  24           H        ASN  24  -8.524  -2.738   1.335
  191    HA   ASN  24           HA       ASN  24  -8.314   0.091   0.649
  192   1HB   ASN  24          2HB       ASN  24  -9.931  -1.432  -0.396
  193   2HB   ASN  24          1HB       ASN  24 -10.646  -1.787   1.178
  194   1HD2  ASN  24          1HD2      ASN  24  -9.670   1.330  -0.363
  195   2HD2  ASN  24          2HD2      ASN  24 -11.185   2.068  -0.161
  196    H    ASP  25           H        ASP  25  -9.568  -1.764   3.439
  197    HA   ASP  25           HA       ASP  25 -10.634   0.426   4.916
  198   1HB   ASP  25          2HB       ASP  25  -9.457  -2.272   5.595
  199   2HB   ASP  25          1HB       ASP  25 -10.073  -1.205   6.859
  200    H    LEU  26           H        LEU  26  -7.349  -0.944   4.801
  201    HA   LEU  26           HA       LEU  26  -6.264   0.836   6.829
  202   1HB   LEU  26          2HB       LEU  26  -5.487  -1.395   5.167
  203   2HB   LEU  26          1HB       LEU  26  -4.249  -0.140   5.083
  204    HG   LEU  26           HG       LEU  26  -5.413  -1.053   7.716
  205   1HD1  LEU  26          1HD1      LEU  26  -3.869  -2.630   5.951
  206   2HD1  LEU  26          2HD1      LEU  26  -4.207  -2.956   7.651
  207   3HD1  LEU  26          3HD1      LEU  26  -2.756  -2.063   7.195
  208   1HD2  LEU  26          1HD2      LEU  26  -3.936   0.411   8.605
  209   2HD2  LEU  26          2HD2      LEU  26  -3.741   1.051   6.974
  210   3HD2  LEU  26          3HD2      LEU  26  -2.629  -0.178   7.577
  211    H    CYS  27           H        CYS  27  -6.163   0.756   3.254
  212    HA   CYS  27           HA       CYS  27  -4.550   3.070   2.869
  213   1HB   CYS  27          2HB       CYS  27  -6.445   1.361   1.359
  214   2HB   CYS  27          1HB       CYS  27  -6.188   2.971   0.691
  215    H    LYS  28           H        LYS  28  -8.095   2.697   3.067
  216    HA   LYS  28           HA       LYS  28  -8.793   5.427   2.643
  217   1HB   LYS  28          2HB       LYS  28 -10.072   3.280   4.374
  218   2HB   LYS  28          1HB       LYS  28 -10.887   4.729   3.783
  219   1HG   LYS  28          2HG       LYS  28  -9.529   3.055   1.737
  220   2HG   LYS  28          1HG       LYS  28 -10.980   2.372   2.472
  221   1HD   LYS  28          2HD       LYS  28 -10.953   5.207   1.453
  222   2HD   LYS  28          1HD       LYS  28 -11.272   3.856   0.365
  223   1HE   LYS  28          2HE       LYS  28 -13.398   3.690   1.127
  224   2HE   LYS  28          1HE       LYS  28 -12.827   3.577   2.803
  225   1HZ   LYS  28          1HZ       LYS  28 -12.559   6.175   1.527
  226   2HZ   LYS  28          2HZ       LYS  28 -13.005   5.790   3.121
  227   3HZ   LYS  28          3HZ       LYS  28 -14.148   5.690   1.867
  228    H    GLY  29           H        GLY  29  -7.627   3.696   5.481
  229   1HA   GLY  29          2HA       GLY  29  -8.286   5.570   7.502
  230   2HA   GLY  29          1HA       GLY  29  -6.885   4.496   7.560
  231    H    LEU  30           H        LEU  30  -5.656   5.516   5.144
  232    HA   LEU  30           HA       LEU  30  -4.339   7.877   6.286
  233   1HB   LEU  30          2HB       LEU  30  -4.048   6.238   3.750
  234   2HB   LEU  30          1HB       LEU  30  -3.005   7.611   4.126
  235    HG   LEU  30           HG       LEU  30  -3.361   5.523   6.231
  236   1HD1  LEU  30          1HD1      LEU  30  -2.841   3.948   4.626
  237   2HD1  LEU  30          2HD1      LEU  30  -1.211   4.505   5.009
  238   3HD1  LEU  30          3HD1      LEU  30  -2.043   5.123   3.582
  239   1HD2  LEU  30          1HD2      LEU  30  -1.737   7.797   5.761
  240   2HD2  LEU  30          2HD2      LEU  30  -0.670   6.397   5.663
  241   3HD2  LEU  30          3HD2      LEU  30  -1.634   6.671   7.114
  242    H    LYS  31           H        LYS  31  -6.684   7.124   3.823
  243    HA   LYS  31           HA       LYS  31  -8.319   9.081   3.412
  244   1HB   LYS  31          2HB       LYS  31  -6.689  10.820   3.903
  245   2HB   LYS  31          1HB       LYS  31  -5.655  10.276   2.581
  246   1HG   LYS  31          2HG       LYS  31  -6.855  11.441   1.060
  247   2HG   LYS  31          1HG       LYS  31  -8.381  10.816   1.689
  248   1HD   LYS  31          2HD       LYS  31  -8.561  12.523   3.302
  249   2HD   LYS  31          1HD       LYS  31  -6.850  12.936   3.187
  250   1HE   LYS  31          2HE       LYS  31  -7.401  13.557   0.708
  251   2HE   LYS  31          1HE       LYS  31  -9.083  13.613   1.276
  252   1HZ   LYS  31          1HZ       LYS  31  -8.452  15.699   1.873
  253   2HZ   LYS  31          2HZ       LYS  31  -6.811  15.289   2.034
  254   3HZ   LYS  31          3HZ       LYS  31  -7.916  14.885   3.260
  255    H    ALA  32           H        ALA  32  -6.496   6.752   2.040
  256    HA   ALA  32           HA       ALA  32  -6.875   7.403  -0.796
  257   1HB   ALA  32          1HB       ALA  32  -5.533   5.436   0.902
  258   2HB   ALA  32          2HB       ALA  32  -5.102   5.989  -0.715
  259   3HB   ALA  32          3HB       ALA  32  -6.279   4.692  -0.513
  260    H    ASP  33           H        ASP  33  -8.942   7.295  -1.609
  261    HA   ASP  33           HA       ASP  33 -11.041   5.693  -0.405
  262   1HB   ASP  33          2HB       ASP  33 -10.756   7.837  -2.198
  263   2HB   ASP  33          1HB       ASP  33 -11.505   6.548  -3.142
  264    H    SER  34           H        SER  34  -9.634   5.550  -3.687
  265    HA   SER  34           HA       SER  34 -10.576   2.802  -4.074
  266   1HB   SER  34          2HB       SER  34 -10.119   4.899  -5.696
  267   2HB   SER  34          1HB       SER  34  -8.553   4.106  -5.844
  268    HG   SER  34           HG       SER  34 -10.802   3.475  -7.050
  269    H    GLY  35           H        GLY  35  -9.357   1.804  -2.238
  270   1HA   GLY  35          2HA       GLY  35  -6.467   1.430  -2.917
  271   2HA   GLY  35          1HA       GLY  35  -7.052   1.480  -1.255
  272    H    TYR  36           H        TYR  36  -6.468  -0.538  -3.959
  273    HA   TYR  36           HA       TYR  36  -7.750  -2.833  -2.509
  274   1HB   TYR  36          2HB       TYR  36  -8.158  -3.758  -4.803
  275   2HB   TYR  36          1HB       TYR  36  -8.992  -2.227  -4.533
  276    HD1  TYR  36           1HD      TYR  36  -6.359  -3.944  -6.388
  277    HD2  TYR  36           2HD      TYR  36  -8.092  -0.118  -5.495
  278    HE1  TYR  36           1HE      TYR  36  -5.166  -2.952  -8.323
  279    HE2  TYR  36           2HE      TYR  36  -6.898   0.875  -7.428
  280    HH   TYR  36           HH       TYR  36  -5.828   0.295  -9.419
  281    H    CYS  37           H        CYS  37  -6.687  -4.966  -3.651
  282    HA   CYS  37           HA       CYS  37  -3.727  -4.551  -3.462
  283   1HB   CYS  37          2HB       CYS  37  -5.548  -6.220  -2.122
  284   2HB   CYS  37          1HB       CYS  37  -4.681  -7.286  -3.229
  285    H    TRP  38           H        TRP  38  -2.383  -5.524  -5.067
  286    HA   TRP  38           HA       TRP  38  -3.659  -5.975  -7.666
  287   1HB   TRP  38          2HB       TRP  38  -1.348  -4.895  -6.945
  288   2HB   TRP  38          1HB       TRP  38  -0.781  -6.564  -7.039
  289    HD1  TRP  38           HD       TRP  38  -0.090  -7.370  -9.344
  290    HE1  TRP  38           1HE      TRP  38  -0.470  -6.579 -11.769
  291    HE3  TRP  38           3HE      TRP  38  -3.325  -3.509  -8.512
  292    HZ2  TRP  38           2HZ      TRP  38  -1.953  -4.574 -13.168
  293    HZ3  TRP  38           3HZ      TRP  38  -4.206  -2.177 -10.407
  294    HH2  TRP  38           HH       TRP  38  -3.525  -2.704 -12.732
  295    H    GLY  39           H        GLY  39  -3.081  -8.006  -8.935
  296   1HA   GLY  39          2HA       GLY  39  -2.947 -10.380  -7.120
  297   2HA   GLY  39          1HA       GLY  39  -4.051 -10.323  -8.493
  298    H    TRP  40           H        TRP  40  -0.593  -9.575  -8.018
  299    HA   TRP  40           HA       TRP  40   0.198 -11.689  -9.896
  300   1HB   TRP  40          2HB       TRP  40  -0.429 -10.110 -11.535
  301   2HB   TRP  40          1HB       TRP  40   0.113  -8.751 -10.560
  302    HD1  TRP  40           HD       TRP  40   2.078  -7.693 -11.734
  303    HE1  TRP  40           1HE      TRP  40   4.221  -8.546 -12.875
  304    HE3  TRP  40           3HE      TRP  40   1.314 -12.729 -11.405
  305    HZ2  TRP  40           2HZ      TRP  40   5.459 -11.033 -13.559
  306    HZ3  TRP  40           3HZ      TRP  40   2.988 -14.318 -12.308
  307    HH2  TRP  40           HH       TRP  40   5.059 -13.476 -13.383
  308    H    THR  41           H        THR  41   1.578  -8.539  -8.990
  309    HA   THR  41           HA       THR  41   3.309  -9.504  -6.920
  310    HB   THR  41           HB       THR  41   4.098 -10.700  -9.075
  311    HG1  THR  41           1HG      THR  41   5.671  -9.187  -7.321
  312   1HG2  THR  41          1HG2      THR  41   3.999  -8.183 -10.139
  313   2HG2  THR  41          2HG2      THR  41   4.957  -9.504 -10.807
  314   3HG2  THR  41          3HG2      THR  41   5.712  -8.321  -9.739
  315    H    LEU  42           H        LEU  42   1.676  -7.133  -7.726
  316    HA   LEU  42           HA       LEU  42   3.831  -5.041  -7.781
  317   1HB   LEU  42          2HB       LEU  42   1.036  -5.265  -8.850
  318   2HB   LEU  42          1HB       LEU  42   1.695  -3.667  -8.505
  319    HG   LEU  42           HG       LEU  42   3.580  -5.392  -9.940
  320   1HD1  LEU  42          1HD1      LEU  42   1.127  -4.471 -11.455
  321   2HD1  LEU  42          2HD1      LEU  42   1.299  -6.117 -10.845
  322   3HD1  LEU  42          3HD1      LEU  42   2.440  -5.495 -12.036
  323   1HD2  LEU  42          1HD2      LEU  42   3.636  -3.313 -11.390
  324   2HD2  LEU  42          2HD2      LEU  42   3.987  -3.027  -9.686
  325   3HD2  LEU  42          3HD2      LEU  42   2.398  -2.628 -10.337
  326    H    SER  43           H        SER  43   2.484  -6.544  -5.413
  327    HA   SER  43           HA       SER  43   1.813  -5.959  -3.224
  328   1HB   SER  43          2HB       SER  43   3.866  -4.515  -3.714
  329   2HB   SER  43          1HB       SER  43   2.743  -3.203  -4.059
  330    HG   SER  43           HG       SER  43   3.626  -3.558  -1.795
  331    H    CYS  44           H        CYS  44   0.627  -3.771  -2.136
  332    HA   CYS  44           HA       CYS  44  -2.054  -3.827  -3.229
  333   1HB   CYS  44          2HB       CYS  44  -1.293  -3.591  -0.811
  334   2HB   CYS  44          1HB       CYS  44  -0.846  -1.929  -1.197
  335    H    TYR  45           H        TYR  45  -3.219  -1.625  -3.640
  336    HA   TYR  45           HA       TYR  45  -1.467   0.433  -4.854
  337   1HB   TYR  45          2HB       TYR  45  -1.860  -1.343  -6.560
  338   2HB   TYR  45          1HB       TYR  45  -3.595  -1.089  -6.389
  339    HD1  TYR  45           1HD      TYR  45  -1.985   2.004  -5.875
  340    HD2  TYR  45           2HD      TYR  45  -3.115  -0.719  -9.001
  341    HE1  TYR  45           1HE      TYR  45  -1.880   3.852  -7.524
  342    HE2  TYR  45           2HE      TYR  45  -3.009   1.130 -10.649
  343    HH   TYR  45           HH       TYR  45  -3.031   4.297  -9.863
  344    H    CYS  46           H        CYS  46  -2.291   2.209  -3.803
  345    HA   CYS  46           HA       CYS  46  -5.269   2.577  -3.850
  346   1HB   CYS  46          2HB       CYS  46  -3.237   3.397  -1.744
  347   2HB   CYS  46          1HB       CYS  46  -4.968   3.725  -1.670
  348    H    GLN  47           H        GLN  47  -5.943   4.557  -4.658
  349    HA   GLN  47           HA       GLN  47  -3.799   6.557  -5.309
  350   1HB   GLN  47          2HB       GLN  47  -6.245   5.552  -6.769
  351   2HB   GLN  47          1HB       GLN  47  -5.527   7.109  -7.182
  352   1HG   GLN  47          2HG       GLN  47  -3.786   6.136  -8.246
  353   2HG   GLN  47          1HG       GLN  47  -3.530   4.985  -6.934
  354   1HE2  GLN  47          1HE2      GLN  47  -5.173   3.103  -6.879
  355   2HE2  GLN  47          2HE2      GLN  47  -5.725   2.507  -8.369
  356    H    GLY  48           H        GLY  48  -4.142   8.590  -4.455
  357   1HA   GLY  48          2HA       GLY  48  -5.673  10.467  -3.990
  358   2HA   GLY  48          1HA       GLY  48  -6.905   9.282  -3.552
  359    H    LEU  49           H        LEU  49  -3.490   9.337  -2.581
  360    HA   LEU  49           HA       LEU  49  -4.411   9.583   0.266
  361   1HB   LEU  49          2HB       LEU  49  -2.023   8.306   0.445
  362   2HB   LEU  49          1HB       LEU  49  -3.547   7.449   0.252
  363    HG   LEU  49           HG       LEU  49  -1.963   8.360  -2.150
  364   1HD1  LEU  49          1HD1      LEU  49  -1.054   6.517  -0.197
  365   2HD1  LEU  49          2HD1      LEU  49  -0.375   6.801  -1.801
  366   3HD1  LEU  49          3HD1      LEU  49  -1.606   5.559  -1.572
  367   1HD2  LEU  49          1HD2      LEU  49  -3.489   5.822  -2.089
  368   2HD2  LEU  49          2HD2      LEU  49  -3.448   7.079  -3.326
  369   3HD2  LEU  49          3HD2      LEU  49  -4.462   7.281  -1.897
  370    HA   PRO  50           HA       PRO  50  -1.655  12.943   0.851
  371   1HB   PRO  50          2HB       PRO  50  -0.198  12.288   3.082
  372   2HB   PRO  50          1HB       PRO  50  -1.906  12.770   3.144
  373   1HG   PRO  50          2HG       PRO  50  -0.709  10.038   3.213
  374   2HG   PRO  50          1HG       PRO  50  -2.050  10.706   4.161
  375   1HD   PRO  50          2HD       PRO  50  -2.454   9.100   2.031
  376   2HD   PRO  50          1HD       PRO  50  -3.579  10.405   2.464
  377    H    ASP  51           H        ASP  51   0.562  13.643   0.518
  378    HA   ASP  51           HA       ASP  51   2.136  12.016  -1.213
  379   1HB   ASP  51          2HB       ASP  51   2.142  14.495  -1.073
  380   2HB   ASP  51          1HB       ASP  51   2.914  14.392   0.511
  381    H    ASN  52           H        ASN  52   1.974  12.136   2.258
  382    HA   ASN  52           HA       ASN  52   4.628  10.893   2.633
  383   1HB   ASN  52          2HB       ASN  52   3.417  12.633   4.116
  384   2HB   ASN  52          1HB       ASN  52   2.435  11.278   4.675
  385   1HD2  ASN  52          1HD2      ASN  52   5.946  11.381   3.872
  386   2HD2  ASN  52          2HD2      ASN  52   6.462  10.864   5.404
  387    H    ALA  53           H        ALA  53   1.949   9.664   1.367
  388    HA   ALA  53           HA       ALA  53   1.238   7.418   3.006
  389   1HB   ALA  53          1HB       ALA  53  -0.299   7.767   1.339
  390   2HB   ALA  53          2HB       ALA  53   0.716   6.625   0.458
  391   3HB   ALA  53          3HB       ALA  53   0.918   8.359   0.208
  392    H    ARG  54           H        ARG  54   2.796   5.956   3.659
  393    HA   ARG  54           HA       ARG  54   5.265   5.406   2.374
  394   1HB   ARG  54          2HB       ARG  54   3.591   4.386   4.530
  395   2HB   ARG  54          1HB       ARG  54   4.460   3.082   3.722
  396   1HG   ARG  54          2HG       ARG  54   6.349   5.132   3.960
  397   2HG   ARG  54          1HG       ARG  54   5.487   5.146   5.499
  398   1HD   ARG  54          2HD       ARG  54   6.837   3.411   6.089
  399   2HD   ARG  54          1HD       ARG  54   5.864   2.426   4.978
  400    HE   ARG  54           HE       ARG  54   8.422   3.787   4.253
  401   1HH1  ARG  54          1HH2      ARG  54   7.533   0.742   4.363
  402   2HH1  ARG  54          2HH2      ARG  54   7.542   0.398   2.666
  403   1HH2  ARG  54          1HH1      ARG  54   7.697   3.732   1.722
  404   2HH2  ARG  54          2HH1      ARG  54   7.635   2.092   1.170
  405    H    ILE  55           H        ILE  55   5.811   4.061   0.673
  406    HA   ILE  55           HA       ILE  55   3.934   1.973  -0.247
  407    HB   ILE  55           HB       ILE  55   4.109   3.081  -2.602
  408   1HG1  ILE  55          2HG1      ILE  55   4.370   5.524  -2.541
  409   2HG1  ILE  55          1HG1      ILE  55   4.671   5.462  -0.804
  410   1HG2  ILE  55          1HG2      ILE  55   2.093   4.351  -2.185
  411   2HG2  ILE  55          2HG2      ILE  55   2.487   4.503  -0.474
  412   3HG2  ILE  55          3HG2      ILE  55   2.058   2.929  -1.142
  413   1HD1  ILE  55          1HD1      ILE  55   6.778   4.551  -1.058
  414   2HD1  ILE  55          2HD1      ILE  55   6.683   5.497  -2.544
  415   3HD1  ILE  55          3HD1      ILE  55   6.367   3.763  -2.581
  416    H    LYS  56           H        LYS  56   5.041   1.302  -2.629
  417    HA   LYS  56           HA       LYS  56   7.347  -0.164  -2.054
  418   1HB   LYS  56          2HB       LYS  56   7.590  -0.236  -4.533
  419   2HB   LYS  56          1HB       LYS  56   5.914  -0.450  -4.026
  420   1HG   LYS  56          2HG       LYS  56   5.935   2.227  -4.252
  421   2HG   LYS  56          1HG       LYS  56   7.188   1.844  -5.434
  422   1HD   LYS  56          2HD       LYS  56   5.086  -0.017  -5.845
  423   2HD   LYS  56          1HD       LYS  56   4.336   1.573  -5.697
  424   1HE   LYS  56          2HE       LYS  56   4.897   1.821  -7.898
  425   2HE   LYS  56          1HE       LYS  56   6.542   2.097  -7.293
  426   1HZ   LYS  56          1HZ       LYS  56   5.335  -0.407  -8.284
  427   2HZ   LYS  56          2HZ       LYS  56   6.640  -0.458  -7.198
  428   3HZ   LYS  56          3HZ       LYS  56   6.817   0.299  -8.709
  429    H    ARG  57           H        ARG  57   8.865   1.157  -0.868
  430    HA   ARG  57           HA       ARG  57  10.280   3.209  -2.541
  431   1HB   ARG  57          2HB       ARG  57   8.937   3.789  -0.360
  432   2HB   ARG  57          1HB       ARG  57  10.333   3.098   0.466
  433   1HG   ARG  57          2HG       ARG  57  11.710   4.659  -1.131
  434   2HG   ARG  57          1HG       ARG  57  10.189   5.540  -1.278
  435   1HD   ARG  57          2HD       ARG  57  10.317   5.186   1.435
  436   2HD   ARG  57          1HD       ARG  57  12.033   5.369   1.023
  437    HE   ARG  57           HE       ARG  57  11.541   7.542   0.075
  438   1HH1  ARG  57          1HH2      ARG  57   8.585   6.019   0.024
  439   2HH1  ARG  57          2HH2      ARG  57   7.674   7.348   0.659
  440   1HH2  ARG  57          1HH1      ARG  57  10.475   9.217   1.485
  441   2HH2  ARG  57          2HH1      ARG  57   8.745   9.159   1.487
  442    H    SER  58           H        SER  58  10.512   0.150  -1.154
  443    HA   SER  58           HA       SER  58  13.506   0.323  -1.051
  444   1HB   SER  58          2HB       SER  58  11.585  -1.486   0.444
  445   2HB   SER  58          1HB       SER  58  13.337  -1.471   0.632
  446    HG   SER  58           HG       SER  58  11.416   0.271   1.578
  447    H    GLY  59           H        GLY  59  14.339  -2.143  -1.296
  448   1HA   GLY  59          2HA       GLY  59  12.936  -3.267  -3.689
  449   2HA   GLY  59          1HA       GLY  59  14.691  -3.258  -3.525
  450    H    ARG  60           H        ARG  60  14.748  -4.000  -0.731
  451    HA   ARG  60           HA       ARG  60  13.595  -6.765  -0.838
  452   1HB   ARG  60          2HB       ARG  60  15.717  -7.648  -0.188
  453   2HB   ARG  60          1HB       ARG  60  16.077  -6.474  -1.454
  454   1HG   ARG  60          2HG       ARG  60  16.275  -4.794   0.567
  455   2HG   ARG  60          1HG       ARG  60  16.534  -6.265   1.504
  456   1HD   ARG  60          2HD       ARG  60  18.148  -6.600  -0.767
  457   2HD   ARG  60          1HD       ARG  60  18.378  -4.906  -0.288
  458    HE   ARG  60           HE       ARG  60  19.228  -5.645   1.822
  459   1HH1  ARG  60          1HH2      ARG  60  17.353  -7.749   2.586
  460   2HH1  ARG  60          2HH2      ARG  60  18.272  -9.204   2.391
  461   1HH2  ARG  60          1HH1      ARG  60  20.695  -7.721   0.402
  462   2HH2  ARG  60          2HH1      ARG  60  20.164  -9.187   1.154
  463    H    CYS  61           H        CYS  61  13.204  -7.699   1.276
  464    HA   CYS  61           HA       CYS  61  11.965  -6.169   3.220
  465   1HB   CYS  61          2HB       CYS  61  11.979  -8.619   3.124
  466   2HB   CYS  61          1HB       CYS  61  13.694  -8.648   3.534
  467    H    ARG  62           H        ARG  62  12.781  -4.403   4.292
  468    HA   ARG  62           HA       ARG  62  15.680  -4.194   4.857
  469   1HB   ARG  62          2HB       ARG  62  13.404  -2.470   4.411
  470   2HB   ARG  62          1HB       ARG  62  14.203  -2.024   5.919
  471   1HG   ARG  62          2HG       ARG  62  16.121  -2.605   3.798
  472   2HG   ARG  62          1HG       ARG  62  15.025  -1.294   3.359
  473   1HD   ARG  62          2HD       ARG  62  15.954  -1.079   6.132
  474   2HD   ARG  62          1HD       ARG  62  17.280  -1.009   4.953
  475    HE   ARG  62           HE       ARG  62  16.437   1.090   4.300
  476   1HH1  ARG  62          1HH2      ARG  62  14.522   0.527   6.806
  477   2HH1  ARG  62          2HH2      ARG  62  13.035   1.092   6.120
  478   1HH2  ARG  62          1HH1      ARG  62  14.267   1.213   2.881
  479   2HH2  ARG  62          2HH1      ARG  62  12.891   1.480   3.898
  480    H    ALA  63           H        ALA  63  14.564  -6.280   6.347
  481    HA   ALA  63           HA       ALA  63  15.196  -5.501   9.055
  482   1HB   ALA  63          1HB       ALA  63  12.740  -6.005   9.811
  483   2HB   ALA  63          2HB       ALA  63  12.329  -5.641   8.135
  484   3HB   ALA  63          3HB       ALA  63  13.107  -4.417   9.138
  Start of MODEL    8
    1   1H    LYS   1          1HT       LYS   1  -1.808  13.625  -2.591
    2   2H    LYS   1          2HT       LYS   1  -3.280  14.283  -2.055
    3   3H    LYS   1          3HT       LYS   1  -2.421  15.031  -3.316
    4    HA   LYS   1           HA       LYS   1  -4.147  12.675  -3.389
    5   1HB   LYS   1          2HB       LYS   1  -4.926  14.748  -4.290
    6   2HB   LYS   1          1HB       LYS   1  -3.389  15.054  -5.099
    7   1HG   LYS   1          2HG       LYS   1  -3.828  13.554  -6.808
    8   2HG   LYS   1          1HG       LYS   1  -4.883  12.558  -5.804
    9   1HD   LYS   1          2HD       LYS   1  -6.246  14.940  -5.838
   10   2HD   LYS   1          1HD       LYS   1  -5.537  14.910  -7.454
   11   1HE   LYS   1          2HE       LYS   1  -6.525  12.281  -6.889
   12   2HE   LYS   1          1HE       LYS   1  -7.811  13.449  -6.529
   13   1HZ   LYS   1          1HZ       LYS   1  -6.224  13.234  -9.029
   14   2HZ   LYS   1          2HZ       LYS   1  -7.226  14.559  -8.668
   15   3HZ   LYS   1          3HZ       LYS   1  -7.896  13.008  -8.853
   16    H    ILE   2           H        ILE   2  -2.058  11.268  -3.086
   17    HA   ILE   2           HA       ILE   2  -0.640  10.966  -5.706
   18    HB   ILE   2           HB       ILE   2   0.602  11.489  -3.530
   19   1HG1  ILE   2          2HG1      ILE   2   1.278   8.931  -5.014
   20   2HG1  ILE   2          1HG1      ILE   2   1.722  10.561  -5.520
   21   1HG2  ILE   2          1HG2      ILE   2  -0.636  10.052  -2.010
   22   2HG2  ILE   2          2HG2      ILE   2   1.024   9.470  -2.093
   23   3HG2  ILE   2          3HG2      ILE   2  -0.249   8.631  -2.978
   24   1HD1  ILE   2          1HD1      ILE   2   2.688  10.577  -2.987
   25   2HD1  ILE   2          2HD1      ILE   2   3.649  10.093  -4.384
   26   3HD1  ILE   2          3HD1      ILE   2   2.877   8.868  -3.377
   27    H    ASP   3           H        ASP   3  -0.266   8.789  -6.444
   28    HA   ASP   3           HA       ASP   3  -2.116   6.719  -5.316
   29   1HB   ASP   3          2HB       ASP   3  -2.462   6.147  -7.816
   30   2HB   ASP   3          1HB       ASP   3  -3.247   7.608  -7.216
   31    H    GLY   4           H        GLY   4  -0.808   5.028  -4.700
   32   1HA   GLY   4          2HA       GLY   4   1.181   4.006  -6.613
   33   2HA   GLY   4          1HA       GLY   4   1.849   4.601  -5.094
   34    H    TYR   5           H        TYR   5   2.536   2.496  -4.457
   35    HA   TYR   5           HA       TYR   5   0.289   0.649  -3.731
   36   1HB   TYR   5          2HB       TYR   5   3.149  -0.122  -4.346
   37   2HB   TYR   5          1HB       TYR   5   1.733  -1.171  -4.305
   38    HD1  TYR   5           1HD      TYR   5   3.576   1.353  -6.238
   39    HD2  TYR   5           2HD      TYR   5   0.083  -1.142  -6.122
   40    HE1  TYR   5           1HE      TYR   5   3.186   1.787  -8.648
   41    HE2  TYR   5           2HE      TYR   5  -0.309  -0.709  -8.532
   42    HH   TYR   5           HH       TYR   5   0.425   1.376 -10.165
   43    HA   PRO   6           HA       PRO   6   2.041   1.605   0.287
   44   1HB   PRO   6          2HB       PRO   6  -0.030   0.547   1.724
   45   2HB   PRO   6          1HB       PRO   6  -0.099   2.152   0.970
   46   1HG   PRO   6          2HG       PRO   6  -1.305  -0.408   0.082
   47   2HG   PRO   6          1HG       PRO   6  -1.917   1.245  -0.070
   48   1HD   PRO   6          2HD       PRO   6  -0.734  -0.187  -2.108
   49   2HD   PRO   6          1HD       PRO   6  -0.855   1.585  -2.048
   50    H    VAL   7           H        VAL   7   3.192   0.305   1.753
   51    HA   VAL   7           HA       VAL   7   2.793  -2.652   1.633
   52    HB   VAL   7           HB       VAL   7   5.240  -2.904   1.319
   53   1HG1  VAL   7          1HG1      VAL   7   5.126  -2.636  -0.967
   54   2HG1  VAL   7          2HG1      VAL   7   4.477  -1.001  -0.848
   55   3HG1  VAL   7          3HG1      VAL   7   3.420  -2.389  -0.594
   56   1HG2  VAL   7          1HG2      VAL   7   6.606  -0.929   0.815
   57   2HG2  VAL   7          2HG2      VAL   7   5.863  -0.754   2.405
   58   3HG2  VAL   7          3HG2      VAL   7   5.201   0.117   1.021
   59    H    ASP   8           H        ASP   8   4.740  -3.491   3.305
   60    HA   ASP   8           HA       ASP   8   3.870  -2.620   5.910
   61   1HB   ASP   8          2HB       ASP   8   5.137  -4.783   4.819
   62   2HB   ASP   8          1HB       ASP   8   6.486  -3.980   5.622
   63    H    TYR   9           H        TYR   9   5.900  -2.148   7.535
   64    HA   TYR   9           HA       TYR   9   6.845   0.514   6.804
   65   1HB   TYR   9          2HB       TYR   9   6.416  -1.071   9.121
   66   2HB   TYR   9          1HB       TYR   9   8.125  -0.635   9.121
   67    HD1  TYR   9           1HD      TYR   9   8.565   1.266  10.386
   68    HD2  TYR   9           2HD      TYR   9   4.946   1.077   8.082
   69    HE1  TYR   9           1HE      TYR   9   7.981   3.562  11.116
   70    HE2  TYR   9           2HE      TYR   9   4.361   3.373   8.813
   71    HH   TYR   9           HH       TYR   9   6.546   5.470  10.200
   72    H    TRP  10           H        TRP  10   7.986  -2.653   6.271
   73    HA   TRP  10           HA       TRP  10  10.714  -1.583   5.635
   74   1HB   TRP  10          2HB       TRP  10  10.114  -4.346   6.717
   75   2HB   TRP  10          1HB       TRP  10  11.675  -3.541   6.614
   76    HD1  TRP  10           HD       TRP  10  12.303  -1.800   8.481
   77    HE1  TRP  10           1HE      TRP  10  11.245  -1.213  10.757
   78    HE3  TRP  10           3HE      TRP  10   7.829  -4.164   7.987
   79    HZ2  TRP  10           2HZ      TRP  10   8.808  -1.693  12.182
   80    HZ3  TRP  10           3HZ      TRP  10   6.147  -4.093   9.811
   81    HH2  TRP  10           HH       TRP  10   6.634  -2.862  11.909
   82    H    ASN  11           H        ASN  11   7.974  -2.697   4.279
   83    HA   ASN  11           HA       ASN  11   7.495  -3.696   2.192
   84   1HB   ASN  11          2HB       ASN  11  10.488  -3.473   1.826
   85   2HB   ASN  11          1HB       ASN  11   9.253  -3.441   0.567
   86   1HD2  ASN  11          1HD2      ASN  11  11.282  -1.320   1.289
   87   2HD2  ASN  11          2HD2      ASN  11  10.370   0.072   1.624
   88    H    CYS  12           H        CYS  12   8.204  -5.388   4.545
   89    HA   CYS  12           HA       CYS  12   9.659  -7.661   3.295
   90   1HB   CYS  12          2HB       CYS  12  10.024  -6.626   5.655
   91   2HB   CYS  12          1HB       CYS  12   8.569  -7.516   6.099
   92    H    LYS  13           H        LYS  13   6.795  -7.468   5.425
   93    HA   LYS  13           HA       LYS  13   5.421  -9.400   3.584
   94   1HB   LYS  13          2HB       LYS  13   5.743  -9.413   6.596
   95   2HB   LYS  13          1HB       LYS  13   4.555 -10.417   5.762
   96   1HG   LYS  13          2HG       LYS  13   7.563 -10.473   5.389
   97   2HG   LYS  13          1HG       LYS  13   6.559 -11.740   6.097
   98   1HD   LYS  13          2HD       LYS  13   5.319 -11.830   3.874
   99   2HD   LYS  13          1HD       LYS  13   6.599 -10.809   3.219
  100   1HE   LYS  13          2HE       LYS  13   8.207 -12.618   4.255
  101   2HE   LYS  13          1HE       LYS  13   6.766 -13.652   4.185
  102   1HZ   LYS  13          1HZ       LYS  13   6.546 -13.331   1.903
  103   2HZ   LYS  13          2HZ       LYS  13   8.222 -13.525   2.104
  104   3HZ   LYS  13          3HZ       LYS  13   7.563 -11.974   1.888
  105    H    ARG  14           H        ARG  14   4.217  -7.524   2.769
  106    HA   ARG  14           HA       ARG  14   1.698  -7.088   4.042
  107   1HB   ARG  14          2HB       ARG  14   3.606  -5.840   5.447
  108   2HB   ARG  14          1HB       ARG  14   3.330  -4.595   4.232
  109   1HG   ARG  14          2HG       ARG  14   1.637  -3.938   5.597
  110   2HG   ARG  14          1HG       ARG  14   0.763  -5.290   4.877
  111   1HD   ARG  14          2HD       ARG  14   2.542  -5.767   7.264
  112   2HD   ARG  14          1HD       ARG  14   0.891  -5.156   7.487
  113    HE   ARG  14           HE       ARG  14   0.605  -7.250   5.681
  114   1HH1  ARG  14          1HH2      ARG  14  -0.025  -6.934   8.796
  115   2HH1  ARG  14          2HH2      ARG  14   0.509  -8.494   9.327
  116   1HH2  ARG  14          1HH1      ARG  14   2.153  -9.233   6.365
  117   2HH2  ARG  14          2HH1      ARG  14   1.742  -9.796   7.951
  118    H    ILE  15           H        ILE  15   4.132  -6.084   1.732
  119    HA   ILE  15           HA       ILE  15   3.251  -4.078   0.192
  120    HB   ILE  15           HB       ILE  15   5.016  -5.843  -0.283
  121   1HG1  ILE  15          2HG1      ILE  15   3.440  -5.449  -2.789
  122   2HG1  ILE  15          1HG1      ILE  15   3.965  -4.009  -1.915
  123   1HG2  ILE  15          1HG2      ILE  15   2.675  -7.236  -1.615
  124   2HG2  ILE  15          2HG2      ILE  15   3.447  -7.779  -0.126
  125   3HG2  ILE  15          3HG2      ILE  15   4.358  -7.763  -1.636
  126   1HD1  ILE  15          1HD1      ILE  15   5.553  -5.960  -3.450
  127   2HD1  ILE  15          2HD1      ILE  15   6.240  -5.547  -1.878
  128   3HD1  ILE  15          3HD1      ILE  15   5.910  -4.278  -3.058
  129    H    CYS  16           H        CYS  16   1.640  -7.259   0.160
  130    HA   CYS  16           HA       CYS  16  -0.932  -5.987  -0.473
  131   1HB   CYS  16          2HB       CYS  16   0.140  -6.133  -2.666
  132   2HB   CYS  16          1HB       CYS  16   0.502  -7.839  -2.405
  133    H    TRP  17           H        TRP  17  -2.710  -7.500  -0.182
  134    HA   TRP  17           HA       TRP  17  -1.891 -10.015   1.231
  135   1HB   TRP  17          2HB       TRP  17  -3.465  -7.789   1.986
  136   2HB   TRP  17          1HB       TRP  17  -4.591  -9.128   1.758
  137    HD1  TRP  17           HD       TRP  17  -2.383 -11.387   2.592
  138    HE1  TRP  17           1HE      TRP  17  -1.891 -11.705   5.101
  139    HE3  TRP  17           3HE      TRP  17  -4.056  -6.909   4.397
  140    HZ2  TRP  17           2HZ      TRP  17  -2.169 -10.255   7.550
  141    HZ3  TRP  17           3HZ      TRP  17  -3.930  -6.406   6.820
  142    HH2  TRP  17           HH       TRP  17  -2.990  -8.073   8.398
  143    H    TYR  18           H        TYR  18  -4.675 -10.940   1.280
  144    HA   TYR  18           HA       TYR  18  -5.024 -11.660  -1.616
  145   1HB   TYR  18          2HB       TYR  18  -4.691 -13.213   0.862
  146   2HB   TYR  18          1HB       TYR  18  -6.056 -13.743  -0.122
  147    HD1  TYR  18           1HD      TYR  18  -5.426 -15.631  -1.342
  148    HD2  TYR  18           2HD      TYR  18  -2.700 -12.329  -1.018
  149    HE1  TYR  18           1HE      TYR  18  -3.862 -16.770  -2.894
  150    HE2  TYR  18           2HE      TYR  18  -1.137 -13.467  -2.571
  151    HH   TYR  18           HH       TYR  18  -1.752 -15.559  -4.591
  152    H    ASN  19           H        ASN  19  -6.386  -9.697   0.477
  153    HA   ASN  19           HA       ASN  19  -9.187 -10.643  -0.047
  154   1HB   ASN  19          2HB       ASN  19  -7.790  -9.342   2.261
  155   2HB   ASN  19          1HB       ASN  19  -9.503  -8.994   2.019
  156   1HD2  ASN  19          1HD2      ASN  19  -9.090 -10.356   4.306
  157   2HD2  ASN  19          2HD2      ASN  19  -9.450 -12.007   4.148
  158    H    ASN  20           H        ASN  20 -10.674  -9.077  -0.808
  159    HA   ASN  20           HA       ASN  20  -9.467  -6.750  -2.169
  160   1HB   ASN  20          2HB       ASN  20 -11.768  -6.621  -3.142
  161   2HB   ASN  20          1HB       ASN  20 -11.054  -8.223  -3.318
  162   1HD2  ASN  20          1HD2      ASN  20 -11.980  -9.979  -2.088
  163   2HD2  ASN  20          2HD2      ASN  20 -13.425  -9.808  -1.214
  164    H    LYS  21           H        LYS  21  -9.821  -6.873   0.860
  165    HA   LYS  21           HA       LYS  21 -11.101  -4.207   1.126
  166   1HB   LYS  21          2HB       LYS  21 -12.581  -5.045   2.909
  167   2HB   LYS  21          1HB       LYS  21 -12.869  -5.932   1.412
  168   1HG   LYS  21          2HG       LYS  21 -11.319  -7.720   2.227
  169   2HG   LYS  21          1HG       LYS  21 -11.189  -6.856   3.761
  170   1HD   LYS  21          2HD       LYS  21 -13.299  -7.440   4.427
  171   2HD   LYS  21          1HD       LYS  21 -13.945  -7.378   2.786
  172   1HE   LYS  21          2HE       LYS  21 -12.044  -9.562   3.688
  173   2HE   LYS  21          1HE       LYS  21 -13.808  -9.719   3.804
  174   1HZ   LYS  21          1HZ       LYS  21 -12.248  -9.114   1.348
  175   2HZ   LYS  21          2HZ       LYS  21 -13.945  -9.108   1.439
  176   3HZ   LYS  21          3HZ       LYS  21 -13.083 -10.553   1.678
  177    H    TYR  22           H        TYR  22  -9.289  -6.871   2.622
  178    HA   TYR  22           HA       TYR  22  -8.531  -5.746   5.069
  179   1HB   TYR  22          2HB       TYR  22  -7.909  -7.937   3.494
  180   2HB   TYR  22          1HB       TYR  22  -6.367  -7.089   3.612
  181    HD1  TYR  22           1HD      TYR  22  -7.346  -9.810   4.917
  182    HD2  TYR  22           2HD      TYR  22  -6.936  -5.778   6.340
  183    HE1  TYR  22           1HE      TYR  22  -7.056 -10.656   7.229
  184    HE2  TYR  22           2HE      TYR  22  -6.647  -6.625   8.653
  185    HH   TYR  22           HH       TYR  22  -5.963  -9.816   9.367
  186    H    CYS  23           H        CYS  23  -7.393  -4.922   1.832
  187    HA   CYS  23           HA       CYS  23  -5.168  -3.275   2.856
  188   1HB   CYS  23          2HB       CYS  23  -5.678  -4.691   0.564
  189   2HB   CYS  23          1HB       CYS  23  -6.052  -3.047   0.043
  190    H    ASN  24           H        ASN  24  -8.020  -2.598   0.785
  191    HA   ASN  24           HA       ASN  24  -8.035   0.151   0.703
  192   1HB   ASN  24          2HB       ASN  24  -9.913  -0.569  -0.346
  193   2HB   ASN  24          1HB       ASN  24  -9.941  -2.052   0.600
  194   1HD2  ASN  24          1HD2      ASN  24 -11.608  -2.237   2.120
  195   2HD2  ASN  24          2HD2      ASN  24 -12.587  -0.951   2.641
  196    H    ASP  25           H        ASP  25  -9.082  -1.842   3.474
  197    HA   ASP  25           HA       ASP  25 -10.106   0.200   5.148
  198   1HB   ASP  25          2HB       ASP  25  -9.524  -2.533   5.244
  199   2HB   ASP  25          1HB       ASP  25  -8.554  -1.840   6.543
  200    H    LEU  26           H        LEU  26  -6.746  -1.041   4.923
  201    HA   LEU  26           HA       LEU  26  -5.711   0.892   6.838
  202   1HB   LEU  26          2HB       LEU  26  -4.788  -1.328   5.140
  203   2HB   LEU  26          1HB       LEU  26  -3.587  -0.052   5.341
  204    HG   LEU  26           HG       LEU  26  -5.079  -1.347   7.639
  205   1HD1  LEU  26          1HD1      LEU  26  -2.481  -2.110   7.916
  206   2HD1  LEU  26          2HD1      LEU  26  -2.630  -2.114   6.158
  207   3HD1  LEU  26          3HD1      LEU  26  -3.712  -3.105   7.137
  208   1HD2  LEU  26          1HD2      LEU  26  -2.486  -0.008   8.058
  209   2HD2  LEU  26          2HD2      LEU  26  -3.976   0.112   8.994
  210   3HD2  LEU  26          3HD2      LEU  26  -3.774   1.073   7.529
  211    H    CYS  27           H        CYS  27  -5.851   0.681   3.288
  212    HA   CYS  27           HA       CYS  27  -4.188   2.892   2.657
  213   1HB   CYS  27          2HB       CYS  27  -6.547   1.502   1.407
  214   2HB   CYS  27          1HB       CYS  27  -5.864   2.933   0.634
  215    H    LYS  28           H        LYS  28  -7.642   2.730   3.504
  216    HA   LYS  28           HA       LYS  28  -8.300   5.463   3.029
  217   1HB   LYS  28          2HB       LYS  28  -9.490   3.128   4.025
  218   2HB   LYS  28          1HB       LYS  28  -9.593   4.277   5.360
  219   1HG   LYS  28          2HG       LYS  28 -11.257   5.375   4.322
  220   2HG   LYS  28          1HG       LYS  28 -10.225   5.645   2.917
  221   1HD   LYS  28          2HD       LYS  28 -11.441   4.168   1.738
  222   2HD   LYS  28          1HD       LYS  28 -11.022   2.905   2.896
  223   1HE   LYS  28          2HE       LYS  28 -13.349   2.920   3.109
  224   2HE   LYS  28          1HE       LYS  28 -12.914   4.110   4.352
  225   1HZ   LYS  28          1HZ       LYS  28 -14.590   4.724   2.447
  226   2HZ   LYS  28          2HZ       LYS  28 -13.162   5.016   1.576
  227   3HZ   LYS  28          3HZ       LYS  28 -13.468   5.860   3.018
  228    H    GLY  29           H        GLY  29  -6.630   3.864   5.681
  229   1HA   GLY  29          2HA       GLY  29  -6.791   5.946   7.626
  230   2HA   GLY  29          1HA       GLY  29  -5.488   4.755   7.533
  231    H    LEU  30           H        LEU  30  -4.641   5.397   4.873
  232    HA   LEU  30           HA       LEU  30  -3.080   7.842   5.451
  233   1HB   LEU  30          2HB       LEU  30  -3.050   5.629   3.397
  234   2HB   LEU  30          1HB       LEU  30  -2.042   7.063   3.198
  235    HG   LEU  30           HG       LEU  30  -2.040   5.323   5.676
  236   1HD1  LEU  30          1HD1      LEU  30   0.252   4.650   4.774
  237   2HD1  LEU  30          2HD1      LEU  30  -0.246   5.358   3.238
  238   3HD1  LEU  30          3HD1      LEU  30  -1.133   3.986   3.903
  239   1HD2  LEU  30          1HD2      LEU  30  -0.839   7.889   4.915
  240   2HD2  LEU  30          2HD2      LEU  30   0.349   6.719   5.486
  241   3HD2  LEU  30          3HD2      LEU  30  -1.013   7.164   6.513
  242    H    LYS  31           H        LYS  31  -6.073   7.677   4.621
  243    HA   LYS  31           HA       LYS  31  -7.493   9.185   3.480
  244   1HB   LYS  31          2HB       LYS  31  -5.412  10.671   3.941
  245   2HB   LYS  31          1HB       LYS  31  -5.012  10.380   2.248
  246   1HG   LYS  31          2HG       LYS  31  -6.294  12.303   2.048
  247   2HG   LYS  31          1HG       LYS  31  -7.537  11.067   1.859
  248   1HD   LYS  31          2HD       LYS  31  -8.575  11.705   3.755
  249   2HD   LYS  31          1HD       LYS  31  -7.063  11.672   4.665
  250   1HE   LYS  31          2HE       LYS  31  -7.422  13.932   2.743
  251   2HE   LYS  31          1HE       LYS  31  -8.379  13.973   4.236
  252   1HZ   LYS  31          1HZ       LYS  31  -5.795  14.718   4.070
  253   2HZ   LYS  31          2HZ       LYS  31  -5.647  13.107   4.588
  254   3HZ   LYS  31          3HZ       LYS  31  -6.559  14.215   5.499
  255    H    ALA  32           H        ALA  32  -5.989   6.677   2.239
  256    HA   ALA  32           HA       ALA  32  -6.333   7.332  -0.639
  257   1HB   ALA  32          1HB       ALA  32  -5.472   4.734   0.655
  258   2HB   ALA  32          2HB       ALA  32  -4.360   6.079   0.415
  259   3HB   ALA  32          3HB       ALA  32  -5.112   5.297  -0.975
  260    H    ASP  33           H        ASP  33  -8.679   7.464  -0.675
  261    HA   ASP  33           HA       ASP  33 -10.517   5.630   0.414
  262   1HB   ASP  33          2HB       ASP  33 -10.612   7.152  -2.208
  263   2HB   ASP  33          1HB       ASP  33 -12.012   6.525  -1.339
  264    H    SER  34           H        SER  34  -9.901   5.672  -3.084
  265    HA   SER  34           HA       SER  34 -10.747   2.988  -3.521
  266   1HB   SER  34          2HB       SER  34 -10.747   4.508  -5.335
  267   2HB   SER  34          1HB       SER  34  -9.087   5.008  -5.024
  268    HG   SER  34           HG       SER  34  -9.838   2.377  -5.774
  269    H    GLY  35           H        GLY  35  -9.640   1.520  -2.126
  270   1HA   GLY  35          2HA       GLY  35  -6.731   1.207  -2.742
  271   2HA   GLY  35          1HA       GLY  35  -7.384   0.923  -1.127
  272    H    TYR  36           H        TYR  36  -6.569  -0.551  -4.040
  273    HA   TYR  36           HA       TYR  36  -7.954  -3.063  -3.197
  274   1HB   TYR  36          2HB       TYR  36  -8.641  -3.425  -5.516
  275   2HB   TYR  36          1HB       TYR  36  -9.226  -1.849  -4.985
  276    HD1  TYR  36           1HD      TYR  36  -6.348  -3.485  -6.731
  277    HD2  TYR  36           2HD      TYR  36  -8.674   0.087  -6.197
  278    HE1  TYR  36           1HE      TYR  36  -5.107  -2.401  -8.585
  279    HE2  TYR  36           2HE      TYR  36  -7.434   1.171  -8.051
  280    HH   TYR  36           HH       TYR  36  -4.992  -0.621  -9.921
  281    H    CYS  37           H        CYS  37  -6.690  -4.927  -3.590
  282    HA   CYS  37           HA       CYS  37  -3.852  -4.423  -4.249
  283   1HB   CYS  37          2HB       CYS  37  -5.379  -6.141  -2.575
  284   2HB   CYS  37          1HB       CYS  37  -4.507  -7.169  -3.713
  285    H    TRP  38           H        TRP  38  -2.723  -5.660  -5.884
  286    HA   TRP  38           HA       TRP  38  -4.316  -6.168  -8.292
  287   1HB   TRP  38          2HB       TRP  38  -1.910  -5.171  -7.948
  288   2HB   TRP  38          1HB       TRP  38  -1.410  -6.861  -7.898
  289    HD1  TRP  38           HD       TRP  38  -0.740  -7.766 -10.158
  290    HE1  TRP  38           1HE      TRP  38  -1.382  -7.303 -12.611
  291    HE3  TRP  38           3HE      TRP  38  -4.267  -4.137  -9.477
  292    HZ2  TRP  38           2HZ      TRP  38  -3.155  -5.618 -14.089
  293    HZ3  TRP  38           3HZ      TRP  38  -5.415  -3.121 -11.426
  294    HH2  TRP  38           HH       TRP  38  -4.864  -3.856 -13.727
  295    H    GLY  39           H        GLY  39  -3.273  -8.351  -9.481
  296   1HA   GLY  39          2HA       GLY  39  -3.807 -10.582  -7.556
  297   2HA   GLY  39          1HA       GLY  39  -4.357 -10.616  -9.232
  298    H    TRP  40           H        TRP  40  -1.834  -9.369 -10.186
  299    HA   TRP  40           HA       TRP  40  -0.293 -11.832 -10.522
  300   1HB   TRP  40          2HB       TRP  40  -0.479 -10.406 -12.405
  301   2HB   TRP  40          1HB       TRP  40  -0.152  -8.965 -11.451
  302    HD1  TRP  40           HD       TRP  40   2.068  -8.039 -12.212
  303    HE1  TRP  40           1HE      TRP  40   4.403  -9.010 -12.692
  304    HE3  TRP  40           3HE      TRP  40   1.109 -13.015 -11.578
  305    HZ2  TRP  40           2HZ      TRP  40   5.704 -11.557 -12.790
  306    HZ3  TRP  40           3HZ      TRP  40   2.913 -14.690 -11.869
  307    HH2  TRP  40           HH       TRP  40   5.207 -13.968 -12.474
  308    H    THR  41           H        THR  41   1.176  -8.685  -9.898
  309    HA   THR  41           HA       THR  41   2.191  -9.387  -7.252
  310    HB   THR  41           HB       THR  41   3.444 -10.805  -9.010
  311    HG1  THR  41           1HG      THR  41   4.562  -9.127  -7.074
  312   1HG2  THR  41          1HG2      THR  41   5.222  -8.497  -9.509
  313   2HG2  THR  41          2HG2      THR  41   3.667  -8.434 -10.340
  314   3HG2  THR  41          3HG2      THR  41   4.745  -9.808 -10.588
  315    H    LEU  42           H        LEU  42   0.817  -7.128  -8.117
  316    HA   LEU  42           HA       LEU  42   2.904  -5.014  -8.465
  317   1HB   LEU  42          2HB       LEU  42   0.063  -5.432  -9.228
  318   2HB   LEU  42          1HB       LEU  42   0.511  -3.780  -8.802
  319    HG   LEU  42           HG       LEU  42   2.377  -3.872 -10.423
  320   1HD1  LEU  42          1HD1      LEU  42   1.558  -6.703 -10.469
  321   2HD1  LEU  42          2HD1      LEU  42   3.119  -5.977 -10.852
  322   3HD1  LEU  42          3HD1      LEU  42   1.840  -6.009 -12.065
  323   1HD2  LEU  42          1HD2      LEU  42  -0.135  -4.791 -11.825
  324   2HD2  LEU  42          2HD2      LEU  42   1.037  -3.586 -12.356
  325   3HD2  LEU  42          3HD2      LEU  42  -0.057  -3.224 -11.022
  326    H    SER  43           H        SER  43   2.008  -6.431  -5.846
  327    HA   SER  43           HA       SER  43   1.656  -5.730  -3.613
  328   1HB   SER  43          2HB       SER  43   2.204  -2.982  -4.753
  329   2HB   SER  43          1HB       SER  43   2.559  -3.564  -3.129
  330    HG   SER  43           HG       SER  43   3.837  -4.117  -5.569
  331    H    CYS  44           H        CYS  44   0.465  -3.514  -2.544
  332    HA   CYS  44           HA       CYS  44  -2.322  -3.785  -3.444
  333   1HB   CYS  44          2HB       CYS  44  -1.394  -3.681  -1.036
  334   2HB   CYS  44          1HB       CYS  44  -1.197  -1.951  -1.316
  335    H    TYR  45           H        TYR  45  -3.598  -1.879  -4.087
  336    HA   TYR  45           HA       TYR  45  -1.918   0.385  -5.117
  337   1HB   TYR  45          2HB       TYR  45  -2.817  -1.460  -6.735
  338   2HB   TYR  45          1HB       TYR  45  -4.378  -0.675  -6.503
  339    HD1  TYR  45           1HD      TYR  45  -3.115  -0.782  -9.183
  340    HD2  TYR  45           2HD      TYR  45  -2.646   2.076  -6.008
  341    HE1  TYR  45           1HE      TYR  45  -2.489   0.958 -10.836
  342    HE2  TYR  45           2HE      TYR  45  -2.021   3.813  -7.662
  343    HH   TYR  45           HH       TYR  45  -1.057   3.186 -10.709
  344    H    CYS  46           H        CYS  46  -2.552   2.206  -4.052
  345    HA   CYS  46           HA       CYS  46  -5.477   2.661  -3.645
  346   1HB   CYS  46          2HB       CYS  46  -3.228   3.025  -1.638
  347   2HB   CYS  46          1HB       CYS  46  -4.907   3.488  -1.363
  348    H    GLN  47           H        GLN  47  -6.082   4.766  -4.130
  349    HA   GLN  47           HA       GLN  47  -3.869   6.729  -4.664
  350   1HB   GLN  47          2HB       GLN  47  -6.480   6.187  -6.113
  351   2HB   GLN  47          1HB       GLN  47  -5.402   7.529  -6.493
  352   1HG   GLN  47          2HG       GLN  47  -4.417   6.074  -7.929
  353   2HG   GLN  47          1HG       GLN  47  -3.663   5.403  -6.483
  354   1HE2  GLN  47          1HE2      GLN  47  -6.110   4.842  -8.943
  355   2HE2  GLN  47          2HE2      GLN  47  -6.532   3.278  -8.434
  356    H    GLY  48           H        GLY  48  -4.415   8.968  -4.234
  357   1HA   GLY  48          2HA       GLY  48  -5.932  10.694  -3.446
  358   2HA   GLY  48          1HA       GLY  48  -6.953   9.434  -2.754
  359    H    LEU  49           H        LEU  49  -3.604   8.980  -2.222
  360    HA   LEU  49           HA       LEU  49  -4.004   9.716   0.641
  361   1HB   LEU  49          2HB       LEU  49  -1.682   8.427   0.700
  362   2HB   LEU  49          1HB       LEU  49  -3.190   7.535   0.549
  363    HG   LEU  49           HG       LEU  49  -1.840   8.453  -1.958
  364   1HD1  LEU  49          1HD1      LEU  49  -0.820   5.920  -1.570
  365   2HD1  LEU  49          2HD1      LEU  49  -0.678   6.631   0.038
  366   3HD1  LEU  49          3HD1      LEU  49   0.085   7.417  -1.344
  367   1HD2  LEU  49          1HD2      LEU  49  -2.971   6.615  -2.897
  368   2HD2  LEU  49          2HD2      LEU  49  -4.098   7.160  -1.654
  369   3HD2  LEU  49          3HD2      LEU  49  -3.061   5.765  -1.354
  370    HA   PRO  50           HA       PRO  50  -1.255  13.132   0.479
  371   1HB   PRO  50          2HB       PRO  50   0.421  12.779   2.615
  372   2HB   PRO  50          1HB       PRO  50  -1.281  13.252   2.786
  373   1HG   PRO  50          2HG       PRO  50  -0.020  10.572   3.109
  374   2HG   PRO  50          1HG       PRO  50  -1.299  11.340   4.063
  375   1HD   PRO  50          2HD       PRO  50  -1.794   9.447   2.185
  376   2HD   PRO  50          1HD       PRO  50  -2.949  10.734   2.587
  377    H    ASP  51           H        ASP  51   0.923  13.801  -0.118
  378    HA   ASP  51           HA       ASP  51   2.355  12.023  -1.811
  379   1HB   ASP  51          2HB       ASP  51   2.329  14.571  -1.713
  380   2HB   ASP  51          1HB       ASP  51   3.443  14.445  -0.350
  381    H    ASN  52           H        ASN  52   2.549  12.566   1.638
  382    HA   ASN  52           HA       ASN  52   5.160  11.226   1.920
  383   1HB   ASN  52          2HB       ASN  52   4.360  13.138   3.327
  384   2HB   ASN  52          1HB       ASN  52   3.087  12.096   3.961
  385   1HD2  ASN  52          1HD2      ASN  52   4.087  12.330   6.140
  386   2HD2  ASN  52          2HD2      ASN  52   5.475  11.436   6.533
  387    H    ALA  53           H        ALA  53   2.398   9.981   0.973
  388    HA   ALA  53           HA       ALA  53   1.529   8.021   2.805
  389   1HB   ALA  53          1HB       ALA  53   1.539   8.500  -0.117
  390   2HB   ALA  53          2HB       ALA  53   0.191   8.110   0.951
  391   3HB   ALA  53          3HB       ALA  53   1.257   6.830   0.371
  392    H    ARG  54           H        ARG  54   2.141   5.791   3.068
  393    HA   ARG  54           HA       ARG  54   5.016   5.260   2.568
  394   1HB   ARG  54          2HB       ARG  54   3.023   4.638   4.536
  395   2HB   ARG  54          1HB       ARG  54   3.648   3.123   3.885
  396   1HG   ARG  54          2HG       ARG  54   5.922   4.706   4.199
  397   2HG   ARG  54          1HG       ARG  54   4.955   5.060   5.631
  398   1HD   ARG  54          2HD       ARG  54   5.411   3.024   6.523
  399   2HD   ARG  54          1HD       ARG  54   4.952   2.203   5.017
  400    HE   ARG  54           HE       ARG  54   7.666   3.063   5.745
  401   1HH1  ARG  54          1HH1      ARG  54   6.358   0.640   4.138
  402   2HH1  ARG  54          2HH1      ARG  54   7.165   0.864   2.621
  403   1HH2  ARG  54          1HH2      ARG  54   8.329   4.035   3.412
  404   2HH2  ARG  54          2HH2      ARG  54   8.282   2.787   2.210
  405    H    ILE  55           H        ILE  55   5.404   4.407   0.540
  406    HA   ILE  55           HA       ILE  55   3.863   1.994  -0.270
  407    HB   ILE  55           HB       ILE  55   3.495   3.016  -2.511
  408   1HG1  ILE  55          2HG1      ILE  55   5.455   4.654  -2.171
  409   2HG1  ILE  55          1HG1      ILE  55   4.012   5.290  -2.959
  410   1HG2  ILE  55          1HG2      ILE  55   2.406   4.669  -0.215
  411   2HG2  ILE  55          2HG2      ILE  55   1.746   3.127  -0.759
  412   3HG2  ILE  55          3HG2      ILE  55   1.696   4.531  -1.823
  413   1HD1  ILE  55          1HD1      ILE  55   5.263   6.188  -0.537
  414   2HD1  ILE  55          2HD1      ILE  55   3.642   5.615  -0.153
  415   3HD1  ILE  55          3HD1      ILE  55   3.866   6.872  -1.368
  416    H    LYS  56           H        LYS  56   4.907   1.702  -2.801
  417    HA   LYS  56           HA       LYS  56   7.313   0.398  -2.573
  418   1HB   LYS  56          2HB       LYS  56   5.871   1.877  -4.700
  419   2HB   LYS  56          1HB       LYS  56   7.570   1.544  -5.038
  420   1HG   LYS  56          2HG       LYS  56   6.614  -0.844  -3.953
  421   2HG   LYS  56          1HG       LYS  56   5.306  -0.291  -4.999
  422   1HD   LYS  56          2HD       LYS  56   7.565   0.212  -6.520
  423   2HD   LYS  56          1HD       LYS  56   7.958  -1.309  -5.718
  424   1HE   LYS  56          2HE       LYS  56   6.714  -2.301  -7.350
  425   2HE   LYS  56          1HE       LYS  56   5.298  -1.650  -6.500
  426   1HZ   LYS  56          1HZ       LYS  56   5.736   0.479  -7.716
  427   2HZ   LYS  56          2HZ       LYS  56   5.205  -0.805  -8.694
  428   3HZ   LYS  56          3HZ       LYS  56   6.846  -0.366  -8.681
  429    H    ARG  57           H        ARG  57   9.073   1.180  -1.455
  430    HA   ARG  57           HA       ARG  57  10.245   3.775  -2.378
  431   1HB   ARG  57          2HB       ARG  57   9.788   2.778   0.453
  432   2HB   ARG  57          1HB       ARG  57  10.766   4.190   0.057
  433   1HG   ARG  57          2HG       ARG  57   8.084   4.151  -1.185
  434   2HG   ARG  57          1HG       ARG  57   8.087   4.293   0.573
  435   1HD   ARG  57          2HD       ARG  57  10.136   6.012  -0.508
  436   2HD   ARG  57          1HD       ARG  57   8.588   6.363  -1.299
  437    HE   ARG  57           HE       ARG  57   7.669   6.957   0.828
  438   1HH1  ARG  57          1HH1      ARG  57   9.470   4.567   1.972
  439   2HH1  ARG  57          2HH1      ARG  57  10.294   5.447   3.217
  440   1HH2  ARG  57          1HH2      ARG  57   9.312   8.555   2.040
  441   2HH2  ARG  57          2HH2      ARG  57  10.204   7.703   3.256
  442    H    SER  58           H        SER  58  10.776   0.724  -2.663
  443    HA   SER  58           HA       SER  58  12.739  -0.571  -2.917
  444   1HB   SER  58          2HB       SER  58  14.496   0.732  -3.536
  445   2HB   SER  58          1HB       SER  58  13.418   2.092  -3.233
  446    HG   SER  58           HG       SER  58  14.213   2.147  -1.100
  447    H    GLY  59           H        GLY  59  14.190  -1.770  -1.536
  448   1HA   GLY  59          2HA       GLY  59  15.348  -1.683   0.757
  449   2HA   GLY  59          1HA       GLY  59  13.756  -1.235   1.372
  450    H    ARG  60           H        ARG  60  15.781  -3.858   0.433
  451    HA   ARG  60           HA       ARG  60  13.745  -5.876   0.046
  452   1HB   ARG  60          2HB       ARG  60  16.638  -6.066   0.957
  453   2HB   ARG  60          1HB       ARG  60  15.683  -7.387   0.285
  454   1HG   ARG  60          2HG       ARG  60  16.414  -4.813  -1.142
  455   2HG   ARG  60          1HG       ARG  60  17.098  -6.408  -1.462
  456   1HD   ARG  60          2HD       ARG  60  14.363  -6.867  -1.633
  457   2HD   ARG  60          1HD       ARG  60  14.558  -5.270  -2.382
  458    HE   ARG  60           HE       ARG  60  16.422  -7.458  -3.168
  459   1HH1  ARG  60          1HH1      ARG  60  16.485  -4.891  -4.629
  460   2HH1  ARG  60          2HH1      ARG  60  15.481  -5.204  -6.005
  461   1HH2  ARG  60          1HH2      ARG  60  14.005  -8.019  -4.624
  462   2HH2  ARG  60          2HH2      ARG  60  14.078  -6.974  -6.003
  463    H    CYS  61           H        CYS  61  12.264  -5.771   1.811
  464    HA   CYS  61           HA       CYS  61  11.516  -6.021   4.047
  465   1HB   CYS  61          2HB       CYS  61  12.000  -8.307   3.304
  466   2HB   CYS  61          1HB       CYS  61  13.696  -8.116   3.753
  467    H    ARG  62           H        ARG  62  12.313  -3.999   4.903
  468    HA   ARG  62           HA       ARG  62  15.026  -3.803   6.005
  469   1HB   ARG  62          2HB       ARG  62  12.801  -2.138   5.270
  470   2HB   ARG  62          1HB       ARG  62  13.277  -1.753   6.922
  471   1HG   ARG  62          2HG       ARG  62  15.095  -0.656   6.174
  472   2HG   ARG  62          1HG       ARG  62  15.643  -2.104   5.327
  473   1HD   ARG  62          2HD       ARG  62  15.192  -0.010   3.874
  474   2HD   ARG  62          1HD       ARG  62  14.425  -1.520   3.342
  475    HE   ARG  62           HE       ARG  62  12.336  -0.569   3.892
  476   1HH1  ARG  62          1HH1      ARG  62  14.634   1.787   4.371
  477   2HH1  ARG  62          2HH1      ARG  62  13.753   2.672   5.572
  478   1HH2  ARG  62          1HH2      ARG  62  11.302   0.247   5.941
  479   2HH2  ARG  62          2HH2      ARG  62  11.867   1.800   6.460
  480    H    ALA  63           H        ALA  63  13.034  -5.864   7.112
  481    HA   ALA  63           HA       ALA  63  12.628  -6.759   9.263
  482   1HB   ALA  63          1HB       ALA  63  14.354  -6.295  10.656
  483   2HB   ALA  63          2HB       ALA  63  13.910  -4.591  10.744
  484   3HB   ALA  63          3HB       ALA  63  14.917  -5.173   9.418
  Start of MODEL    9
    1   1H    LYS   1          1HT       LYS   1  -3.512  15.029  -2.151
    2   2H    LYS   1          2HT       LYS   1  -3.199  15.457  -3.766
    3   3H    LYS   1          3HT       LYS   1  -2.019  14.639  -2.857
    4    HA   LYS   1           HA       LYS   1  -3.895  12.833  -2.640
    5   1HB   LYS   1          2HB       LYS   1  -4.770  14.839  -4.604
    6   2HB   LYS   1          1HB       LYS   1  -4.840  13.188  -5.220
    7   1HG   LYS   1          2HG       LYS   1  -6.271  12.481  -3.444
    8   2HG   LYS   1          1HG       LYS   1  -5.975  13.957  -2.524
    9   1HD   LYS   1          2HD       LYS   1  -7.136  14.204  -5.273
   10   2HD   LYS   1          1HD       LYS   1  -8.191  13.677  -3.963
   11   1HE   LYS   1          2HE       LYS   1  -6.435  16.110  -3.616
   12   2HE   LYS   1          1HE       LYS   1  -8.020  16.235  -4.404
   13   1HZ   LYS   1          1HZ       LYS   1  -7.724  14.743  -1.878
   14   2HZ   LYS   1          2HZ       LYS   1  -9.115  15.461  -2.538
   15   3HZ   LYS   1          3HZ       LYS   1  -7.901  16.429  -1.847
   16    H    ILE   2           H        ILE   2  -2.618  11.091  -3.146
   17    HA   ILE   2           HA       ILE   2  -1.013  11.194  -5.677
   18    HB   ILE   2           HB       ILE   2   0.474  11.694  -3.847
   19   1HG1  ILE   2          2HG1      ILE   2   0.686   8.721  -4.409
   20   2HG1  ILE   2          1HG1      ILE   2   1.250   9.982  -5.505
   21   1HG2  ILE   2          1HG2      ILE   2  -0.357  11.133  -1.814
   22   2HG2  ILE   2          2HG2      ILE   2   0.462   9.596  -2.081
   23   3HG2  ILE   2          3HG2      ILE   2  -1.252   9.758  -2.457
   24   1HD1  ILE   2          1HD1      ILE   2   2.915  10.716  -3.986
   25   2HD1  ILE   2          2HD1      ILE   2   2.995   8.955  -3.911
   26   3HD1  ILE   2          3HD1      ILE   2   2.176   9.856  -2.634
   27    H    ASP   3           H        ASP   3  -0.599   9.086  -6.604
   28    HA   ASP   3           HA       ASP   3  -2.345   6.890  -5.528
   29   1HB   ASP   3          2HB       ASP   3  -2.887   6.382  -7.844
   30   2HB   ASP   3          1HB       ASP   3  -3.156   8.108  -7.588
   31    H    GLY   4           H        GLY   4  -1.200   5.019  -5.116
   32   1HA   GLY   4          2HA       GLY   4   0.977   4.145  -6.824
   33   2HA   GLY   4          1HA       GLY   4   1.575   4.771  -5.289
   34    H    TYR   5           H        TYR   5   2.319   2.452  -5.092
   35    HA   TYR   5           HA       TYR   5   0.113   0.650  -4.169
   36   1HB   TYR   5          2HB       TYR   5   2.969   0.002  -4.977
   37   2HB   TYR   5          1HB       TYR   5   1.662  -1.152  -4.721
   38    HD1  TYR   5           1HD      TYR   5   0.290  -1.793  -6.515
   39    HD2  TYR   5           2HD      TYR   5   2.592   1.821  -6.804
   40    HE1  TYR   5           1HE      TYR   5  -0.396  -1.544  -8.883
   41    HE2  TYR   5           2HE      TYR   5   1.904   2.070  -9.170
   42    HH   TYR   5           HH       TYR   5   0.797  -0.243 -11.013
   43    HA   PRO   6           HA       PRO   6   2.108   1.755  -0.277
   44   1HB   PRO   6          2HB       PRO   6  -0.041   1.131   1.291
   45   2HB   PRO   6          1HB       PRO   6   0.105   2.666   0.414
   46   1HG   PRO   6          2HG       PRO   6  -1.509   0.265  -0.233
   47   2HG   PRO   6          1HG       PRO   6  -1.865   1.976  -0.507
   48   1HD   PRO   6          2HD       PRO   6  -0.981   0.211  -2.443
   49   2HD   PRO   6          1HD       PRO   6  -0.849   1.981  -2.537
   50    H    VAL   7           H        VAL   7   3.585   0.159   0.261
   51    HA   VAL   7           HA       VAL   7   2.795  -2.675   0.439
   52    HB   VAL   7           HB       VAL   7   5.250  -2.869   1.102
   53   1HG1  VAL   7          1HG1      VAL   7   5.617  -3.035  -1.115
   54   2HG1  VAL   7          2HG1      VAL   7   5.501  -1.286  -1.313
   55   3HG1  VAL   7          3HG1      VAL   7   4.045  -2.279  -1.378
   56   1HG2  VAL   7          1HG2      VAL   7   6.534  -1.011   1.458
   57   2HG2  VAL   7          2HG2      VAL   7   4.986  -0.256   1.836
   58   3HG2  VAL   7          3HG2      VAL   7   5.691  -0.068   0.230
   59    H    ASP   8           H        ASP   8   4.122  -3.646   2.598
   60    HA   ASP   8           HA       ASP   8   2.417  -2.915   4.825
   61   1HB   ASP   8          2HB       ASP   8   3.827  -4.617   5.980
   62   2HB   ASP   8          1HB       ASP   8   3.262  -5.183   4.409
   63    H    TYR   9           H        TYR   9   4.980  -3.315   6.611
   64    HA   TYR   9           HA       TYR   9   5.474  -0.414   6.935
   65   1HB   TYR   9          2HB       TYR   9   5.194  -2.683   8.591
   66   2HB   TYR   9          1HB       TYR   9   6.875  -2.175   8.755
   67    HD1  TYR   9           1HD      TYR   9   7.466  -0.069   9.770
   68    HD2  TYR   9           2HD      TYR   9   3.351  -1.109   9.117
   69    HE1  TYR   9           1HE      TYR   9   6.760   1.826  11.206
   70    HE2  TYR   9           2HE      TYR   9   2.644   0.785  10.555
   71    HH   TYR   9           HH       TYR   9   5.053   2.947  12.059
   72    H    TRP  10           H        TRP  10   7.583  -3.318   7.021
   73    HA   TRP  10           HA       TRP  10   9.766  -1.642   5.839
   74   1HB   TRP  10          2HB       TRP  10  10.026  -4.351   7.152
   75   2HB   TRP  10          1HB       TRP  10  11.250  -3.096   6.991
   76    HD1  TRP  10           HD       TRP  10  11.065  -0.969   8.613
   77    HE1  TRP  10           1HE      TRP  10   9.900  -0.669  10.895
   78    HE3  TRP  10           3HE      TRP  10   7.999  -5.047   8.577
   79    HZ2  TRP  10           2HZ      TRP  10   7.929  -1.990  12.495
   80    HZ3  TRP  10           3HZ      TRP  10   6.489  -5.506  10.489
   81    HH2  TRP  10           HH       TRP  10   6.449  -3.982  12.446
   82    H    ASN  11           H        ASN  11   7.519  -3.077   4.349
   83    HA   ASN  11           HA       ASN  11   7.386  -4.223   2.272
   84   1HB   ASN  11          2HB       ASN  11  10.081  -3.242   2.582
   85   2HB   ASN  11          1HB       ASN  11  10.134  -4.828   1.816
   86   1HD2  ASN  11          1HD2      ASN  11  10.894  -2.806   0.171
   87   2HD2  ASN  11          2HD2      ASN  11   9.672  -2.409  -0.937
   88    H    CYS  12           H        CYS  12   8.311  -5.488   5.153
   89    HA   CYS  12           HA       CYS  12   9.228  -8.141   4.302
   90   1HB   CYS  12          2HB       CYS  12   8.394  -6.888   6.931
   91   2HB   CYS  12          1HB       CYS  12   9.007  -8.535   6.794
   92    H    LYS  13           H        LYS  13   6.474  -7.161   6.334
   93    HA   LYS  13           HA       LYS  13   4.921  -9.400   6.391
   94   1HB   LYS  13          2HB       LYS  13   4.264  -6.491   5.994
   95   2HB   LYS  13          1HB       LYS  13   2.970  -7.678   6.147
   96   1HG   LYS  13          2HG       LYS  13   5.148  -7.876   8.151
   97   2HG   LYS  13          1HG       LYS  13   4.112  -6.453   8.278
   98   1HD   LYS  13          2HD       LYS  13   2.744  -9.058   7.835
   99   2HD   LYS  13          1HD       LYS  13   3.472  -8.806   9.423
  100   1HE   LYS  13          2HE       LYS  13   2.238  -6.664   9.648
  101   2HE   LYS  13          1HE       LYS  13   1.478  -6.951   8.070
  102   1HZ   LYS  13          1HZ       LYS  13   0.944  -8.208  10.609
  103   2HZ   LYS  13          2HZ       LYS  13   1.144  -9.316   9.336
  104   3HZ   LYS  13          3HZ       LYS  13  -0.036  -8.099   9.230
  105    H    ARG  14           H        ARG  14   3.688  -7.066   4.042
  106    HA   ARG  14           HA       ARG  14   4.067  -8.845   1.746
  107   1HB   ARG  14          2HB       ARG  14   1.965  -9.326   3.556
  108   2HB   ARG  14          1HB       ARG  14   1.210  -8.550   2.164
  109   1HG   ARG  14          2HG       ARG  14   1.863 -10.243   0.696
  110   2HG   ARG  14          1HG       ARG  14   3.197 -10.761   1.727
  111   1HD   ARG  14          2HD       ARG  14   0.360 -11.011   2.717
  112   2HD   ARG  14          1HD       ARG  14   1.051 -12.254   1.655
  113    HE   ARG  14           HE       ARG  14   3.025 -12.176   3.390
  114   1HH1  ARG  14          1HH2      ARG  14   0.333 -10.624   4.592
  115   2HH1  ARG  14          2HH2      ARG  14   0.133 -11.640   5.980
  116   1HH2  ARG  14          1HH1      ARG  14   2.493 -13.962   4.950
  117   2HH2  ARG  14          2HH1      ARG  14   1.355 -13.530   6.183
  118    H    ILE  15           H        ILE  15   4.570  -7.179   0.328
  119    HA   ILE  15           HA       ILE  15   3.726  -4.511   0.352
  120    HB   ILE  15           HB       ILE  15   4.284  -4.589  -2.057
  121   1HG1  ILE  15          2HG1      ILE  15   4.285  -7.601  -1.690
  122   2HG1  ILE  15          1HG1      ILE  15   3.000  -6.703  -2.498
  123   1HG2  ILE  15          1HG2      ILE  15   6.464  -4.841  -1.523
  124   2HG2  ILE  15          2HG2      ILE  15   6.247  -6.560  -1.196
  125   3HG2  ILE  15          3HG2      ILE  15   5.926  -5.374   0.070
  126   1HD1  ILE  15          1HD1      ILE  15   4.189  -6.808  -4.406
  127   2HD1  ILE  15          2HD1      ILE  15   5.535  -7.573  -3.562
  128   3HD1  ILE  15          3HD1      ILE  15   5.431  -5.815  -3.644
  129    H    CYS  16           H        CYS  16   1.959  -7.369  -0.531
  130    HA   CYS  16           HA       CYS  16  -0.523  -5.777  -0.874
  131   1HB   CYS  16          2HB       CYS  16   0.413  -5.928  -3.109
  132   2HB   CYS  16          1HB       CYS  16   0.694  -7.656  -2.922
  133    H    TRP  17           H        TRP  17  -2.096  -6.828   0.285
  134    HA   TRP  17           HA       TRP  17  -1.625  -9.571   1.243
  135   1HB   TRP  17          2HB       TRP  17  -2.768  -7.312   2.261
  136   2HB   TRP  17          1HB       TRP  17  -4.201  -8.190   1.726
  137    HD1  TRP  17           HD       TRP  17  -0.913  -9.397   3.388
  138    HE1  TRP  17           1HE      TRP  17  -1.539 -10.876   5.406
  139    HE3  TRP  17           3HE      TRP  17  -6.003  -9.050   3.190
  140    HZ2  TRP  17           2HZ      TRP  17  -3.886 -11.789   6.756
  141    HZ3  TRP  17           3HZ      TRP  17  -7.409 -10.233   4.854
  142    HH2  TRP  17           HH       TRP  17  -6.357 -11.602   6.635
  143    H    TYR  18           H        TYR  18  -4.266 -10.520   1.341
  144    HA   TYR  18           HA       TYR  18  -4.729 -11.180  -1.530
  145   1HB   TYR  18          2HB       TYR  18  -4.467 -12.675   0.788
  146   2HB   TYR  18          1HB       TYR  18  -6.213 -12.629   0.547
  147    HD1  TYR  18           1HD      TYR  18  -4.228 -15.036   0.247
  148    HD2  TYR  18           2HD      TYR  18  -6.007 -12.298  -2.543
  149    HE1  TYR  18           1HE      TYR  18  -4.022 -16.733  -1.548
  150    HE2  TYR  18           2HE      TYR  18  -5.801 -13.996  -4.340
  151    HH   TYR  18           HH       TYR  18  -4.510 -15.971  -4.862
  152    H    ASN  19           H        ASN  19  -6.642 -10.543   1.417
  153    HA   ASN  19           HA       ASN  19  -9.149 -10.157   0.124
  154   1HB   ASN  19          2HB       ASN  19  -7.883  -9.765   2.729
  155   2HB   ASN  19          1HB       ASN  19  -9.117  -8.547   2.404
  156   1HD2  ASN  19          1HD2      ASN  19  -9.131 -11.026   4.232
  157   2HD2  ASN  19          2HD2      ASN  19 -10.536 -11.865   3.779
  158    H    ASN  20           H        ASN  20  -9.503  -8.629  -1.443
  159    HA   ASN  20           HA       ASN  20  -7.928  -6.312  -1.926
  160   1HB   ASN  20          2HB       ASN  20  -9.971  -5.664  -3.281
  161   2HB   ASN  20          1HB       ASN  20  -9.376  -7.295  -3.594
  162   1HD2  ASN  20          1HD2      ASN  20 -11.800  -7.484  -4.329
  163   2HD2  ASN  20          2HD2      ASN  20 -12.911  -7.957  -3.136
  164    H    LYS  21           H        LYS  21 -10.297  -6.907   0.506
  165    HA   LYS  21           HA       LYS  21 -10.921  -4.034   0.884
  166   1HB   LYS  21          2HB       LYS  21 -12.530  -4.899   2.495
  167   2HB   LYS  21          1HB       LYS  21 -12.626  -5.874   1.029
  168   1HG   LYS  21          2HG       LYS  21 -11.292  -7.626   2.027
  169   2HG   LYS  21          1HG       LYS  21 -10.955  -6.626   3.442
  170   1HD   LYS  21          2HD       LYS  21 -13.081  -6.900   4.315
  171   2HD   LYS  21          1HD       LYS  21 -13.815  -7.138   2.730
  172   1HE   LYS  21          2HE       LYS  21 -13.845  -9.344   3.374
  173   2HE   LYS  21          1HE       LYS  21 -12.145  -9.310   2.864
  174   1HZ   LYS  21          1HZ       LYS  21 -13.202  -8.783   5.590
  175   2HZ   LYS  21          2HZ       LYS  21 -11.590  -8.509   5.128
  176   3HZ   LYS  21          3HZ       LYS  21 -12.225 -10.085   5.111
  177    H    TYR  22           H        TYR  22  -8.953  -6.583   2.303
  178    HA   TYR  22           HA       TYR  22  -8.435  -5.433   4.860
  179   1HB   TYR  22          2HB       TYR  22  -7.867  -7.734   4.073
  180   2HB   TYR  22          1HB       TYR  22  -6.614  -7.044   3.042
  181    HD1  TYR  22           1HD      TYR  22  -4.457  -7.179   3.899
  182    HD2  TYR  22           2HD      TYR  22  -7.753  -6.651   6.602
  183    HE1  TYR  22           1HE      TYR  22  -2.883  -7.174   5.816
  184    HE2  TYR  22           2HE      TYR  22  -6.180  -6.645   8.520
  185    HH   TYR  22           HH       TYR  22  -3.370  -5.995   8.591
  186    H    CYS  23           H        CYS  23  -6.649  -5.094   1.773
  187    HA   CYS  23           HA       CYS  23  -4.658  -3.276   2.749
  188   1HB   CYS  23          2HB       CYS  23  -5.082  -4.708   0.502
  189   2HB   CYS  23          1HB       CYS  23  -5.626  -3.130  -0.069
  190    H    ASN  24           H        ASN  24  -7.841  -2.743   1.225
  191    HA   ASN  24           HA       ASN  24  -7.721   0.075   0.915
  192   1HB   ASN  24          2HB       ASN  24  -9.474  -1.812   0.286
  193   2HB   ASN  24          1HB       ASN  24 -10.220  -1.331   1.810
  194   1HD2  ASN  24          1HD2      ASN  24  -9.094   1.512   1.337
  195   2HD2  ASN  24          2HD2      ASN  24 -10.178   2.193   0.221
  196    H    ASP  25           H        ASP  25  -8.485  -1.904   3.765
  197    HA   ASP  25           HA       ASP  25  -9.496   0.124   5.479
  198   1HB   ASP  25          2HB       ASP  25  -9.256  -2.475   5.689
  199   2HB   ASP  25          1HB       ASP  25  -7.681  -2.103   6.392
  200    H    LEU  26           H        LEU  26  -6.140  -1.140   5.337
  201    HA   LEU  26           HA       LEU  26  -4.998   0.866   7.024
  202   1HB   LEU  26          2HB       LEU  26  -4.238  -1.420   5.507
  203   2HB   LEU  26          1HB       LEU  26  -3.154  -0.109   5.044
  204    HG   LEU  26           HG       LEU  26  -3.745  -0.970   7.890
  205   1HD1  LEU  26          1HD1      LEU  26  -2.340  -2.531   6.442
  206   2HD1  LEU  26          2HD1      LEU  26  -1.556  -1.935   7.906
  207   3HD1  LEU  26          3HD1      LEU  26  -1.158  -1.225   6.341
  208   1HD2  LEU  26          1HD2      LEU  26  -1.597   0.922   6.920
  209   2HD2  LEU  26          2HD2      LEU  26  -2.172   0.680   8.569
  210   3HD2  LEU  26          3HD2      LEU  26  -3.196   1.497   7.389
  211    H    CYS  27           H        CYS  27  -5.423   0.695   3.492
  212    HA   CYS  27           HA       CYS  27  -3.917   3.032   2.825
  213   1HB   CYS  27          2HB       CYS  27  -6.148   1.421   1.611
  214   2HB   CYS  27          1HB       CYS  27  -5.643   2.925   0.835
  215    H    LYS  28           H        LYS  28  -7.308   2.587   3.811
  216    HA   LYS  28           HA       LYS  28  -8.182   5.270   3.309
  217   1HB   LYS  28          2HB       LYS  28  -9.207   2.846   4.279
  218   2HB   LYS  28          1HB       LYS  28  -9.395   3.972   5.624
  219   1HG   LYS  28          2HG       LYS  28 -11.307   4.566   4.532
  220   2HG   LYS  28          1HG       LYS  28 -10.209   5.535   3.547
  221   1HD   LYS  28          2HD       LYS  28 -10.055   3.785   1.883
  222   2HD   LYS  28          1HD       LYS  28 -10.966   2.673   2.904
  223   1HE   LYS  28          2HE       LYS  28 -12.043   5.271   1.743
  224   2HE   LYS  28          1HE       LYS  28 -12.449   3.636   1.181
  225   1HZ   LYS  28          1HZ       LYS  28 -13.252   5.006   3.619
  226   2HZ   LYS  28          2HZ       LYS  28 -12.832   3.370   3.799
  227   3HZ   LYS  28          3HZ       LYS  28 -14.070   3.819   2.726
  228    H    GLY  29           H        GLY  29  -6.391   3.778   5.942
  229   1HA   GLY  29          2HA       GLY  29  -6.709   5.870   7.879
  230   2HA   GLY  29          1HA       GLY  29  -5.350   4.739   7.823
  231    H    LEU  30           H        LEU  30  -4.807   5.470   5.005
  232    HA   LEU  30           HA       LEU  30  -3.211   7.922   5.539
  233   1HB   LEU  30          2HB       LEU  30  -3.224   5.889   3.279
  234   2HB   LEU  30          1HB       LEU  30  -2.028   7.169   3.490
  235    HG   LEU  30           HG       LEU  30  -2.532   5.309   5.778
  236   1HD1  LEU  30          1HD1      LEU  30  -1.311   4.591   3.153
  237   2HD1  LEU  30          2HD1      LEU  30  -2.167   3.572   4.309
  238   3HD1  LEU  30          3HD1      LEU  30  -0.490   4.026   4.609
  239   1HD2  LEU  30          1HD2      LEU  30  -1.016   7.103   6.202
  240   2HD2  LEU  30          2HD2      LEU  30  -0.201   6.875   4.654
  241   3HD2  LEU  30          3HD2      LEU  30  -0.001   5.683   5.939
  242    H    LYS  31           H        LYS  31  -6.224   7.643   4.845
  243    HA   LYS  31           HA       LYS  31  -7.752   9.069   3.742
  244   1HB   LYS  31          2HB       LYS  31  -5.685  10.619   4.146
  245   2HB   LYS  31          1HB       LYS  31  -5.386  10.387   2.424
  246   1HG   LYS  31          2HG       LYS  31  -7.059  11.791   1.858
  247   2HG   LYS  31          1HG       LYS  31  -8.188  10.983   2.948
  248   1HD   LYS  31          2HD       LYS  31  -8.089  12.965   4.080
  249   2HD   LYS  31          1HD       LYS  31  -6.617  12.262   4.755
  250   1HE   LYS  31          2HE       LYS  31  -5.503  14.050   3.907
  251   2HE   LYS  31          1HE       LYS  31  -5.831  13.391   2.292
  252   1HZ   LYS  31          1HZ       LYS  31  -7.839  14.960   3.801
  253   2HZ   LYS  31          2HZ       LYS  31  -7.844  14.565   2.149
  254   3HZ   LYS  31          3HZ       LYS  31  -6.729  15.698   2.752
  255    H    ALA  32           H        ALA  32  -6.004   6.698   2.373
  256    HA   ALA  32           HA       ALA  32  -6.446   7.350  -0.462
  257   1HB   ALA  32          1HB       ALA  32  -5.349   5.211  -0.797
  258   2HB   ALA  32          2HB       ALA  32  -5.614   4.766   0.888
  259   3HB   ALA  32          3HB       ALA  32  -4.496   6.068   0.485
  260    H    ASP  33           H        ASP  33  -8.641   7.387  -0.946
  261    HA   ASP  33           HA       ASP  33 -10.671   5.786   0.245
  262   1HB   ASP  33          2HB       ASP  33 -10.462   7.077  -2.494
  263   2HB   ASP  33          1HB       ASP  33 -11.967   6.543  -1.743
  264    H    SER  34           H        SER  34  -9.949   5.441  -3.205
  265    HA   SER  34           HA       SER  34 -10.739   2.681  -3.291
  266   1HB   SER  34          2HB       SER  34 -10.035   2.859  -5.592
  267   2HB   SER  34          1HB       SER  34 -10.697   4.427  -5.139
  268    HG   SER  34           HG       SER  34  -8.292   4.725  -4.488
  269    H    GLY  35           H        GLY  35  -9.480   1.484  -1.754
  270   1HA   GLY  35          2HA       GLY  35  -6.562   1.300  -2.400
  271   2HA   GLY  35          1HA       GLY  35  -7.213   1.049  -0.780
  272    H    TYR  36           H        TYR  36  -7.045  -0.335  -4.030
  273    HA   TYR  36           HA       TYR  36  -7.931  -2.965  -2.886
  274   1HB   TYR  36          2HB       TYR  36  -8.733  -3.451  -5.115
  275   2HB   TYR  36          1HB       TYR  36  -9.288  -1.827  -4.708
  276    HD1  TYR  36           1HD      TYR  36  -8.477   0.107  -5.876
  277    HD2  TYR  36           2HD      TYR  36  -6.755  -3.759  -6.607
  278    HE1  TYR  36           1HE      TYR  36  -7.277   1.015  -7.848
  279    HE2  TYR  36           2HE      TYR  36  -5.556  -2.852  -8.579
  280    HH   TYR  36           HH       TYR  36  -5.665   0.602  -9.366
  281    H    CYS  37           H        CYS  37  -6.655  -4.830  -3.472
  282    HA   CYS  37           HA       CYS  37  -3.835  -4.179  -4.136
  283   1HB   CYS  37          2HB       CYS  37  -5.172  -5.882  -2.352
  284   2HB   CYS  37          1HB       CYS  37  -4.480  -6.961  -3.562
  285    H    TRP  38           H        TRP  38  -2.694  -5.397  -5.808
  286    HA   TRP  38           HA       TRP  38  -4.346  -5.952  -8.167
  287   1HB   TRP  38          2HB       TRP  38  -1.971  -4.889  -7.946
  288   2HB   TRP  38          1HB       TRP  38  -1.407  -6.555  -7.829
  289    HD1  TRP  38           HD       TRP  38  -0.780  -7.569 -10.053
  290    HE1  TRP  38           1HE      TRP  38  -1.480  -7.236 -12.511
  291    HE3  TRP  38           3HE      TRP  38  -4.361  -3.974  -9.472
  292    HZ2  TRP  38           2HZ      TRP  38  -3.316  -5.656 -14.030
  293    HZ3  TRP  38           3HZ      TRP  38  -5.569  -3.075 -11.440
  294    HH2  TRP  38           HH       TRP  38  -5.051  -3.910 -13.717
  295    H    GLY  39           H        GLY  39  -3.972  -8.089  -9.370
  296   1HA   GLY  39          2HA       GLY  39  -4.028 -10.312  -7.381
  297   2HA   GLY  39          1HA       GLY  39  -4.820 -10.357  -8.956
  298    H    TRP  40           H        TRP  40  -2.392  -9.104 -10.216
  299    HA   TRP  40           HA       TRP  40  -0.989 -11.606 -10.790
  300   1HB   TRP  40          2HB       TRP  40  -1.427 -10.041 -12.568
  301   2HB   TRP  40          1HB       TRP  40  -0.721  -8.713 -11.653
  302    HD1  TRP  40           HD       TRP  40   1.638  -8.152 -12.311
  303    HE1  TRP  40           1HE      TRP  40   3.599  -9.412 -13.399
  304    HE3  TRP  40           3HE      TRP  40  -0.425 -12.800 -12.750
  305    HZ2  TRP  40           2HZ      TRP  40   4.226 -12.046 -14.331
  306    HZ3  TRP  40           3HZ      TRP  40   0.873 -14.666 -13.738
  307    HH2  TRP  40           HH       TRP  40   3.192 -14.295 -14.530
  308    H    THR  41           H        THR  41   0.837  -8.639 -10.490
  309    HA   THR  41           HA       THR  41   2.054  -9.388  -7.914
  310    HB   THR  41           HB       THR  41   4.300  -9.666  -8.975
  311    HG1  THR  41           1HG      THR  41   4.529  -9.454 -11.073
  312   1HG2  THR  41          1HG2      THR  41   2.287 -11.530 -10.246
  313   2HG2  THR  41          2HG2      THR  41   2.709 -11.601  -8.535
  314   3HG2  THR  41          3HG2      THR  41   3.942 -11.897  -9.760
  315    H    LEU  42           H        LEU  42   0.674  -7.030  -8.642
  316    HA   LEU  42           HA       LEU  42   2.889  -5.050  -9.073
  317   1HB   LEU  42          2HB       LEU  42   0.254  -5.411 -10.136
  318   2HB   LEU  42          1HB       LEU  42   0.287  -3.888  -9.247
  319    HG   LEU  42           HG       LEU  42   2.307  -4.712 -11.355
  320   1HD1  LEU  42          1HD1      LEU  42  -0.326  -3.572 -11.572
  321   2HD1  LEU  42          2HD1      LEU  42   0.820  -3.946 -12.859
  322   3HD1  LEU  42          3HD1      LEU  42   0.869  -2.372 -12.066
  323   1HD2  LEU  42          1HD2      LEU  42   1.940  -1.921 -10.340
  324   2HD2  LEU  42          2HD2      LEU  42   3.396  -2.707 -10.950
  325   3HD2  LEU  42          3HD2      LEU  42   2.818  -3.063  -9.323
  326    H    SER  43           H        SER  43   2.188  -6.345  -6.458
  327    HA   SER  43           HA       SER  43   1.889  -5.672  -4.214
  328   1HB   SER  43          2HB       SER  43   3.648  -4.073  -5.307
  329   2HB   SER  43          1HB       SER  43   2.358  -2.877  -5.233
  330    HG   SER  43           HG       SER  43   2.454  -2.885  -3.097
  331    H    CYS  44           H        CYS  44   0.714  -3.607  -2.969
  332    HA   CYS  44           HA       CYS  44  -2.089  -3.827  -3.755
  333   1HB   CYS  44          2HB       CYS  44  -1.099  -3.792  -1.408
  334   2HB   CYS  44          1HB       CYS  44  -0.811  -2.068  -1.645
  335    H    TYR  45           H        TYR  45  -3.443  -1.777  -3.953
  336    HA   TYR  45           HA       TYR  45  -1.926   0.499  -5.167
  337   1HB   TYR  45          2HB       TYR  45  -2.862  -1.342  -6.772
  338   2HB   TYR  45          1HB       TYR  45  -4.433  -0.628  -6.408
  339    HD1  TYR  45           1HD      TYR  45  -4.034   2.197  -6.260
  340    HD2  TYR  45           2HD      TYR  45  -2.110  -0.633  -8.856
  341    HE1  TYR  45           1HE      TYR  45  -3.587   4.004  -7.899
  342    HE2  TYR  45           2HE      TYR  45  -1.665   1.175 -10.495
  343    HH   TYR  45           HH       TYR  45  -1.852   4.400  -9.765
  344    H    CYS  46           H        CYS  46  -2.592   2.316  -4.098
  345    HA   CYS  46           HA       CYS  46  -5.496   2.578  -3.435
  346   1HB   CYS  46          2HB       CYS  46  -3.127   3.200  -1.635
  347   2HB   CYS  46          1HB       CYS  46  -4.815   3.504  -1.237
  348    H    GLN  47           H        GLN  47  -6.296   4.583  -3.978
  349    HA   GLN  47           HA       GLN  47  -4.315   6.659  -4.855
  350   1HB   GLN  47          2HB       GLN  47  -7.201   6.367  -5.721
  351   2HB   GLN  47          1HB       GLN  47  -5.906   7.237  -6.541
  352   1HG   GLN  47          2HG       GLN  47  -4.827   5.216  -7.199
  353   2HG   GLN  47          1HG       GLN  47  -5.813   4.246  -6.105
  354   1HE2  GLN  47          1HE2      GLN  47  -6.499   6.682  -8.696
  355   2HE2  GLN  47          2HE2      GLN  47  -7.693   5.744  -9.453
  356    H    GLY  48           H        GLY  48  -4.608   8.772  -4.069
  357   1HA   GLY  48          2HA       GLY  48  -5.931  10.541  -3.059
  358   2HA   GLY  48          1HA       GLY  48  -7.004   9.312  -2.390
  359    H    LEU  49           H        LEU  49  -3.492   9.099  -2.227
  360    HA   LEU  49           HA       LEU  49  -3.732   9.254   0.752
  361   1HB   LEU  49          2HB       LEU  49  -1.151   8.363   0.076
  362   2HB   LEU  49          1HB       LEU  49  -2.490   7.363   0.618
  363    HG   LEU  49           HG       LEU  49  -2.001   8.073  -2.289
  364   1HD1  LEU  49          1HD1      LEU  49  -1.545   5.314  -1.696
  365   2HD1  LEU  49          2HD1      LEU  49  -0.558   6.285  -0.606
  366   3HD1  LEU  49          3HD1      LEU  49  -0.408   6.492  -2.351
  367   1HD2  LEU  49          1HD2      LEU  49  -4.282   7.155  -1.085
  368   2HD2  LEU  49          2HD2      LEU  49  -3.477   5.638  -1.485
  369   3HD2  LEU  49          3HD2      LEU  49  -3.843   6.803  -2.757
  370    HA   PRO  50           HA       PRO  50  -1.260  12.868   1.013
  371   1HB   PRO  50          2HB       PRO  50   0.793  12.257   2.719
  372   2HB   PRO  50          1HB       PRO  50  -0.885  12.459   3.265
  373   1HG   PRO  50          2HG       PRO  50   0.630   9.952   2.704
  374   2HG   PRO  50          1HG       PRO  50  -0.490  10.320   4.027
  375   1HD   PRO  50          2HD       PRO  50  -1.214   8.857   1.869
  376   2HD   PRO  50          1HD       PRO  50  -2.349   9.905   2.745
  377    H    ASP  51           H        ASP  51   0.724  13.884   0.221
  378    HA   ASP  51           HA       ASP  51   1.964  12.591  -1.992
  379   1HB   ASP  51          2HB       ASP  51   1.757  15.077  -1.392
  380   2HB   ASP  51          1HB       ASP  51   3.130  14.827  -0.313
  381    H    ASN  52           H        ASN  52   2.579  12.378   1.396
  382    HA   ASN  52           HA       ASN  52   5.274  11.175   0.936
  383   1HB   ASN  52          2HB       ASN  52   4.603  13.033   2.674
  384   2HB   ASN  52          1HB       ASN  52   3.966  11.675   3.603
  385   1HD2  ASN  52          1HD2      ASN  52   6.158   9.901   2.354
  386   2HD2  ASN  52          2HD2      ASN  52   7.550  10.287   3.246
  387    H    ALA  53           H        ALA  53   2.533   9.924   0.366
  388    HA   ALA  53           HA       ALA  53   1.962   7.916   2.335
  389   1HB   ALA  53          1HB       ALA  53   1.562   7.535  -0.626
  390   2HB   ALA  53          2HB       ALA  53   0.684   8.808   0.218
  391   3HB   ALA  53          3HB       ALA  53   0.473   7.127   0.701
  392    H    ARG  54           H        ARG  54   3.207   6.183   2.899
  393    HA   ARG  54           HA       ARG  54   5.634   5.451   1.514
  394   1HB   ARG  54          2HB       ARG  54   5.335   5.139   3.906
  395   2HB   ARG  54          1HB       ARG  54   3.925   4.116   3.634
  396   1HG   ARG  54          2HG       ARG  54   5.993   2.970   2.102
  397   2HG   ARG  54          1HG       ARG  54   6.723   3.381   3.654
  398   1HD   ARG  54          2HD       ARG  54   4.028   2.106   3.757
  399   2HD   ARG  54          1HD       ARG  54   5.391   1.069   3.289
  400    HE   ARG  54           HE       ARG  54   4.940   2.017   5.935
  401   1HH1  ARG  54          1HH1      ARG  54   7.374   1.459   3.566
  402   2HH1  ARG  54          2HH1      ARG  54   8.684   1.547   4.697
  403   1HH2  ARG  54          1HH2      ARG  54   6.648   2.278   7.406
  404   2HH2  ARG  54          2HH2      ARG  54   8.273   2.010   6.869
  405    H    ILE  55           H        ILE  55   5.562   4.506  -0.476
  406    HA   ILE  55           HA       ILE  55   3.827   2.114  -0.814
  407    HB   ILE  55           HB       ILE  55   3.260   3.117  -3.124
  408   1HG1  ILE  55          2HG1      ILE  55   3.267   5.722  -2.906
  409   2HG1  ILE  55          1HG1      ILE  55   4.556   5.462  -1.736
  410   1HG2  ILE  55          1HG2      ILE  55   2.275   4.138  -0.472
  411   2HG2  ILE  55          2HG2      ILE  55   1.472   3.066  -1.615
  412   3HG2  ILE  55          3HG2      ILE  55   1.603   4.786  -1.967
  413   1HD1  ILE  55          1HD1      ILE  55   6.035   5.122  -3.385
  414   2HD1  ILE  55          2HD1      ILE  55   4.768   5.493  -4.556
  415   3HD1  ILE  55          3HD1      ILE  55   5.036   3.827  -4.044
  416    H    LYS  56           H        LYS  56   4.995   0.484  -1.686
  417    HA   LYS  56           HA       LYS  56   7.019  -0.583  -2.401
  418   1HB   LYS  56          2HB       LYS  56   5.386   0.731  -4.405
  419   2HB   LYS  56          1HB       LYS  56   7.050   0.560  -4.966
  420   1HG   LYS  56          2HG       LYS  56   5.512  -1.725  -3.713
  421   2HG   LYS  56          1HG       LYS  56   5.511  -1.418  -5.450
  422   1HD   LYS  56          2HD       LYS  56   7.393  -2.668  -5.529
  423   2HD   LYS  56          1HD       LYS  56   8.203  -1.289  -4.784
  424   1HE   LYS  56          2HE       LYS  56   8.575  -2.500  -2.911
  425   2HE   LYS  56          1HE       LYS  56   6.833  -2.792  -2.737
  426   1HZ   LYS  56          1HZ       LYS  56   8.367  -4.797  -3.177
  427   2HZ   LYS  56          2HZ       LYS  56   8.399  -4.234  -4.780
  428   3HZ   LYS  56          3HZ       LYS  56   6.924  -4.673  -4.060
  429    H    ARG  57           H        ARG  57   8.008   1.441  -0.854
  430    HA   ARG  57           HA       ARG  57  10.194   2.564  -2.548
  431   1HB   ARG  57          2HB       ARG  57   9.948   4.645  -1.553
  432   2HB   ARG  57          1HB       ARG  57   8.277   4.094  -1.659
  433   1HG   ARG  57          2HG       ARG  57   9.044   3.004   0.713
  434   2HG   ARG  57          1HG       ARG  57   9.975   4.504   0.701
  435   1HD   ARG  57          2HD       ARG  57   7.484   5.291  -0.242
  436   2HD   ARG  57          1HD       ARG  57   7.100   4.133   1.046
  437    HE   ARG  57           HE       ARG  57   8.186   5.568   2.622
  438   1HH1  ARG  57          1HH2      ARG  57   7.207   7.436   0.181
  439   2HH1  ARG  57          2HH2      ARG  57   8.497   8.590   0.226
  440   1HH2  ARG  57          1HH1      ARG  57  10.486   6.681   2.329
  441   2HH2  ARG  57          2HH1      ARG  57  10.353   8.163   1.442
  442    H    SER  58           H        SER  58   9.584   0.310  -0.327
  443    HA   SER  58           HA       SER  58  11.807   0.918   1.537
  444   1HB   SER  58          2HB       SER  58   9.439  -0.827   1.368
  445   2HB   SER  58          1HB       SER  58  10.839  -1.599   2.106
  446    HG   SER  58           HG       SER  58   9.837   0.961   2.818
  447    H    GLY  59           H        GLY  59  13.658  -0.482   1.708
  448   1HA   GLY  59          2HA       GLY  59  14.511  -1.641  -0.834
  449   2HA   GLY  59          1HA       GLY  59  15.465  -1.581   0.648
  450    H    ARG  60           H        ARG  60  16.051  -3.704   0.936
  451    HA   ARG  60           HA       ARG  60  14.100  -5.878   0.511
  452   1HB   ARG  60          2HB       ARG  60  16.958  -5.882   1.536
  453   2HB   ARG  60          1HB       ARG  60  16.062  -7.279   0.939
  454   1HG   ARG  60          2HG       ARG  60  16.654  -4.813  -0.720
  455   2HG   ARG  60          1HG       ARG  60  17.619  -6.289  -0.766
  456   1HD   ARG  60          2HD       ARG  60  15.815  -7.569  -1.659
  457   2HD   ARG  60          1HD       ARG  60  14.631  -6.305  -1.269
  458    HE   ARG  60           HE       ARG  60  15.404  -5.043  -3.141
  459   1HH1  ARG  60          1HH2      ARG  60  18.352  -5.414  -2.618
  460   2HH1  ARG  60          2HH2      ARG  60  18.842  -6.332  -4.003
  461   1HH2  ARG  60          1HH1      ARG  60  15.614  -7.252  -4.870
  462   2HH2  ARG  60          2HH1      ARG  60  17.294  -7.372  -5.276
  463    H    CYS  61           H        CYS  61  12.570  -5.524   2.232
  464    HA   CYS  61           HA       CYS  61  11.755  -5.711   4.445
  465   1HB   CYS  61          2HB       CYS  61  13.650  -7.749   3.823
  466   2HB   CYS  61          1HB       CYS  61  13.928  -7.275   5.500
  467    H    ARG  62           H        ARG  62  11.999  -3.644   5.363
  468    HA   ARG  62           HA       ARG  62  14.625  -2.643   6.209
  469   1HB   ARG  62          2HB       ARG  62  12.017  -1.661   5.619
  470   2HB   ARG  62          1HB       ARG  62  12.388  -1.190   7.278
  471   1HG   ARG  62          2HG       ARG  62  14.171   0.135   6.656
  472   2HG   ARG  62          1HG       ARG  62  14.535  -0.840   5.233
  473   1HD   ARG  62          2HD       ARG  62  13.616   1.085   4.253
  474   2HD   ARG  62          1HD       ARG  62  12.173   0.062   4.411
  475    HE   ARG  62           HE       ARG  62  12.723   2.461   5.969
  476   1HH1  ARG  62          1HH1      ARG  62  10.375   0.275   5.166
  477   2HH1  ARG  62          2HH1      ARG  62   9.591   0.248   6.710
  478   1HH2  ARG  62          1HH2      ARG  62  12.095   2.033   8.311
  479   2HH2  ARG  62          2HH2      ARG  62  10.565   1.242   8.492
  480    H    ALA  63           H        ALA  63  14.125  -5.083   7.516
  481    HA   ALA  63           HA       ALA  63  14.366  -4.304  10.300
  482   1HB   ALA  63          1HB       ALA  63  12.171  -4.302  10.829
  483   2HB   ALA  63          2HB       ALA  63  12.073  -5.995  10.340
  484   3HB   ALA  63          3HB       ALA  63  11.756  -4.718   9.166
  Start of MODEL   10
    1   1H    LYS   1          1HT       LYS   1  -1.520  13.826  -1.716
    2   2H    LYS   1          2HT       LYS   1  -2.885  12.878  -1.365
    3   3H    LYS   1          3HT       LYS   1  -3.015  14.570  -1.426
    4    HA   LYS   1           HA       LYS   1  -3.833  13.204  -3.444
    5   1HB   LYS   1          2HB       LYS   1  -3.159  15.144  -4.821
    6   2HB   LYS   1          1HB       LYS   1  -3.632  15.666  -3.202
    7   1HG   LYS   1          2HG       LYS   1  -1.499  16.268  -2.624
    8   2HG   LYS   1          1HG       LYS   1  -0.765  14.975  -3.574
    9   1HD   LYS   1          2HD       LYS   1  -2.046  16.697  -5.424
   10   2HD   LYS   1          1HD       LYS   1  -1.163  17.734  -4.302
   11   1HE   LYS   1          2HE       LYS   1   0.907  16.520  -4.719
   12   2HE   LYS   1          1HE       LYS   1   0.050  15.338  -5.727
   13   1HZ   LYS   1          1HZ       LYS   1  -0.780  17.601  -6.830
   14   2HZ   LYS   1          2HZ       LYS   1   0.607  16.777  -7.362
   15   3HZ   LYS   1          3HZ       LYS   1   0.754  18.105  -6.311
   16    H    ILE   2           H        ILE   2  -2.124  11.245  -2.956
   17    HA   ILE   2           HA       ILE   2  -0.188  11.321  -5.238
   18    HB   ILE   2           HB       ILE   2   0.781  11.648  -2.886
   19   1HG1  ILE   2          2HG1      ILE   2   1.691   9.177  -4.389
   20   2HG1  ILE   2          1HG1      ILE   2   2.070  10.828  -4.880
   21   1HG2  ILE   2          1HG2      ILE   2  -0.706  10.032  -1.749
   22   2HG2  ILE   2          2HG2      ILE   2   0.989   9.604  -1.522
   23   3HG2  ILE   2          3HG2      ILE   2   0.005   8.722  -2.689
   24   1HD1  ILE   2          1HD1      ILE   2   2.903   9.417  -2.337
   25   2HD1  ILE   2          2HD1      ILE   2   3.045  11.163  -2.549
   26   3HD1  ILE   2          3HD1      ILE   2   3.946  10.070  -3.601
   27    H    ASP   3           H        ASP   3   0.411   9.046  -5.917
   28    HA   ASP   3           HA       ASP   3  -1.655   7.005  -5.217
   29   1HB   ASP   3          2HB       ASP   3  -0.866   7.623  -8.069
   30   2HB   ASP   3          1HB       ASP   3  -2.279   6.739  -7.495
   31    H    GLY   4           H        GLY   4  -0.782   4.930  -5.165
   32   1HA   GLY   4          2HA       GLY   4   1.379   3.989  -6.737
   33   2HA   GLY   4          1HA       GLY   4   2.059   4.588  -5.225
   34    H    TYR   5           H        TYR   5   2.652   2.503  -4.486
   35    HA   TYR   5           HA       TYR   5   0.343   0.719  -3.782
   36   1HB   TYR   5          2HB       TYR   5   3.210  -0.076  -4.357
   37   2HB   TYR   5          1HB       TYR   5   1.811  -1.142  -4.236
   38    HD1  TYR   5           1HD      TYR   5   0.354  -1.496  -6.094
   39    HD2  TYR   5           2HD      TYR   5   3.350   1.579  -6.254
   40    HE1  TYR   5           1HE      TYR   5  -0.084  -1.194  -8.516
   41    HE2  TYR   5           2HE      TYR   5   2.910   1.881  -8.676
   42    HH   TYR   5           HH       TYR   5   0.303   0.993 -10.194
   43    HA   PRO   6           HA       PRO   6   1.978   1.702   0.274
   44   1HB   PRO   6          2HB       PRO   6  -0.054   0.510   1.669
   45   2HB   PRO   6          1HB       PRO   6  -0.203   2.118   0.932
   46   1HG   PRO   6          2HG       PRO   6  -1.224  -0.504  -0.026
   47   2HG   PRO   6          1HG       PRO   6  -1.955   1.103  -0.134
   48   1HD   PRO   6          2HD       PRO   6  -0.684  -0.150  -2.214
   49   2HD   PRO   6          1HD       PRO   6  -0.862   1.611  -2.067
   50    H    VAL   7           H        VAL   7   3.414   0.455   1.464
   51    HA   VAL   7           HA       VAL   7   3.048  -2.518   1.466
   52    HB   VAL   7           HB       VAL   7   5.504  -2.683   1.015
   53   1HG1  VAL   7          1HG1      VAL   7   4.400  -3.025  -0.975
   54   2HG1  VAL   7          2HG1      VAL   7   5.233  -1.528  -1.391
   55   3HG1  VAL   7          3HG1      VAL   7   3.545  -1.486  -0.888
   56   1HG2  VAL   7          1HG2      VAL   7   5.185   0.302   0.983
   57   2HG2  VAL   7          2HG2      VAL   7   6.400  -0.444  -0.052
   58   3HG2  VAL   7          3HG2      VAL   7   6.468  -0.673   1.696
   59    H    ASP   8           H        ASP   8   5.214  -3.252   2.942
   60    HA   ASP   8           HA       ASP   8   4.543  -2.257   5.613
   61   1HB   ASP   8          2HB       ASP   8   5.554  -4.589   4.440
   62   2HB   ASP   8          1HB       ASP   8   6.909  -3.947   5.370
   63    H    TYR   9           H        TYR   9   6.472  -1.734   7.118
   64    HA   TYR   9           HA       TYR   9   7.801   0.633   6.228
   65   1HB   TYR   9          2HB       TYR   9   7.223  -0.466   8.590
   66   2HB   TYR   9          1HB       TYR   9   8.873  -1.066   8.450
   67    HD1  TYR   9           1HD      TYR   9   9.353   1.624   6.581
   68    HD2  TYR   9           2HD      TYR   9   8.189   0.776  10.630
   69    HE1  TYR   9           1HE      TYR   9  10.216   3.837   7.293
   70    HE2  TYR   9           2HE      TYR   9   9.051   2.990  11.339
   71    HH   TYR   9           HH       TYR   9  11.127   4.732   9.805
   72    H    TRP  10           H        TRP  10   8.584  -2.728   5.876
   73    HA   TRP  10           HA       TRP  10  11.258  -1.971   4.742
   74   1HB   TRP  10          2HB       TRP  10  10.656  -4.563   6.175
   75   2HB   TRP  10          1HB       TRP  10  12.226  -3.846   5.842
   76    HD1  TRP  10           HD       TRP  10  12.990  -1.777   7.367
   77    HE1  TRP  10           1HE      TRP  10  12.243  -1.036   9.722
   78    HE3  TRP  10           3HE      TRP  10   8.666  -4.443   7.787
   79    HZ2  TRP  10           2HZ      TRP  10  10.086  -1.519  11.545
   80    HZ3  TRP  10           3HZ      TRP  10   7.281  -4.290   9.839
   81    HH2  TRP  10           HH       TRP  10   7.987  -2.831  11.717
   82    H    ASN  11           H        ASN  11   8.317  -2.875   3.820
   83    HA   ASN  11           HA       ASN  11   7.462  -4.119   1.995
   84   1HB   ASN  11          2HB       ASN  11  10.423  -3.976   1.322
   85   2HB   ASN  11          1HB       ASN  11   9.169  -4.469   0.183
   86   1HD2  ASN  11          1HD2      ASN  11  10.932  -2.042   0.046
   87   2HD2  ASN  11          2HD2      ASN  11   9.875  -0.715   0.005
   88    H    CYS  12           H        CYS  12   8.264  -5.519   4.440
   89    HA   CYS  12           HA       CYS  12   9.525  -8.035   3.561
   90   1HB   CYS  12          2HB       CYS  12   8.577  -6.818   6.147
   91   2HB   CYS  12          1HB       CYS  12   9.053  -8.514   6.070
   92    H    LYS  13           H        LYS  13   6.426  -7.148   5.141
   93    HA   LYS  13           HA       LYS  13   5.262  -9.639   3.933
   94   1HB   LYS  13          2HB       LYS  13   5.279  -8.480   6.671
   95   2HB   LYS  13          1HB       LYS  13   3.780  -9.254   6.153
   96   1HG   LYS  13          2HG       LYS  13   4.699 -11.266   6.555
   97   2HG   LYS  13          1HG       LYS  13   5.920 -10.936   5.325
   98   1HD   LYS  13          2HD       LYS  13   6.986 -11.439   7.485
   99   2HD   LYS  13          1HD       LYS  13   7.299  -9.768   7.012
  100   1HE   LYS  13          2HE       LYS  13   5.098  -9.283   8.412
  101   2HE   LYS  13          1HE       LYS  13   5.532 -10.812   9.203
  102   1HZ   LYS  13          1HZ       LYS  13   6.921  -9.504  10.377
  103   2HZ   LYS  13          2HZ       LYS  13   6.926  -8.264   9.215
  104   3HZ   LYS  13          3HZ       LYS  13   7.917  -9.629   9.010
  105    H    ARG  14           H        ARG  14   4.176  -6.554   5.438
  106    HA   ARG  14           HA       ARG  14   1.590  -6.322   4.627
  107   1HB   ARG  14          2HB       ARG  14   2.930  -4.611   5.806
  108   2HB   ARG  14          1HB       ARG  14   3.737  -4.208   4.294
  109   1HG   ARG  14          2HG       ARG  14   2.031  -2.595   4.424
  110   2HG   ARG  14          1HG       ARG  14   1.332  -3.829   3.374
  111   1HD   ARG  14          2HD       ARG  14  -0.401  -3.459   4.927
  112   2HD   ARG  14          1HD       ARG  14   0.442  -4.845   5.646
  113    HE   ARG  14           HE       ARG  14   1.787  -2.594   6.617
  114   1HH1  ARG  14          1HH1      ARG  14   0.433  -4.473   8.465
  115   2HH1  ARG  14          2HH1      ARG  14  -0.802  -3.487   9.175
  116   1HH2  ARG  14          1HH2      ARG  14  -0.613  -1.028   6.738
  117   2HH2  ARG  14          2HH2      ARG  14  -1.394  -1.538   8.198
  118    H    ILE  15           H        ILE  15   3.430  -4.261   2.497
  119    HA   ILE  15           HA       ILE  15   3.279  -3.990   0.151
  120    HB   ILE  15           HB       ILE  15   3.447  -6.988   0.556
  121   1HG1  ILE  15          2HG1      ILE  15   5.532  -4.919  -0.208
  122   2HG1  ILE  15          1HG1      ILE  15   5.332  -5.597   1.409
  123   1HG2  ILE  15          1HG2      ILE  15   3.530  -5.307  -1.944
  124   2HG2  ILE  15          2HG2      ILE  15   2.651  -6.808  -1.653
  125   3HG2  ILE  15          3HG2      ILE  15   4.404  -6.836  -1.856
  126   1HD1  ILE  15          1HD1      ILE  15   5.445  -7.747  -0.490
  127   2HD1  ILE  15          2HD1      ILE  15   6.552  -7.396   0.837
  128   3HD1  ILE  15          3HD1      ILE  15   6.825  -6.681  -0.752
  129    H    CYS  16           H        CYS  16   1.637  -7.079  -0.009
  130    HA   CYS  16           HA       CYS  16  -0.975  -5.696  -0.509
  131   1HB   CYS  16          2HB       CYS  16   0.639  -6.495  -2.484
  132   2HB   CYS  16          1HB       CYS  16  -0.128  -8.042  -2.158
  133    H    TRP  17           H        TRP  17  -2.675  -6.761   0.496
  134    HA   TRP  17           HA       TRP  17  -2.063  -9.201   2.042
  135   1HB   TRP  17          2HB       TRP  17  -3.806  -6.925   2.174
  136   2HB   TRP  17          1HB       TRP  17  -4.787  -8.389   2.241
  137    HD1  TRP  17           HD       TRP  17  -2.862 -10.302   3.778
  138    HE1  TRP  17           1HE      TRP  17  -2.324  -9.894   6.266
  139    HE3  TRP  17           3HE      TRP  17  -4.013  -5.340   4.124
  140    HZ2  TRP  17           2HZ      TRP  17  -2.375  -7.743   8.153
  141    HZ3  TRP  17           3HZ      TRP  17  -3.759  -4.137   6.274
  142    HH2  TRP  17           HH       TRP  17  -2.942  -5.331   8.289
  143    H    TYR  18           H        TYR  18  -4.727 -10.271   2.016
  144    HA   TYR  18           HA       TYR  18  -4.726 -11.555  -0.686
  145   1HB   TYR  18          2HB       TYR  18  -5.172 -12.378   2.119
  146   2HB   TYR  18          1HB       TYR  18  -6.287 -13.094   0.956
  147    HD1  TYR  18           1HD      TYR  18  -5.540 -15.312   0.688
  148    HD2  TYR  18           2HD      TYR  18  -2.721 -12.077   0.490
  149    HE1  TYR  18           1HE      TYR  18  -3.776 -16.895  -0.040
  150    HE2  TYR  18           2HE      TYR  18  -0.956 -13.660  -0.237
  151    HH   TYR  18           HH       TYR  18  -0.964 -15.985  -1.457
  152    H    ASN  19           H        ASN  19  -6.744  -9.905   1.693
  153    HA   ASN  19           HA       ASN  19  -9.193 -10.264   0.088
  154   1HB   ASN  19          2HB       ASN  19  -8.366  -9.216   2.748
  155   2HB   ASN  19          1HB       ASN  19  -9.831  -8.520   2.054
  156   1HD2  ASN  19          1HD2      ASN  19 -11.280  -9.622   3.535
  157   2HD2  ASN  19          2HD2      ASN  19 -11.513 -11.303   3.478
  158    H    ASN  20           H        ASN  20 -10.334  -8.460  -0.864
  159    HA   ASN  20           HA       ASN  20  -8.552  -6.362  -1.921
  160   1HB   ASN  20          2HB       ASN  20 -10.491  -7.811  -3.022
  161   2HB   ASN  20          1HB       ASN  20 -11.509  -6.513  -2.400
  162   1HD2  ASN  20          1HD2      ASN  20  -9.425  -7.398  -4.982
  163   2HD2  ASN  20          2HD2      ASN  20  -9.285  -5.864  -5.697
  164    H    LYS  21           H        LYS  21 -10.845  -6.737   0.637
  165    HA   LYS  21           HA       LYS  21 -11.340  -3.815   0.852
  166   1HB   LYS  21          2HB       LYS  21 -13.168  -5.492   1.073
  167   2HB   LYS  21          1HB       LYS  21 -12.336  -6.189   2.463
  168   1HG   LYS  21          2HG       LYS  21 -12.465  -3.963   3.598
  169   2HG   LYS  21          1HG       LYS  21 -13.422  -3.367   2.240
  170   1HD   LYS  21          2HD       LYS  21 -15.080  -4.030   3.755
  171   2HD   LYS  21          1HD       LYS  21 -14.930  -5.452   2.722
  172   1HE   LYS  21          2HE       LYS  21 -14.803  -6.424   4.851
  173   2HE   LYS  21          1HE       LYS  21 -13.083  -6.148   4.507
  174   1HZ   LYS  21          1HZ       LYS  21 -14.923  -4.464   6.103
  175   2HZ   LYS  21          2HZ       LYS  21 -13.462  -3.856   5.482
  176   3HZ   LYS  21          3HZ       LYS  21 -13.448  -5.150   6.584
  177    H    TYR  22           H        TYR  22  -9.154  -6.162   2.005
  178    HA   TYR  22           HA       TYR  22  -8.716  -5.196   4.690
  179   1HB   TYR  22          2HB       TYR  22  -7.748  -7.188   2.877
  180   2HB   TYR  22          1HB       TYR  22  -6.356  -6.319   3.526
  181    HD1  TYR  22           1HD      TYR  22  -9.302  -8.378   4.374
  182    HD2  TYR  22           2HD      TYR  22  -5.809  -6.391   5.888
  183    HE1  TYR  22           1HE      TYR  22  -9.539  -9.596   6.522
  184    HE2  TYR  22           2HE      TYR  22  -6.045  -7.608   8.035
  185    HH   TYR  22           HH       TYR  22  -7.765 -10.288   8.448
  186    H    CYS  23           H        CYS  23  -6.718  -4.776   1.736
  187    HA   CYS  23           HA       CYS  23  -5.038  -2.735   2.858
  188   1HB   CYS  23          2HB       CYS  23  -5.071  -4.321   0.644
  189   2HB   CYS  23          1HB       CYS  23  -5.552  -2.779  -0.065
  190    H    ASN  24           H        ASN  24  -8.170  -2.649   1.254
  191    HA   ASN  24           HA       ASN  24  -8.199   0.169   0.614
  192   1HB   ASN  24          2HB       ASN  24  -9.657  -1.702  -0.294
  193   2HB   ASN  24          1HB       ASN  24 -10.514  -1.692   1.247
  194   1HD2  ASN  24          1HD2      ASN  24  -9.254   1.116  -0.610
  195   2HD2  ASN  24          2HD2      ASN  24 -10.768   1.857  -0.811
  196    H    ASP  25           H        ASP  25  -9.304  -1.721   3.436
  197    HA   ASP  25           HA       ASP  25 -10.593   0.369   4.866
  198   1HB   ASP  25          2HB       ASP  25  -9.521  -2.309   5.295
  199   2HB   ASP  25          1HB       ASP  25  -9.336  -1.300   6.731
  200    H    LEU  26           H        LEU  26  -7.178  -0.698   4.951
  201    HA   LEU  26           HA       LEU  26  -6.362   1.369   6.828
  202   1HB   LEU  26          2HB       LEU  26  -5.154  -0.781   5.154
  203   2HB   LEU  26          1HB       LEU  26  -4.076   0.520   5.660
  204    HG   LEU  26           HG       LEU  26  -5.896  -0.784   7.667
  205   1HD1  LEU  26          1HD1      LEU  26  -3.707  -2.170   8.161
  206   2HD1  LEU  26          2HD1      LEU  26  -3.382  -1.888   6.451
  207   3HD1  LEU  26          3HD1      LEU  26  -4.848  -2.736   6.941
  208   1HD2  LEU  26          1HD2      LEU  26  -4.840   0.814   8.880
  209   2HD2  LEU  26          2HD2      LEU  26  -3.637   1.085   7.620
  210   3HD2  LEU  26          3HD2      LEU  26  -3.418  -0.224   8.782
  211    H    CYS  27           H        CYS  27  -6.124   0.964   3.285
  212    HA   CYS  27           HA       CYS  27  -4.637   3.316   2.716
  213   1HB   CYS  27          2HB       CYS  27  -6.597   1.536   1.302
  214   2HB   CYS  27          1HB       CYS  27  -6.093   3.030   0.512
  215    H    LYS  28           H        LYS  28  -8.134   2.802   3.145
  216    HA   LYS  28           HA       LYS  28  -9.010   5.418   2.410
  217   1HB   LYS  28          2HB       LYS  28 -10.028   3.311   4.339
  218   2HB   LYS  28          1HB       LYS  28 -10.951   4.758   3.932
  219   1HG   LYS  28          2HG       LYS  28  -9.864   2.932   1.790
  220   2HG   LYS  28          1HG       LYS  28 -11.428   2.632   2.549
  221   1HD   LYS  28          2HD       LYS  28 -11.256   5.409   1.851
  222   2HD   LYS  28          1HD       LYS  28 -10.837   4.439   0.438
  223   1HE   LYS  28          2HE       LYS  28 -13.002   3.832   0.152
  224   2HE   LYS  28          1HE       LYS  28 -13.114   3.286   1.837
  225   1HZ   LYS  28          1HZ       LYS  28 -13.427   5.532   2.561
  226   2HZ   LYS  28          2HZ       LYS  28 -14.566   5.212   1.341
  227   3HZ   LYS  28          3HZ       LYS  28 -13.182   6.134   0.994
  228    H    GLY  29           H        GLY  29  -7.510   4.159   5.328
  229   1HA   GLY  29          2HA       GLY  29  -8.183   6.293   7.111
  230   2HA   GLY  29          1HA       GLY  29  -6.744   5.273   7.253
  231    H    LEU  30           H        LEU  30  -5.721   5.871   4.638
  232    HA   LEU  30           HA       LEU  30  -4.520   8.523   5.198
  233   1HB   LEU  30          2HB       LEU  30  -3.982   6.272   3.236
  234   2HB   LEU  30          1HB       LEU  30  -3.038   7.760   3.280
  235    HG   LEU  30           HG       LEU  30  -3.433   6.247   5.833
  236   1HD1  LEU  30          1HD1      LEU  30  -0.983   5.471   4.495
  237   2HD1  LEU  30          2HD1      LEU  30  -2.386   5.007   3.529
  238   3HD1  LEU  30          3HD1      LEU  30  -2.237   4.447   5.195
  239   1HD2  LEU  30          1HD2      LEU  30  -1.815   8.412   4.790
  240   2HD2  LEU  30          2HD2      LEU  30  -0.786   7.141   5.449
  241   3HD2  LEU  30          3HD2      LEU  30  -2.021   7.889   6.463
  242    H    LYS  31           H        LYS  31  -7.350   7.973   4.110
  243    HA   LYS  31           HA       LYS  31  -8.788   9.135   2.639
  244   1HB   LYS  31          2HB       LYS  31  -7.017  10.919   3.315
  245   2HB   LYS  31          1HB       LYS  31  -6.347  10.641   1.708
  246   1HG   LYS  31          2HG       LYS  31  -7.933  11.949   0.799
  247   2HG   LYS  31          1HG       LYS  31  -9.190  10.911   1.472
  248   1HD   LYS  31          2HD       LYS  31  -9.739  12.518   2.944
  249   2HD   LYS  31          1HD       LYS  31  -8.104  12.473   3.605
  250   1HE   LYS  31          2HE       LYS  31  -8.220  14.693   2.872
  251   2HE   LYS  31          1HE       LYS  31  -7.551  13.909   1.427
  252   1HZ   LYS  31          1HZ       LYS  31 -10.270  14.860   1.931
  253   2HZ   LYS  31          2HZ       LYS  31 -10.102  13.436   1.021
  254   3HZ   LYS  31          3HZ       LYS  31  -9.371  14.875   0.494
  255    H    ALA  32           H        ALA  32  -6.735   6.843   1.763
  256    HA   ALA  32           HA       ALA  32  -6.566   7.333  -1.131
  257   1HB   ALA  32          1HB       ALA  32  -5.420   5.614   0.879
  258   2HB   ALA  32          2HB       ALA  32  -4.866   5.888  -0.771
  259   3HB   ALA  32          3HB       ALA  32  -6.047   4.625  -0.439
  260    H    ASP  33           H        ASP  33  -8.846   7.501  -1.691
  261    HA   ASP  33           HA       ASP  33 -10.971   5.854  -0.984
  262   1HB   ASP  33          2HB       ASP  33 -10.222   7.658  -3.115
  263   2HB   ASP  33          1HB       ASP  33 -11.199   6.336  -3.756
  264    H    SER  34           H        SER  34  -9.725   5.326  -4.249
  265    HA   SER  34           HA       SER  34 -10.414   2.527  -4.215
  266   1HB   SER  34          2HB       SER  34  -8.525   3.993  -6.074
  267   2HB   SER  34          1HB       SER  34  -9.490   2.566  -6.444
  268    HG   SER  34           HG       SER  34 -10.424   4.543  -7.201
  269    H    GLY  35           H        GLY  35  -9.254   1.552  -2.450
  270   1HA   GLY  35          2HA       GLY  35  -6.323   1.268  -2.962
  271   2HA   GLY  35          1HA       GLY  35  -6.957   1.437  -1.324
  272    H    TYR  36           H        TYR  36  -6.456  -0.745  -3.972
  273    HA   TYR  36           HA       TYR  36  -7.702  -2.943  -2.349
  274   1HB   TYR  36          2HB       TYR  36  -8.015  -4.033  -4.596
  275   2HB   TYR  36          1HB       TYR  36  -8.898  -2.517  -4.421
  276    HD1  TYR  36           1HD      TYR  36  -5.936  -4.132  -5.944
  277    HD2  TYR  36           2HD      TYR  36  -8.294  -0.549  -5.684
  278    HE1  TYR  36           1HE      TYR  36  -4.750  -3.207  -7.915
  279    HE2  TYR  36           2HE      TYR  36  -7.107   0.375  -7.656
  280    HH   TYR  36           HH       TYR  36  -5.350   0.105  -9.035
  281    H    CYS  37           H        CYS  37  -6.649  -5.127  -3.561
  282    HA   CYS  37           HA       CYS  37  -3.672  -4.781  -3.353
  283   1HB   CYS  37          2HB       CYS  37  -4.585  -5.728  -1.308
  284   2HB   CYS  37          1HB       CYS  37  -5.532  -6.897  -2.225
  285    H    TRP  38           H        TRP  38  -2.621  -5.575  -5.160
  286    HA   TRP  38           HA       TRP  38  -4.130  -6.998  -7.232
  287   1HB   TRP  38          2HB       TRP  38  -2.200  -5.230  -7.374
  288   2HB   TRP  38          1HB       TRP  38  -1.142  -6.623  -7.147
  289    HD1  TRP  38           HD       TRP  38  -0.570  -7.973  -9.220
  290    HE1  TRP  38           1HE      TRP  38  -1.458  -8.099 -11.637
  291    HE3  TRP  38           3HE      TRP  38  -4.630  -4.900  -8.829
  292    HZ2  TRP  38           2HZ      TRP  38  -3.607  -7.036 -13.200
  293    HZ3  TRP  38           3HZ      TRP  38  -6.077  -4.474 -10.796
  294    HH2  TRP  38           HH       TRP  38  -5.572  -5.537 -12.977
  295    H    GLY  39           H        GLY  39  -3.801  -9.181  -7.865
  296   1HA   GLY  39          2HA       GLY  39  -2.364 -10.855  -5.847
  297   2HA   GLY  39          1HA       GLY  39  -3.747 -11.412  -6.789
  298    H    TRP  40           H        TRP  40  -0.539  -9.959  -7.467
  299    HA   TRP  40           HA       TRP  40   0.190 -12.262  -9.137
  300   1HB   TRP  40          2HB       TRP  40  -1.157 -11.153 -10.740
  301   2HB   TRP  40          1HB       TRP  40  -0.613  -9.563 -10.220
  302    HD1  TRP  40           HD       TRP  40   0.757  -8.569 -12.098
  303    HE1  TRP  40           1HE      TRP  40   2.636  -9.404 -13.645
  304    HE3  TRP  40           3HE      TRP  40   0.980 -13.466 -10.664
  305    HZ2  TRP  40           2HZ      TRP  40   4.060 -11.825 -14.202
  306    HZ3  TRP  40           3HZ      TRP  40   2.606 -15.012 -11.716
  307    HH2  TRP  40           HH       TRP  40   4.145 -14.199 -13.481
  308    H    THR  41           H        THR  41   1.099  -8.818  -9.192
  309    HA   THR  41           HA       THR  41   3.525  -9.189  -7.638
  310    HB   THR  41           HB       THR  41   3.889 -10.428  -9.853
  311    HG1  THR  41           1HG      THR  41   5.980  -9.588 -10.024
  312   1HG2  THR  41          1HG2      THR  41   4.436  -7.784 -11.106
  313   2HG2  THR  41          2HG2      THR  41   2.748  -8.288 -11.003
  314   3HG2  THR  41          3HG2      THR  41   3.920  -9.297 -11.851
  315    H    LEU  42           H        LEU  42   1.285  -7.272  -7.873
  316    HA   LEU  42           HA       LEU  42   2.824  -4.810  -8.644
  317   1HB   LEU  42          2HB       LEU  42   0.000  -5.729  -8.999
  318   2HB   LEU  42          1HB       LEU  42   0.277  -4.002  -8.769
  319    HG   LEU  42           HG       LEU  42   1.800  -5.642 -10.805
  320   1HD1  LEU  42          1HD1      LEU  42  -0.942  -5.032 -10.873
  321   2HD1  LEU  42          2HD1      LEU  42   0.060  -5.538 -12.234
  322   3HD1  LEU  42          3HD1      LEU  42  -0.176  -3.822 -11.902
  323   1HD2  LEU  42          1HD2      LEU  42   2.187  -3.371 -11.779
  324   2HD2  LEU  42          2HD2      LEU  42   2.853  -3.533 -10.154
  325   3HD2  LEU  42          3HD2      LEU  42   1.335  -2.670 -10.403
  326    H    SER  43           H        SER  43   2.093  -6.486  -5.983
  327    HA   SER  43           HA       SER  43   1.769  -5.914  -3.719
  328   1HB   SER  43          2HB       SER  43   2.672  -3.251  -4.851
  329   2HB   SER  43          1HB       SER  43   2.709  -3.700  -3.149
  330    HG   SER  43           HG       SER  43   4.198  -4.736  -5.314
  331    H    CYS  44           H        CYS  44   0.726  -3.771  -2.420
  332    HA   CYS  44           HA       CYS  44  -2.078  -3.780  -3.209
  333   1HB   CYS  44          2HB       CYS  44  -1.216  -3.719  -0.868
  334   2HB   CYS  44          1HB       CYS  44  -0.548  -2.116  -1.176
  335    H    TYR  45           H        TYR  45  -3.288  -1.836  -3.861
  336    HA   TYR  45           HA       TYR  45  -1.576   0.378  -4.931
  337   1HB   TYR  45          2HB       TYR  45  -2.220  -1.465  -6.591
  338   2HB   TYR  45          1HB       TYR  45  -3.880  -0.898  -6.420
  339    HD1  TYR  45           1HD      TYR  45  -2.817  -0.798  -9.071
  340    HD2  TYR  45           2HD      TYR  45  -2.254   2.018  -5.874
  341    HE1  TYR  45           1HE      TYR  45  -2.374   0.996 -10.725
  342    HE2  TYR  45           2HE      TYR  45  -1.814   3.808  -7.529
  343    HH   TYR  45           HH       TYR  45  -1.863   4.358  -9.695
  344    H    CYS  46           H        CYS  46  -2.309   2.159  -3.834
  345    HA   CYS  46           HA       CYS  46  -5.272   2.574  -3.700
  346   1HB   CYS  46          2HB       CYS  46  -3.175   3.291  -1.622
  347   2HB   CYS  46          1HB       CYS  46  -4.903   3.595  -1.485
  348    H    GLN  47           H        GLN  47  -5.946   4.689  -4.180
  349    HA   GLN  47           HA       GLN  47  -3.781   6.636  -4.911
  350   1HB   GLN  47          2HB       GLN  47  -6.401   5.981  -6.299
  351   2HB   GLN  47          1HB       GLN  47  -5.307   7.276  -6.789
  352   1HG   GLN  47          2HG       GLN  47  -4.166   5.778  -8.021
  353   2HG   GLN  47          1HG       GLN  47  -3.705   4.965  -6.525
  354   1HE2  GLN  47          1HE2      GLN  47  -4.454   2.852  -6.293
  355   2HE2  GLN  47          2HE2      GLN  47  -5.729   2.171  -7.182
  356    H    GLY  48           H        GLY  48  -4.213   8.811  -4.370
  357   1HA   GLY  48          2HA       GLY  48  -5.621  10.631  -3.638
  358   2HA   GLY  48          1HA       GLY  48  -6.847   9.455  -3.160
  359    H    LEU  49           H        LEU  49  -3.429   9.201  -2.349
  360    HA   LEU  49           HA       LEU  49  -4.202   9.454   0.533
  361   1HB   LEU  49          2HB       LEU  49  -1.801   8.240   0.624
  362   2HB   LEU  49          1HB       LEU  49  -3.289   7.338   0.367
  363    HG   LEU  49           HG       LEU  49  -1.776   8.447  -1.986
  364   1HD1  LEU  49          1HD1      LEU  49  -0.935   6.296  -0.150
  365   2HD1  LEU  49          2HD1      LEU  49   0.011   7.198  -1.335
  366   3HD1  LEU  49          3HD1      LEU  49  -0.974   5.828  -1.850
  367   1HD2  LEU  49          1HD2      LEU  49  -4.166   7.236  -1.850
  368   2HD2  LEU  49          2HD2      LEU  49  -3.150   5.794  -1.891
  369   3HD2  LEU  49          3HD2      LEU  49  -3.069   6.968  -3.205
  370    HA   PRO  50           HA       PRO  50  -1.544  12.908   1.079
  371   1HB   PRO  50          2HB       PRO  50  -0.023  12.288   3.275
  372   2HB   PRO  50          1HB       PRO  50  -1.745  12.708   3.374
  373   1HG   PRO  50          2HG       PRO  50  -0.449  10.024   3.410
  374   2HG   PRO  50          1HG       PRO  50  -1.803  10.635   4.375
  375   1HD   PRO  50          2HD       PRO  50  -2.158   9.025   2.234
  376   2HD   PRO  50          1HD       PRO  50  -3.335  10.266   2.706
  377    H    ASP  51           H        ASP  51   0.684  13.683   0.828
  378    HA   ASP  51           HA       ASP  51   2.290  12.161  -0.978
  379   1HB   ASP  51          2HB       ASP  51   2.483  14.514  -1.017
  380   2HB   ASP  51          1HB       ASP  51   2.638  14.618   0.736
  381    H    ASN  52           H        ASN  52   1.997  12.026   2.443
  382    HA   ASN  52           HA       ASN  52   4.685  10.804   2.804
  383   1HB   ASN  52          2HB       ASN  52   3.667  12.560   4.335
  384   2HB   ASN  52          1HB       ASN  52   2.480  11.346   4.816
  385   1HD2  ASN  52          1HD2      ASN  52   6.072  11.406   4.363
  386   2HD2  ASN  52          2HD2      ASN  52   6.410  10.609   5.823
  387    H    ALA  53           H        ALA  53   2.071   9.630   1.475
  388    HA   ALA  53           HA       ALA  53   1.121   7.463   3.060
  389   1HB   ALA  53          1HB       ALA  53   0.985   8.466   0.358
  390   2HB   ALA  53          2HB       ALA  53  -0.172   7.442   1.209
  391   3HB   ALA  53          3HB       ALA  53   1.169   6.713   0.324
  392    H    ARG  54           H        ARG  54   2.144   5.598   3.694
  393    HA   ARG  54           HA       ARG  54   4.890   5.035   2.955
  394   1HB   ARG  54          2HB       ARG  54   2.947   4.264   4.885
  395   2HB   ARG  54          1HB       ARG  54   3.493   2.785   4.092
  396   1HG   ARG  54          2HG       ARG  54   5.823   4.301   4.489
  397   2HG   ARG  54          1HG       ARG  54   4.906   4.467   5.986
  398   1HD   ARG  54          2HD       ARG  54   5.433   1.792   4.654
  399   2HD   ARG  54          1HD       ARG  54   6.436   2.458   5.959
  400    HE   ARG  54           HE       ARG  54   4.298   2.576   7.322
  401   1HH1  ARG  54          1HH1      ARG  54   2.316   1.899   5.261
  402   2HH1  ARG  54          2HH1      ARG  54   2.085   0.197   5.479
  403   1HH2  ARG  54          1HH2      ARG  54   4.995  -0.225   7.320
  404   2HH2  ARG  54          2HH2      ARG  54   3.605  -1.008   6.647
  405    H    ILE  55           H        ILE  55   5.083   4.590   0.723
  406    HA   ILE  55           HA       ILE  55   3.723   2.092  -0.210
  407    HB   ILE  55           HB       ILE  55   3.482   3.367  -2.427
  408   1HG1  ILE  55          2HG1      ILE  55   3.376   5.869  -2.097
  409   2HG1  ILE  55          1HG1      ILE  55   4.147   5.633  -0.529
  410   1HG2  ILE  55          1HG2      ILE  55   1.947   3.652   0.074
  411   2HG2  ILE  55          2HG2      ILE  55   1.395   3.208  -1.541
  412   3HG2  ILE  55          3HG2      ILE  55   1.624   4.905  -1.124
  413   1HD1  ILE  55          1HD1      ILE  55   5.406   4.400  -2.949
  414   2HD1  ILE  55          2HD1      ILE  55   6.165   4.970  -1.463
  415   3HD1  ILE  55          3HD1      ILE  55   5.613   6.129  -2.673
  416    H    LYS  56           H        LYS  56   4.804   2.133  -2.783
  417    HA   LYS  56           HA       LYS  56   7.090   0.740  -2.851
  418   1HB   LYS  56          2HB       LYS  56   5.958   2.899  -4.530
  419   2HB   LYS  56          1HB       LYS  56   7.644   2.500  -4.858
  420   1HG   LYS  56          2HG       LYS  56   6.659   0.006  -4.685
  421   2HG   LYS  56          1HG       LYS  56   5.199   0.839  -5.222
  422   1HD   LYS  56          2HD       LYS  56   6.189   1.547  -7.229
  423   2HD   LYS  56          1HD       LYS  56   7.825   1.328  -6.610
  424   1HE   LYS  56          2HE       LYS  56   7.172  -1.199  -6.440
  425   2HE   LYS  56          1HE       LYS  56   5.887  -0.763  -7.584
  426   1HZ   LYS  56          1HZ       LYS  56   8.108  -1.399  -8.591
  427   2HZ   LYS  56          2HZ       LYS  56   8.702   0.069  -7.974
  428   3HZ   LYS  56          3HZ       LYS  56   7.440   0.071  -9.112
  429    H    ARG  57           H        ARG  57   8.590   1.098  -1.168
  430    HA   ARG  57           HA       ARG  57  10.039   3.723  -1.189
  431   1HB   ARG  57          2HB       ARG  57   9.262   1.690   0.852
  432   2HB   ARG  57          1HB       ARG  57  10.790   2.537   1.106
  433   1HG   ARG  57          2HG       ARG  57   9.772   4.582   1.383
  434   2HG   ARG  57          1HG       ARG  57   8.415   4.167   0.336
  435   1HD   ARG  57          2HD       ARG  57   7.387   4.103   2.439
  436   2HD   ARG  57          1HD       ARG  57   7.897   2.411   2.272
  437    HE   ARG  57           HE       ARG  57   9.118   4.401   4.051
  438   1HH1  ARG  57          1HH1      ARG  57   8.757   1.154   3.348
  439   2HH1  ARG  57          2HH1      ARG  57  10.336   0.675   3.876
  440   1HH2  ARG  57          1HH2      ARG  57  11.474   3.925   4.292
  441   2HH2  ARG  57          2HH2      ARG  57  11.873   2.243   4.413
  442    H    SER  58           H        SER  58  10.287   0.645  -2.370
  443    HA   SER  58           HA       SER  58  12.111  -0.539  -3.296
  444   1HB   SER  58          2HB       SER  58  12.705   2.082  -3.501
  445   2HB   SER  58          1HB       SER  58  13.994   1.594  -2.405
  446    HG   SER  58           HG       SER  58  14.360  -0.157  -3.975
  447    H    GLY  59           H        GLY  59  14.333  -1.453  -2.551
  448   1HA   GLY  59          2HA       GLY  59  15.775  -2.229  -0.817
  449   2HA   GLY  59          1HA       GLY  59  14.785  -1.364   0.359
  450    H    ARG  60           H        ARG  60  15.477  -4.413  -0.949
  451    HA   ARG  60           HA       ARG  60  13.101  -5.882  -0.850
  452   1HB   ARG  60          2HB       ARG  60  15.889  -6.558   0.149
  453   2HB   ARG  60          1HB       ARG  60  14.629  -7.755  -0.160
  454   1HG   ARG  60          2HG       ARG  60  15.251  -5.808  -2.338
  455   2HG   ARG  60          1HG       ARG  60  16.414  -7.101  -2.036
  456   1HD   ARG  60          2HD       ARG  60  13.512  -7.836  -2.194
  457   2HD   ARG  60          1HD       ARG  60  14.381  -7.499  -3.703
  458    HE   ARG  60           HE       ARG  60  14.740  -9.856  -2.131
  459   1HH1  ARG  60          1HH1      ARG  60  15.741  -9.468  -4.948
  460   2HH1  ARG  60          2HH1      ARG  60  17.457  -9.538  -4.726
  461   1HH2  ARG  60          1HH2      ARG  60  17.301  -9.048  -1.297
  462   2HH2  ARG  60          2HH2      ARG  60  18.339  -9.300  -2.659
  463    H    CYS  61           H        CYS  61  12.748  -7.585   1.081
  464    HA   CYS  61           HA       CYS  61  11.498  -6.398   3.242
  465   1HB   CYS  61          2HB       CYS  61  11.367  -8.765   2.788
  466   2HB   CYS  61          1HB       CYS  61  13.101  -8.966   3.045
  467    H    ARG  62           H        ARG  62  12.635  -4.596   4.136
  468    HA   ARG  62           HA       ARG  62  15.396  -4.884   5.097
  469   1HB   ARG  62          2HB       ARG  62  13.458  -2.828   4.508
  470   2HB   ARG  62          1HB       ARG  62  14.126  -2.562   6.117
  471   1HG   ARG  62          2HG       ARG  62  16.315  -3.296   4.496
  472   2HG   ARG  62          1HG       ARG  62  15.380  -2.138   3.549
  473   1HD   ARG  62          2HD       ARG  62  15.532  -1.259   6.307
  474   2HD   ARG  62          1HD       ARG  62  17.159  -1.529   5.650
  475    HE   ARG  62           HE       ARG  62  16.764   0.198   4.065
  476   1HH1  ARG  62          1HH2      ARG  62  14.664   0.736   6.451
  477   2HH1  ARG  62          2HH2      ARG  62  13.362   1.357   5.492
  478   1HH2  ARG  62          1HH1      ARG  62  14.750   0.351   2.478
  479   2HH2  ARG  62          2HH1      ARG  62  13.411   1.141   3.242
  480    H    ALA  63           H        ALA  63  13.767  -6.826   6.334
  481    HA   ALA  63           HA       ALA  63  14.251  -6.303   9.131
  482   1HB   ALA  63          1HB       ALA  63  12.396  -4.880   9.159
  483   2HB   ALA  63          2HB       ALA  63  11.651  -6.420   9.587
  484   3HB   ALA  63          3HB       ALA  63  11.538  -5.814   7.934
  Start of MODEL   11
    1   1H    LYS   1          1HT       LYS   1  -2.213  14.217  -2.058
    2   2H    LYS   1          2HT       LYS   1  -3.026  13.048  -1.132
    3   3H    LYS   1          3HT       LYS   1  -3.723  14.578  -1.374
    4    HA   LYS   1           HA       LYS   1  -4.612  12.639  -2.776
    5   1HB   LYS   1          2HB       LYS   1  -3.807  15.430  -3.455
    6   2HB   LYS   1          1HB       LYS   1  -4.421  14.434  -4.773
    7   1HG   LYS   1          2HG       LYS   1  -6.228  13.861  -2.807
    8   2HG   LYS   1          1HG       LYS   1  -5.843  15.543  -2.435
    9   1HD   LYS   1          2HD       LYS   1  -7.738  15.362  -4.031
   10   2HD   LYS   1          1HD       LYS   1  -6.356  16.195  -4.742
   11   1HE   LYS   1          2HE       LYS   1  -6.423  14.687  -6.433
   12   2HE   LYS   1          1HE       LYS   1  -5.942  13.442  -5.262
   13   1HZ   LYS   1          1HZ       LYS   1  -8.454  13.647  -4.591
   14   2HZ   LYS   1          2HZ       LYS   1  -7.978  12.642  -5.875
   15   3HZ   LYS   1          3HZ       LYS   1  -8.624  14.182  -6.192
   16    H    ILE   2           H        ILE   2  -2.736  11.024  -2.823
   17    HA   ILE   2           HA       ILE   2  -1.275  11.265  -5.429
   18    HB   ILE   2           HB       ILE   2   0.085  11.759  -3.336
   19   1HG1  ILE   2          2HG1      ILE   2   0.824   9.360  -5.042
   20   2HG1  ILE   2          1HG1      ILE   2   1.188  11.051  -5.394
   21   1HG2  ILE   2          1HG2      ILE   2  -1.116   9.992  -1.972
   22   2HG2  ILE   2          2HG2      ILE   2   0.643   9.937  -1.862
   23   3HG2  ILE   2          3HG2      ILE   2  -0.214   8.780  -2.880
   24   1HD1  ILE   2          1HD1      ILE   2   2.260   9.392  -3.096
   25   2HD1  ILE   2          2HD1      ILE   2   2.487  11.135  -3.232
   26   3HD1  ILE   2          3HD1      ILE   2   3.177  10.059  -4.448
   27    H    ASP   3           H        ASP   3  -0.651   9.126  -6.304
   28    HA   ASP   3           HA       ASP   3  -2.367   6.885  -5.283
   29   1HB   ASP   3          2HB       ASP   3  -1.728   7.413  -8.192
   30   2HB   ASP   3          1HB       ASP   3  -3.033   6.433  -7.522
   31    H    GLY   4           H        GLY   4  -1.176   5.034  -4.910
   32   1HA   GLY   4          2HA       GLY   4   1.050   4.265  -6.602
   33   2HA   GLY   4          1HA       GLY   4   1.616   4.898  -5.057
   34    H    TYR   5           H        TYR   5   2.436   2.550  -5.004
   35    HA   TYR   5           HA       TYR   5   0.300   0.673  -4.084
   36   1HB   TYR   5          2HB       TYR   5   3.177   0.041  -4.770
   37   2HB   TYR   5          1HB       TYR   5   1.801  -1.059  -4.759
   38    HD1  TYR   5           1HD      TYR   5   3.284   1.873  -6.514
   39    HD2  TYR   5           2HD      TYR   5   0.402  -1.310  -6.669
   40    HE1  TYR   5           1HE      TYR   5   2.873   2.360  -8.910
   41    HE2  TYR   5           2HE      TYR   5  -0.010  -0.821  -9.063
   42    HH   TYR   5           HH       TYR   5   0.309   1.469 -10.554
   43    HA   PRO   6           HA       PRO   6   2.230   1.724  -0.128
   44   1HB   PRO   6          2HB       PRO   6   0.086   0.944   1.384
   45   2HB   PRO   6          1HB       PRO   6   0.187   2.530   0.594
   46   1HG   PRO   6          2HG       PRO   6  -1.311   0.099  -0.230
   47   2HG   PRO   6          1HG       PRO   6  -1.763   1.805  -0.364
   48   1HD   PRO   6          2HD       PRO   6  -0.817   0.295  -2.449
   49   2HD   PRO   6          1HD       PRO   6  -0.680   2.064  -2.357
   50    H    VAL   7           H        VAL   7   3.406   0.309   1.159
   51    HA   VAL   7           HA       VAL   7   2.773  -2.613   0.933
   52    HB   VAL   7           HB       VAL   7   5.282  -2.830   1.183
   53   1HG1  VAL   7          1HG1      VAL   7   5.212  -2.930  -1.061
   54   2HG1  VAL   7          2HG1      VAL   7   5.295  -1.173  -1.150
   55   3HG1  VAL   7          3HG1      VAL   7   3.728  -1.980  -1.059
   56   1HG2  VAL   7          1HG2      VAL   7   5.235   0.162   0.692
   57   2HG2  VAL   7          2HG2      VAL   7   6.652  -0.852   0.967
   58   3HG2  VAL   7          3HG2      VAL   7   5.510  -0.556   2.279
   59    H    ASP   8           H        ASP   8   4.412  -3.613   2.855
   60    HA   ASP   8           HA       ASP   8   3.044  -3.036   5.318
   61   1HB   ASP   8          2HB       ASP   8   4.724  -4.611   6.224
   62   2HB   ASP   8          1HB       ASP   8   4.061  -5.201   4.700
   63    H    TYR   9           H        TYR   9   5.420  -3.092   7.060
   64    HA   TYR   9           HA       TYR   9   5.950  -0.191   7.114
   65   1HB   TYR   9          2HB       TYR   9   5.803  -2.412   8.927
   66   2HB   TYR   9          1HB       TYR   9   7.377  -1.643   9.107
   67    HD1  TYR   9           1HD      TYR   9   3.721  -1.113   9.278
   68    HD2  TYR   9           2HD      TYR   9   7.598   0.604   9.958
   69    HE1  TYR   9           1HE      TYR   9   2.677   0.739  10.555
   70    HE2  TYR   9           2HE      TYR   9   6.554   2.457  11.234
   71    HH   TYR   9           HH       TYR   9   4.620   3.443  11.795
   72    H    TRP  10           H        TRP  10   7.733  -3.206   6.502
   73    HA   TRP  10           HA       TRP  10  10.078  -1.531   5.657
   74   1HB   TRP  10          2HB       TRP  10  10.158  -4.263   6.971
   75   2HB   TRP  10          1HB       TRP  10  11.523  -3.194   6.658
   76    HD1  TRP  10           HD       TRP  10  11.740  -0.988   8.156
   77    HE1  TRP  10           1HE      TRP  10  10.811  -0.427  10.495
   78    HE3  TRP  10           3HE      TRP  10   8.191  -4.623   8.580
   79    HZ2  TRP  10           2HZ      TRP  10   8.820  -1.398  12.307
   80    HZ3  TRP  10           3HZ      TRP  10   6.790  -4.787  10.621
   81    HH2  TRP  10           HH       TRP  10   7.100  -3.179  12.483
   82    H    ASN  11           H        ASN  11   7.875  -2.634   4.012
   83    HA   ASN  11           HA       ASN  11   7.629  -3.791   1.965
   84   1HB   ASN  11          2HB       ASN  11  10.656  -3.691   2.179
   85   2HB   ASN  11          1HB       ASN  11   9.748  -3.990   0.698
   86   1HD2  ASN  11          1HD2      ASN  11  11.025  -1.515   2.731
   87   2HD2  ASN  11          2HD2      ASN  11  10.291  -0.194   1.957
   88    H    CYS  12           H        CYS  12   8.303  -5.248   4.689
   89    HA   CYS  12           HA       CYS  12   9.106  -7.875   3.495
   90   1HB   CYS  12          2HB       CYS  12  10.270  -6.560   5.491
   91   2HB   CYS  12          1HB       CYS  12   8.982  -7.311   6.434
   92    H    LYS  13           H        LYS  13   6.806  -6.388   5.772
   93    HA   LYS  13           HA       LYS  13   5.251  -8.783   6.201
   94   1HB   LYS  13          2HB       LYS  13   5.415  -6.103   7.111
   95   2HB   LYS  13          1HB       LYS  13   3.764  -6.334   6.535
   96   1HG   LYS  13          2HG       LYS  13   3.249  -7.665   8.282
   97   2HG   LYS  13          1HG       LYS  13   4.708  -8.633   8.058
   98   1HD   LYS  13          2HD       LYS  13   5.683  -7.615   9.810
   99   2HD   LYS  13          1HD       LYS  13   5.460  -6.043   9.041
  100   1HE   LYS  13          2HE       LYS  13   3.636  -5.543  10.325
  101   2HE   LYS  13          1HE       LYS  13   3.001  -7.198  10.225
  102   1HZ   LYS  13          1HZ       LYS  13   3.831  -6.647  12.464
  103   2HZ   LYS  13          2HZ       LYS  13   5.380  -6.392  11.813
  104   3HZ   LYS  13          3HZ       LYS  13   4.677  -7.937  11.760
  105    H    ARG  14           H        ARG  14   5.450  -8.931   3.545
  106    HA   ARG  14           HA       ARG  14   4.175  -9.103   1.568
  107   1HB   ARG  14          2HB       ARG  14   2.302  -8.924   3.861
  108   2HB   ARG  14          1HB       ARG  14   1.594  -8.632   2.272
  109   1HG   ARG  14          2HG       ARG  14   1.691 -10.822   1.757
  110   2HG   ARG  14          1HG       ARG  14   3.404 -10.890   2.172
  111   1HD   ARG  14          2HD       ARG  14   2.367 -10.775   4.666
  112   2HD   ARG  14          1HD       ARG  14   1.035 -11.597   3.829
  113    HE   ARG  14           HE       ARG  14   2.446 -13.477   3.675
  114   1HH1  ARG  14          1HH2      ARG  14   4.255 -10.665   4.420
  115   2HH1  ARG  14          2HH2      ARG  14   5.794 -11.404   4.127
  116   1HH2  ARG  14          1HH1      ARG  14   4.443 -14.408   3.045
  117   2HH2  ARG  14          2HH1      ARG  14   5.901 -13.523   3.348
  118    H    ILE  15           H        ILE  15   4.241  -7.563   0.012
  119    HA   ILE  15           HA       ILE  15   3.925  -4.710   0.612
  120    HB   ILE  15           HB       ILE  15   4.589  -6.493  -1.718
  121   1HG1  ILE  15          2HG1      ILE  15   6.524  -4.702  -1.690
  122   2HG1  ILE  15          1HG1      ILE  15   5.930  -4.378  -0.060
  123   1HG2  ILE  15          1HG2      ILE  15   4.909  -4.129  -2.897
  124   2HG2  ILE  15          2HG2      ILE  15   3.567  -3.691  -1.840
  125   3HG2  ILE  15          3HG2      ILE  15   3.386  -5.009  -2.995
  126   1HD1  ILE  15          1HD1      ILE  15   6.397  -6.570   0.676
  127   2HD1  ILE  15          2HD1      ILE  15   7.783  -6.174  -0.341
  128   3HD1  ILE  15          3HD1      ILE  15   6.492  -7.197  -0.969
  129    H    CYS  16           H        CYS  16   1.855  -7.285  -0.243
  130    HA   CYS  16           HA       CYS  16  -0.401  -5.402  -0.699
  131   1HB   CYS  16          2HB       CYS  16   0.895  -6.426  -2.820
  132   2HB   CYS  16          1HB       CYS  16  -0.170  -7.791  -2.481
  133    H    TRP  17           H        TRP  17  -2.506  -6.506  -0.299
  134    HA   TRP  17           HA       TRP  17  -2.171  -8.862   1.513
  135   1HB   TRP  17          2HB       TRP  17  -3.571  -6.391   1.609
  136   2HB   TRP  17          1HB       TRP  17  -4.786  -7.669   1.545
  137    HD1  TRP  17           HD       TRP  17  -3.494  -9.931   3.164
  138    HE1  TRP  17           1HE      TRP  17  -3.036  -9.689   5.688
  139    HE3  TRP  17           3HE      TRP  17  -3.440  -4.839   3.569
  140    HZ2  TRP  17           2HZ      TRP  17  -2.691  -7.613   7.624
  141    HZ3  TRP  17           3HZ      TRP  17  -3.045  -3.758   5.763
  142    HH2  TRP  17           HH       TRP  17  -2.670  -5.137   7.790
  143    H    TYR  18           H        TYR  18  -3.999 -10.477   1.450
  144    HA   TYR  18           HA       TYR  18  -4.514 -11.328  -1.306
  145   1HB   TYR  18          2HB       TYR  18  -4.097 -12.543   1.107
  146   2HB   TYR  18          1HB       TYR  18  -5.852 -12.656   0.977
  147    HD1  TYR  18           1HD      TYR  18  -6.193 -12.861  -1.969
  148    HD2  TYR  18           2HD      TYR  18  -3.351 -14.736   0.650
  149    HE1  TYR  18           1HE      TYR  18  -5.953 -14.737  -3.573
  150    HE2  TYR  18           2HE      TYR  18  -3.110 -16.611  -0.954
  151    HH   TYR  18           HH       TYR  18  -4.174 -17.632  -2.760
  152    H    ASN  19           H        ASN  19  -6.347  -9.895   1.348
  153    HA   ASN  19           HA       ASN  19  -8.885 -10.118  -0.181
  154   1HB   ASN  19          2HB       ASN  19  -8.033 -10.029   2.561
  155   2HB   ASN  19          1HB       ASN  19  -9.150  -8.694   2.273
  156   1HD2  ASN  19          1HD2      ASN  19 -10.658 -10.028   3.705
  157   2HD2  ASN  19          2HD2      ASN  19 -11.561 -11.268   2.980
  158    H    ASN  20           H        ASN  20  -9.224  -8.489  -1.640
  159    HA   ASN  20           HA       ASN  20  -7.900  -6.061  -1.932
  160   1HB   ASN  20          2HB       ASN  20 -10.500  -7.248  -2.665
  161   2HB   ASN  20          1HB       ASN  20 -10.478  -5.484  -2.699
  162   1HD2  ASN  20          1HD2      ASN  20 -10.313  -5.105  -4.956
  163   2HD2  ASN  20          2HD2      ASN  20  -9.036  -5.684  -5.914
  164    H    LYS  21           H        LYS  21 -10.419  -6.873   0.390
  165    HA   LYS  21           HA       LYS  21 -11.001  -4.122   1.156
  166   1HB   LYS  21          2HB       LYS  21 -12.665  -5.816   1.473
  167   2HB   LYS  21          1HB       LYS  21 -11.531  -6.862   2.328
  168   1HG   LYS  21          2HG       LYS  21 -11.616  -5.596   4.277
  169   2HG   LYS  21          1HG       LYS  21 -12.083  -4.124   3.421
  170   1HD   LYS  21          2HD       LYS  21 -14.293  -5.254   2.898
  171   2HD   LYS  21          1HD       LYS  21 -13.816  -6.536   4.013
  172   1HE   LYS  21          2HE       LYS  21 -14.184  -3.594   4.682
  173   2HE   LYS  21          1HE       LYS  21 -15.149  -4.959   5.280
  174   1HZ   LYS  21          1HZ       LYS  21 -13.634  -4.837   6.955
  175   2HZ   LYS  21          2HZ       LYS  21 -12.418  -4.171   5.971
  176   3HZ   LYS  21          3HZ       LYS  21 -12.755  -5.835   5.901
  177    H    TYR  22           H        TYR  22  -8.791  -6.651   2.289
  178    HA   TYR  22           HA       TYR  22  -8.029  -5.595   4.795
  179   1HB   TYR  22          2HB       TYR  22  -7.119  -7.501   2.829
  180   2HB   TYR  22          1HB       TYR  22  -5.734  -6.629   3.482
  181    HD1  TYR  22           1HD      TYR  22  -5.243  -6.665   5.902
  182    HD2  TYR  22           2HD      TYR  22  -8.466  -8.957   4.227
  183    HE1  TYR  22           1HE      TYR  22  -5.380  -7.999   7.989
  184    HE2  TYR  22           2HE      TYR  22  -8.603 -10.289   6.313
  185    HH   TYR  22           HH       TYR  22  -6.675 -10.828   8.278
  186    H    CYS  23           H        CYS  23  -6.805  -4.782   1.537
  187    HA   CYS  23           HA       CYS  23  -4.873  -2.836   2.550
  188   1HB   CYS  23          2HB       CYS  23  -5.385  -4.268   0.197
  189   2HB   CYS  23          1HB       CYS  23  -5.684  -2.588  -0.244
  190    H    ASN  24           H        ASN  24  -7.921  -2.552   0.665
  191    HA   ASN  24           HA       ASN  24  -8.181   0.224   0.535
  192   1HB   ASN  24          2HB       ASN  24  -9.666  -1.777  -0.269
  193   2HB   ASN  24          1HB       ASN  24 -10.492  -1.570   1.275
  194   1HD2  ASN  24          1HD2      ASN  24 -12.274  -1.009  -0.519
  195   2HD2  ASN  24          2HD2      ASN  24 -12.406   0.640  -0.902
  196    H    ASP  25           H        ASP  25  -9.036  -1.898   3.279
  197    HA   ASP  25           HA       ASP  25 -10.264   0.016   4.962
  198   1HB   ASP  25          2HB       ASP  25 -10.317  -2.334   5.449
  199   2HB   ASP  25          1HB       ASP  25  -8.556  -2.431   5.473
  200    H    LEU  26           H        LEU  26  -6.816  -0.980   4.925
  201    HA   LEU  26           HA       LEU  26  -5.997   1.045   6.819
  202   1HB   LEU  26          2HB       LEU  26  -4.813  -1.030   5.057
  203   2HB   LEU  26          1HB       LEU  26  -3.735   0.293   5.503
  204    HG   LEU  26           HG       LEU  26  -5.022  -0.305   7.885
  205   1HD1  LEU  26          1HD1      LEU  26  -5.540  -2.501   8.013
  206   2HD1  LEU  26          2HD1      LEU  26  -4.061  -2.978   7.180
  207   3HD1  LEU  26          3HD1      LEU  26  -5.483  -2.503   6.250
  208   1HD2  LEU  26          1HD2      LEU  26  -2.504   0.066   7.126
  209   2HD2  LEU  26          2HD2      LEU  26  -2.461  -1.696   7.179
  210   3HD2  LEU  26          3HD2      LEU  26  -2.872  -0.780   8.629
  211    H    CYS  27           H        CYS  27  -6.122   0.889   3.277
  212    HA   CYS  27           HA       CYS  27  -4.559   3.216   2.717
  213   1HB   CYS  27          2HB       CYS  27  -6.718   1.623   1.361
  214   2HB   CYS  27          1HB       CYS  27  -6.173   3.135   0.629
  215    H    LYS  28           H        LYS  28  -8.075   2.800   3.201
  216    HA   LYS  28           HA       LYS  28  -8.850   5.500   2.780
  217   1HB   LYS  28          2HB       LYS  28 -10.009   3.084   3.487
  218   2HB   LYS  28          1HB       LYS  28 -10.245   4.062   4.934
  219   1HG   LYS  28          2HG       LYS  28 -11.912   5.180   3.924
  220   2HG   LYS  28          1HG       LYS  28 -10.806   5.693   2.648
  221   1HD   LYS  28          2HD       LYS  28 -11.597   4.151   1.188
  222   2HD   LYS  28          1HD       LYS  28 -11.637   2.884   2.414
  223   1HE   LYS  28          2HE       LYS  28 -13.925   3.183   1.971
  224   2HE   LYS  28          1HE       LYS  28 -13.692   4.287   3.341
  225   1HZ   LYS  28          1HZ       LYS  28 -14.643   5.663   1.766
  226   2HZ   LYS  28          2HZ       LYS  28 -13.849   4.912   0.464
  227   3HZ   LYS  28          3HZ       LYS  28 -12.990   5.941   1.508
  228    H    GLY  29           H        GLY  29  -7.294   3.924   5.504
  229   1HA   GLY  29          2HA       GLY  29  -7.817   5.877   7.518
  230   2HA   GLY  29          1HA       GLY  29  -6.405   4.817   7.488
  231    H    LEU  30           H        LEU  30  -5.384   5.671   4.962
  232    HA   LEU  30           HA       LEU  30  -4.157   8.237   5.785
  233   1HB   LEU  30          2HB       LEU  30  -3.657   6.296   3.502
  234   2HB   LEU  30          1HB       LEU  30  -2.634   7.682   3.890
  235    HG   LEU  30           HG       LEU  30  -3.277   5.671   6.025
  236   1HD1  LEU  30          1HD1      LEU  30  -2.085   4.931   3.608
  237   2HD1  LEU  30          2HD1      LEU  30  -1.985   4.048   5.132
  238   3HD1  LEU  30          3HD1      LEU  30  -0.724   5.203   4.697
  239   1HD2  LEU  30          1HD2      LEU  30  -1.106   6.426   6.884
  240   2HD2  LEU  30          2HD2      LEU  30  -2.140   7.818   6.561
  241   3HD2  LEU  30          3HD2      LEU  30  -0.851   7.397   5.434
  242    H    LYS  31           H        LYS  31  -6.998   7.822   4.651
  243    HA   LYS  31           HA       LYS  31  -8.434   9.227   3.400
  244   1HB   LYS  31          2HB       LYS  31  -6.394  10.815   4.002
  245   2HB   LYS  31          1HB       LYS  31  -6.049  10.657   2.279
  246   1HG   LYS  31          2HG       LYS  31  -7.663  12.147   1.811
  247   2HG   LYS  31          1HG       LYS  31  -8.856  11.101   2.583
  248   1HD   LYS  31          2HD       LYS  31  -8.817  13.326   3.651
  249   2HD   LYS  31          1HD       LYS  31  -8.292  12.076   4.780
  250   1HE   LYS  31          2HE       LYS  31  -6.252  13.042   5.003
  251   2HE   LYS  31          1HE       LYS  31  -6.046  13.138   3.242
  252   1HZ   LYS  31          1HZ       LYS  31  -7.822  14.969   3.406
  253   2HZ   LYS  31          2HZ       LYS  31  -6.229  15.353   3.857
  254   3HZ   LYS  31          3HZ       LYS  31  -7.401  15.041   5.047
  255    H    ALA  32           H        ALA  32  -6.533   6.887   2.282
  256    HA   ALA  32           HA       ALA  32  -6.632   7.503  -0.600
  257   1HB   ALA  32          1HB       ALA  32  -5.425   5.410  -0.773
  258   2HB   ALA  32          2HB       ALA  32  -5.893   4.952   0.865
  259   3HB   ALA  32          3HB       ALA  32  -4.773   6.289   0.609
  260    H    ASP  33           H        ASP  33  -8.991   7.672  -0.798
  261    HA   ASP  33           HA       ASP  33 -10.957   5.869   0.007
  262   1HB   ASP  33          2HB       ASP  33 -10.527   7.622  -2.394
  263   2HB   ASP  33          1HB       ASP  33 -11.975   6.621  -2.300
  264    H    SER  34           H        SER  34 -10.302   5.770  -3.444
  265    HA   SER  34           HA       SER  34 -10.900   3.003  -3.726
  266   1HB   SER  34          2HB       SER  34 -10.114   3.359  -5.995
  267   2HB   SER  34          1HB       SER  34 -10.920   4.831  -5.461
  268    HG   SER  34           HG       SER  34  -8.306   4.389  -6.124
  269    H    GLY  35           H        GLY  35  -9.639   1.699  -2.307
  270   1HA   GLY  35          2HA       GLY  35  -6.756   1.511  -3.064
  271   2HA   GLY  35          1HA       GLY  35  -7.241   1.476  -1.369
  272    H    TYR  36           H        TYR  36  -6.308  -0.508  -3.784
  273    HA   TYR  36           HA       TYR  36  -7.680  -2.835  -2.531
  274   1HB   TYR  36          2HB       TYR  36  -8.217  -3.692  -4.809
  275   2HB   TYR  36          1HB       TYR  36  -9.023  -2.160  -4.476
  276    HD1  TYR  36           1HD      TYR  36  -7.086  -3.920  -6.823
  277    HD2  TYR  36           2HD      TYR  36  -7.590   0.001  -5.140
  278    HE1  TYR  36           1HE      TYR  36  -6.013  -2.922  -8.822
  279    HE2  TYR  36           2HE      TYR  36  -6.510   0.995  -7.138
  280    HH   TYR  36           HH       TYR  36  -6.123  -0.578  -9.990
  281    H    CYS  37           H        CYS  37  -6.625  -4.901  -3.871
  282    HA   CYS  37           HA       CYS  37  -3.670  -4.375  -3.916
  283   1HB   CYS  37          2HB       CYS  37  -4.316  -5.529  -1.892
  284   2HB   CYS  37          1HB       CYS  37  -5.299  -6.675  -2.804
  285    H    TRP  38           H        TRP  38  -2.546  -5.242  -5.668
  286    HA   TRP  38           HA       TRP  38  -4.152  -6.498  -7.816
  287   1HB   TRP  38          2HB       TRP  38  -2.277  -4.643  -7.907
  288   2HB   TRP  38          1HB       TRP  38  -1.180  -6.025  -7.874
  289    HD1  TRP  38           HD       TRP  38  -0.705  -7.138 -10.116
  290    HE1  TRP  38           1HE      TRP  38  -1.764  -7.070 -12.465
  291    HE3  TRP  38           3HE      TRP  38  -4.830  -4.300  -9.140
  292    HZ2  TRP  38           2HZ      TRP  38  -4.060  -5.956 -13.760
  293    HZ3  TRP  38           3HZ      TRP  38  -6.437  -3.749 -10.944
  294    HH2  TRP  38           HH       TRP  38  -6.058  -4.573 -13.252
  295    H    GLY  39           H        GLY  39  -4.538  -8.661  -7.182
  296   1HA   GLY  39          2HA       GLY  39  -2.551 -10.315  -5.902
  297   2HA   GLY  39          1HA       GLY  39  -4.041 -10.895  -6.645
  298    H    TRP  40           H        TRP  40  -0.831  -9.631  -7.564
  299    HA   TRP  40           HA       TRP  40  -0.466 -11.845  -9.455
  300   1HB   TRP  40          2HB       TRP  40  -1.889 -10.341 -10.736
  301   2HB   TRP  40          1HB       TRP  40  -0.865  -8.969 -10.330
  302    HD1  TRP  40           HD       TRP  40   0.134  -8.338 -12.594
  303    HE1  TRP  40           1HE      TRP  40   1.545  -9.566 -14.363
  304    HE3  TRP  40           3HE      TRP  40  -0.089 -13.097 -10.757
  305    HZ2  TRP  40           2HZ      TRP  40   2.464 -12.216 -14.927
  306    HZ3  TRP  40           3HZ      TRP  40   1.061 -14.952 -11.927
  307    HH2  TRP  40           HH       TRP  40   2.337 -14.518 -14.009
  308    H    THR  41           H        THR  41   0.744  -8.506  -9.143
  309    HA   THR  41           HA       THR  41   3.157  -9.088  -7.764
  310    HB   THR  41           HB       THR  41   3.740 -10.508  -9.615
  311    HG1  THR  41           1HG      THR  41   4.949  -7.992 -10.100
  312   1HG2  THR  41          1HG2      THR  41   3.803  -9.380 -11.959
  313   2HG2  THR  41          2HG2      THR  41   2.675  -8.221 -11.254
  314   3HG2  THR  41          3HG2      THR  41   2.250  -9.931 -11.333
  315    H    LEU  42           H        LEU  42   1.161  -6.962  -8.071
  316    HA   LEU  42           HA       LEU  42   2.966  -4.721  -8.930
  317   1HB   LEU  42          2HB       LEU  42   0.328  -5.534  -9.764
  318   2HB   LEU  42          1HB       LEU  42   0.246  -3.929  -9.037
  319    HG   LEU  42           HG       LEU  42   2.315  -4.671 -11.115
  320   1HD1  LEU  42          1HD1      LEU  42  -0.498  -3.626 -11.423
  321   2HD1  LEU  42          2HD1      LEU  42   0.292  -4.932 -12.305
  322   3HD1  LEU  42          3HD1      LEU  42   0.746  -3.257 -12.618
  323   1HD2  LEU  42          1HD2      LEU  42   1.638  -1.944 -11.184
  324   2HD2  LEU  42          2HD2      LEU  42   3.109  -2.646 -10.511
  325   3HD2  LEU  42          3HD2      LEU  42   1.717  -2.352  -9.470
  326    H    SER  43           H        SER  43   2.196  -6.093  -6.203
  327    HA   SER  43           HA       SER  43   1.869  -5.334  -3.993
  328   1HB   SER  43          2HB       SER  43   3.756  -3.932  -4.571
  329   2HB   SER  43          1HB       SER  43   2.724  -2.826  -5.469
  330    HG   SER  43           HG       SER  43   3.320  -2.216  -3.244
  331    H    CYS  44           H        CYS  44   0.678  -3.361  -2.769
  332    HA   CYS  44           HA       CYS  44  -2.103  -3.484  -3.571
  333   1HB   CYS  44          2HB       CYS  44  -1.071  -3.270  -1.241
  334   2HB   CYS  44          1HB       CYS  44  -0.773  -1.575  -1.630
  335    H    TYR  45           H        TYR  45  -3.362  -1.282  -3.770
  336    HA   TYR  45           HA       TYR  45  -1.807   0.860  -5.089
  337   1HB   TYR  45          2HB       TYR  45  -2.402  -1.066  -6.715
  338   2HB   TYR  45          1HB       TYR  45  -4.063  -0.492  -6.573
  339    HD1  TYR  45           1HD      TYR  45  -2.811  -0.453  -9.206
  340    HD2  TYR  45           2HD      TYR  45  -2.595   2.455  -6.048
  341    HE1  TYR  45           1HE      TYR  45  -2.343   1.325 -10.870
  342    HE2  TYR  45           2HE      TYR  45  -2.127   4.229  -7.713
  343    HH   TYR  45           HH       TYR  45  -2.007   3.493 -11.200
  344    H    CYS  46           H        CYS  46  -2.627   2.496  -3.810
  345    HA   CYS  46           HA       CYS  46  -5.610   2.808  -3.750
  346   1HB   CYS  46          2HB       CYS  46  -3.558   3.456  -1.605
  347   2HB   CYS  46          1HB       CYS  46  -5.296   3.712  -1.469
  348    H    GLN  47           H        GLN  47  -6.323   4.860  -4.334
  349    HA   GLN  47           HA       GLN  47  -4.199   6.910  -4.880
  350   1HB   GLN  47          2HB       GLN  47  -6.916   6.795  -6.190
  351   2HB   GLN  47          1HB       GLN  47  -5.424   7.496  -6.812
  352   1HG   GLN  47          2HG       GLN  47  -4.458   5.199  -6.976
  353   2HG   GLN  47          1HG       GLN  47  -6.013   4.541  -6.465
  354   1HE2  GLN  47          1HE2      GLN  47  -7.710   4.442  -8.026
  355   2HE2  GLN  47          2HE2      GLN  47  -7.516   4.932  -9.639
  356    H    GLY  48           H        GLY  48  -4.427   8.831  -3.760
  357   1HA   GLY  48          2HA       GLY  48  -6.026  10.653  -3.088
  358   2HA   GLY  48          1HA       GLY  48  -7.082   9.374  -2.484
  359    H    LEU  49           H        LEU  49  -3.647   9.096  -2.034
  360    HA   LEU  49           HA       LEU  49  -4.078   9.479   0.903
  361   1HB   LEU  49          2HB       LEU  49  -1.611   8.327   0.675
  362   2HB   LEU  49          1HB       LEU  49  -3.104   7.407   0.800
  363    HG   LEU  49           HG       LEU  49  -2.005   8.281  -1.874
  364   1HD1  LEU  49          1HD1      LEU  49  -0.915   6.315  -0.028
  365   2HD1  LEU  49          2HD1      LEU  49  -0.268   6.875  -1.570
  366   3HD1  LEU  49          3HD1      LEU  49  -1.442   5.560  -1.532
  367   1HD2  LEU  49          1HD2      LEU  49  -4.411   7.202  -1.177
  368   2HD2  LEU  49          2HD2      LEU  49  -3.474   5.737  -1.469
  369   3HD2  LEU  49          3HD2      LEU  49  -3.646   6.942  -2.745
  370    HA   PRO  50           HA       PRO  50  -1.419  12.958   1.076
  371   1HB   PRO  50          2HB       PRO  50   0.420  12.384   3.028
  372   2HB   PRO  50          1HB       PRO  50  -1.276  12.774   3.374
  373   1HG   PRO  50          2HG       PRO  50   0.062  10.114   3.240
  374   2HG   PRO  50          1HG       PRO  50  -1.153  10.709   4.383
  375   1HD   PRO  50          2HD       PRO  50  -1.771   9.072   2.321
  376   2HD   PRO  50          1HD       PRO  50  -2.903  10.286   2.952
  377    H    ASP  51           H        ASP  51   0.701  13.783   0.436
  378    HA   ASP  51           HA       ASP  51   2.029  12.305  -1.595
  379   1HB   ASP  51          2HB       ASP  51   2.120  14.707  -1.503
  380   2HB   ASP  51          1HB       ASP  51   2.803  14.679   0.122
  381    H    ASN  52           H        ASN  52   2.431  12.275   1.859
  382    HA   ASN  52           HA       ASN  52   5.106  11.020   1.729
  383   1HB   ASN  52          2HB       ASN  52   3.981  12.726   3.452
  384   2HB   ASN  52          1HB       ASN  52   3.443  11.225   4.208
  385   1HD2  ASN  52          1HD2      ASN  52   5.019   9.930   5.286
  386   2HD2  ASN  52          2HD2      ASN  52   6.646  10.385   5.435
  387    H    ALA  53           H        ALA  53   2.270   9.831   0.892
  388    HA   ALA  53           HA       ALA  53   1.661   7.625   2.567
  389   1HB   ALA  53          1HB       ALA  53   1.043   8.651  -0.049
  390   2HB   ALA  53          2HB       ALA  53   0.084   7.561   0.952
  391   3HB   ALA  53          3HB       ALA  53   1.286   6.908  -0.162
  392    H    ARG  54           H        ARG  54   2.872   5.827   3.048
  393    HA   ARG  54           HA       ARG  54   5.463   5.334   1.917
  394   1HB   ARG  54          2HB       ARG  54   3.810   4.419   4.022
  395   2HB   ARG  54          1HB       ARG  54   4.223   2.990   3.073
  396   1HG   ARG  54          2HG       ARG  54   6.613   4.423   3.213
  397   2HG   ARG  54          1HG       ARG  54   5.916   4.589   4.825
  398   1HD   ARG  54          2HD       ARG  54   6.112   1.913   3.412
  399   2HD   ARG  54          1HD       ARG  54   7.372   2.519   4.505
  400    HE   ARG  54           HE       ARG  54   5.918   2.051   6.301
  401   1HH1  ARG  54          1HH2      ARG  54   4.341   0.523   4.010
  402   2HH1  ARG  54          2HH2      ARG  54   2.731   1.017   4.416
  403   1HH2  ARG  54          1HH1      ARG  54   3.762   3.544   6.553
  404   2HH2  ARG  54          2HH1      ARG  54   2.404   2.728   5.854
  405    H    ILE  55           H        ILE  55   6.090   3.964   0.238
  406    HA   ILE  55           HA       ILE  55   3.981   2.329  -1.120
  407    HB   ILE  55           HB       ILE  55   5.899   4.287  -2.412
  408   1HG1  ILE  55          2HG1      ILE  55   4.012   5.316  -1.082
  409   2HG1  ILE  55          1HG1      ILE  55   3.981   5.704  -2.802
  410   1HG2  ILE  55          1HG2      ILE  55   5.436   2.509  -3.947
  411   2HG2  ILE  55          2HG2      ILE  55   4.400   3.855  -4.416
  412   3HG2  ILE  55          3HG2      ILE  55   3.727   2.501  -3.516
  413   1HD1  ILE  55          1HD1      ILE  55   2.498   3.285  -1.833
  414   2HD1  ILE  55          2HD1      ILE  55   2.163   4.317  -3.224
  415   3HD1  ILE  55          3HD1      ILE  55   1.782   4.879  -1.596
  416    H    LYS  56           H        LYS  56   5.142   0.977  -2.926
  417    HA   LYS  56           HA       LYS  56   7.129  -0.701  -1.767
  418   1HB   LYS  56          2HB       LYS  56   5.516  -0.510  -4.087
  419   2HB   LYS  56          1HB       LYS  56   7.176  -0.680  -4.659
  420   1HG   LYS  56          2HG       LYS  56   6.376  -2.450  -2.415
  421   2HG   LYS  56          1HG       LYS  56   5.642  -2.794  -3.981
  422   1HD   LYS  56          2HD       LYS  56   8.122  -2.503  -4.851
  423   2HD   LYS  56          1HD       LYS  56   8.527  -2.893  -3.179
  424   1HE   LYS  56          2HE       LYS  56   6.621  -4.797  -3.730
  425   2HE   LYS  56          1HE       LYS  56   7.452  -4.645  -5.293
  426   1HZ   LYS  56          1HZ       LYS  56   8.569  -6.201  -3.741
  427   2HZ   LYS  56          2HZ       LYS  56   8.841  -4.902  -2.681
  428   3HZ   LYS  56          3HZ       LYS  56   9.557  -4.909  -4.221
  429    H    ARG  57           H        ARG  57   8.764   0.941  -1.032
  430    HA   ARG  57           HA       ARG  57  10.318   2.249  -3.184
  431   1HB   ARG  57          2HB       ARG  57  11.427   3.336  -1.246
  432   2HB   ARG  57          1HB       ARG  57   9.672   3.535  -1.226
  433   1HG   ARG  57          2HG       ARG  57   9.426   2.260   0.612
  434   2HG   ARG  57          1HG       ARG  57  10.622   1.083   0.065
  435   1HD   ARG  57          2HD       ARG  57  12.253   2.042   1.313
  436   2HD   ARG  57          1HD       ARG  57  11.844   3.659   0.708
  437    HE   ARG  57           HE       ARG  57  10.627   2.350   3.081
  438   1HH1  ARG  57          1HH2      ARG  57   8.442   3.748   1.737
  439   2HH1  ARG  57          2HH2      ARG  57   8.574   5.371   2.327
  440   1HH2  ARG  57          1HH1      ARG  57  11.824   4.975   3.467
  441   2HH2  ARG  57          2HH1      ARG  57  10.488   6.065   3.307
  442    H    SER  58           H        SER  58  10.302  -0.764  -2.457
  443    HA   SER  58           HA       SER  58  11.927  -2.480  -2.497
  444   1HB   SER  58          2HB       SER  58  12.783  -0.722  -4.208
  445   2HB   SER  58          1HB       SER  58  13.934  -0.273  -2.953
  446    HG   SER  58           HG       SER  58  14.427  -2.049  -4.601
  447    H    GLY  59           H        GLY  59  14.457  -2.669  -1.524
  448   1HA   GLY  59          2HA       GLY  59  15.771  -1.814   0.462
  449   2HA   GLY  59          1HA       GLY  59  14.218  -1.678   1.290
  450    H    ARG  60           H        ARG  60  13.808  -4.339  -0.511
  451    HA   ARG  60           HA       ARG  60  13.621  -6.604   0.146
  452   1HB   ARG  60          2HB       ARG  60  16.365  -5.614   0.020
  453   2HB   ARG  60          1HB       ARG  60  16.224  -7.046   1.040
  454   1HG   ARG  60          2HG       ARG  60  15.338  -6.762  -1.844
  455   2HG   ARG  60          1HG       ARG  60  16.623  -7.798  -1.222
  456   1HD   ARG  60          2HD       ARG  60  14.501  -8.633   0.302
  457   2HD   ARG  60          1HD       ARG  60  13.704  -8.247  -1.236
  458    HE   ARG  60           HE       ARG  60  14.785 -10.138  -2.126
  459   1HH1  ARG  60          1HH1      ARG  60  16.133  -9.432   0.905
  460   2HH1  ARG  60          2HH1      ARG  60  17.605 -10.303   0.632
  461   1HH2  ARG  60          1HH2      ARG  60  16.893 -10.984  -2.693
  462   2HH2  ARG  60          2HH2      ARG  60  18.034 -11.181  -1.407
  463    H    CYS  61           H        CYS  61  12.218  -6.058   2.040
  464    HA   CYS  61           HA       CYS  61  11.690  -6.138   4.346
  465   1HB   CYS  61          2HB       CYS  61  13.936  -8.091   3.864
  466   2HB   CYS  61          1HB       CYS  61  13.225  -7.927   5.470
  467    H    ARG  62           H        ARG  62  12.187  -4.089   5.188
  468    HA   ARG  62           HA       ARG  62  14.988  -3.388   5.839
  469   1HB   ARG  62          2HB       ARG  62  12.521  -2.069   5.237
  470   2HB   ARG  62          1HB       ARG  62  13.042  -1.537   6.836
  471   1HG   ARG  62          2HG       ARG  62  15.054  -0.654   6.038
  472   2HG   ARG  62          1HG       ARG  62  15.037  -1.662   4.591
  473   1HD   ARG  62          2HD       ARG  62  14.311   0.277   3.589
  474   2HD   ARG  62          1HD       ARG  62  12.736  -0.220   4.239
  475    HE   ARG  62           HE       ARG  62  14.253   2.028   5.175
  476   1HH1  ARG  62          1HH2      ARG  62  11.418   0.472   5.702
  477   2HH1  ARG  62          2HH2      ARG  62  11.363   0.698   7.418
  478   1HH2  ARG  62          1HH1      ARG  62  14.635   1.824   7.641
  479   2HH2  ARG  62          2HH1      ARG  62  13.184   1.463   8.516
  480    H    ALA  63           H        ALA  63  14.063  -5.642   7.301
  481    HA   ALA  63           HA       ALA  63  14.469  -4.708  10.035
  482   1HB   ALA  63          1HB       ALA  63  11.766  -5.439   8.949
  483   2HB   ALA  63          2HB       ALA  63  12.202  -4.145  10.064
  484   3HB   ALA  63          3HB       ALA  63  12.142  -5.813  10.631
  Start of MODEL   12
    1   1H    LYS   1          1HT       LYS   1  -3.551  15.044  -2.363
    2   2H    LYS   1          2HT       LYS   1  -2.685  15.545  -3.736
    3   3H    LYS   1          3HT       LYS   1  -2.003  14.419  -2.660
    4    HA   LYS   1           HA       LYS   1  -4.061  12.980  -3.249
    5   1HB   LYS   1          2HB       LYS   1  -5.189  14.843  -4.373
    6   2HB   LYS   1          1HB       LYS   1  -3.835  15.017  -5.489
    7   1HG   LYS   1          2HG       LYS   1  -4.275  12.546  -6.108
    8   2HG   LYS   1          1HG       LYS   1  -5.833  12.763  -5.308
    9   1HD   LYS   1          2HD       LYS   1  -5.277  14.990  -7.080
   10   2HD   LYS   1          1HD       LYS   1  -5.191  13.461  -7.956
   11   1HE   LYS   1          2HE       LYS   1  -7.424  12.844  -6.903
   12   2HE   LYS   1          1HE       LYS   1  -7.523  14.523  -6.332
   13   1HZ   LYS   1          1HZ       LYS   1  -6.912  13.852  -9.150
   14   2HZ   LYS   1          2HZ       LYS   1  -7.412  15.344  -8.510
   15   3HZ   LYS   1          3HZ       LYS   1  -8.506  14.049  -8.608
   16    H    ILE   2           H        ILE   2  -2.483  11.352  -3.298
   17    HA   ILE   2           HA       ILE   2  -0.681  11.338  -5.698
   18    HB   ILE   2           HB       ILE   2   0.455  11.867  -3.534
   19   1HG1  ILE   2          2HG1      ILE   2   1.217   9.090  -4.452
   20   2HG1  ILE   2          1HG1      ILE   2   1.493  10.510  -5.461
   21   1HG2  ILE   2          1HG2      ILE   2  -1.269  10.238  -2.338
   22   2HG2  ILE   2          2HG2      ILE   2   0.354  10.463  -1.688
   23   3HG2  ILE   2          3HG2      ILE   2  -0.015   9.040  -2.661
   24   1HD1  ILE   2          1HD1      ILE   2   3.163  11.308  -4.116
   25   2HD1  ILE   2          2HD1      ILE   2   3.302   9.611  -3.656
   26   3HD1  ILE   2          3HD1      ILE   2   2.391  10.729  -2.640
   27    H    ASP   3           H        ASP   3  -0.133   9.157  -6.448
   28    HA   ASP   3           HA       ASP   3  -2.016   7.019  -5.513
   29   1HB   ASP   3          2HB       ASP   3  -2.338   6.482  -7.927
   30   2HB   ASP   3          1HB       ASP   3  -2.870   8.119  -7.539
   31    H    GLY   4           H        GLY   4  -1.052   4.984  -5.375
   32   1HA   GLY   4          2HA       GLY   4   1.135   4.044  -6.894
   33   2HA   GLY   4          1HA       GLY   4   1.815   4.794  -5.451
   34    H    TYR   5           H        TYR   5   2.542   2.508  -5.027
   35    HA   TYR   5           HA       TYR   5   0.333   0.835  -3.887
   36   1HB   TYR   5          2HB       TYR   5   3.126  -0.109  -4.513
   37   2HB   TYR   5          1HB       TYR   5   1.635  -1.045  -4.464
   38    HD1  TYR   5           1HD      TYR   5  -0.036   1.045  -6.042
   39    HD2  TYR   5           2HD      TYR   5   3.784  -0.789  -6.740
   40    HE1  TYR   5           1HE      TYR   5  -0.322   1.375  -8.482
   41    HE2  TYR   5           2HE      TYR   5   3.497  -0.462  -9.180
   42    HH   TYR   5           HH       TYR   5   2.101   0.168 -10.798
   43    HA   PRO   6           HA       PRO   6   2.549   2.220  -0.172
   44   1HB   PRO   6          2HB       PRO   6   0.413   1.893   1.508
   45   2HB   PRO   6          1HB       PRO   6   0.653   3.349   0.520
   46   1HG   PRO   6          2HG       PRO   6  -1.145   1.025   0.061
   47   2HG   PRO   6          1HG       PRO   6  -1.416   2.745  -0.260
   48   1HD   PRO   6          2HD       PRO   6  -0.759   0.923  -2.188
   49   2HD   PRO   6          1HD       PRO   6  -0.395   2.656  -2.302
   50    H    VAL   7           H        VAL   7   3.884   0.641   0.596
   51    HA   VAL   7           HA       VAL   7   3.040  -2.155   0.793
   52    HB   VAL   7           HB       VAL   7   5.391  -2.442   1.497
   53   1HG1  VAL   7          1HG1      VAL   7   5.965  -0.435  -0.502
   54   2HG1  VAL   7          2HG1      VAL   7   4.478  -1.286  -0.922
   55   3HG1  VAL   7          3HG1      VAL   7   5.972  -2.191  -0.670
   56   1HG2  VAL   7          1HG2      VAL   7   6.016  -0.722   2.899
   57   2HG2  VAL   7          2HG2      VAL   7   5.089   0.483   2.006
   58   3HG2  VAL   7          3HG2      VAL   7   6.648  -0.064   1.390
   59    H    ASP   8           H        ASP   8   3.917  -3.209   3.045
   60    HA   ASP   8           HA       ASP   8   2.069  -2.434   5.082
   61   1HB   ASP   8          2HB       ASP   8   4.600  -4.097   5.019
   62   2HB   ASP   8          1HB       ASP   8   3.586  -3.977   6.458
   63    H    TYR   9           H        TYR   9   5.340  -2.674   6.236
   64    HA   TYR   9           HA       TYR   9   5.365   0.252   6.882
   65   1HB   TYR   9          2HB       TYR   9   4.989  -2.000   8.600
   66   2HB   TYR   9          1HB       TYR   9   6.580  -1.324   8.954
   67    HD1  TYR   9           1HD      TYR   9   2.996  -0.861   9.231
   68    HD2  TYR   9           2HD      TYR   9   6.788   1.139   9.477
   69    HE1  TYR   9           1HE      TYR   9   1.927   1.012  10.457
   70    HE2  TYR   9           2HE      TYR   9   5.720   3.013  10.702
   71    HH   TYR   9           HH       TYR   9   3.048   3.906  10.725
   72    H    TRP  10           H        TRP  10   7.395  -2.683   7.205
   73    HA   TRP  10           HA       TRP  10   9.743  -1.082   6.264
   74   1HB   TRP  10          2HB       TRP  10   9.576  -3.754   7.700
   75   2HB   TRP  10          1HB       TRP  10  11.041  -2.814   7.419
   76    HD1  TRP  10           HD       TRP  10  11.260  -0.465   8.745
   77    HE1  TRP  10           1HE      TRP  10  10.255   0.282  11.000
   78    HE3  TRP  10           3HE      TRP  10   7.574  -3.955   9.266
   79    HZ2  TRP  10           2HZ      TRP  10   8.163  -0.500  12.790
   80    HZ3  TRP  10           3HZ      TRP  10   6.090  -3.935  11.252
   81    HH2  TRP  10           HH       TRP  10   6.380  -2.213  13.014
   82    H    ASN  11           H        ASN  11   7.477  -2.666   4.755
   83    HA   ASN  11           HA       ASN  11   7.361  -3.894   2.742
   84   1HB   ASN  11          2HB       ASN  11  10.349  -3.363   2.766
   85   2HB   ASN  11          1HB       ASN  11   9.364  -3.736   1.352
   86   1HD2  ASN  11          1HD2      ASN  11   9.610  -1.723   0.241
   87   2HD2  ASN  11          2HD2      ASN  11   9.051  -0.248   0.868
   88    H    CYS  12           H        CYS  12   8.554  -5.045   5.506
   89    HA   CYS  12           HA       CYS  12  10.202  -7.276   4.873
   90   1HB   CYS  12          2HB       CYS  12   8.178  -6.678   7.038
   91   2HB   CYS  12          1HB       CYS  12   9.161  -8.141   7.056
   92    H    LYS  13           H        LYS  13   6.692  -7.330   5.539
   93    HA   LYS  13           HA       LYS  13   6.279 -10.005   4.615
   94   1HB   LYS  13          2HB       LYS  13   4.844  -7.922   5.819
   95   2HB   LYS  13          1HB       LYS  13   3.998  -8.218   4.299
   96   1HG   LYS  13          2HG       LYS  13   3.069  -9.670   6.026
   97   2HG   LYS  13          1HG       LYS  13   3.943 -10.652   4.850
   98   1HD   LYS  13          2HD       LYS  13   5.975 -10.374   6.432
   99   2HD   LYS  13          1HD       LYS  13   4.789  -9.867   7.636
  100   1HE   LYS  13          2HE       LYS  13   4.740 -12.143   8.056
  101   2HE   LYS  13          1HE       LYS  13   3.570 -12.113   6.721
  102   1HZ   LYS  13          1HZ       LYS  13   5.796 -12.131   5.328
  103   2HZ   LYS  13          2HZ       LYS  13   5.063 -13.572   5.850
  104   3HZ   LYS  13          3HZ       LYS  13   6.380 -12.926   6.707
  105    H    ARG  14           H        ARG  14   5.193  -6.985   2.999
  106    HA   ARG  14           HA       ARG  14   6.298  -7.523   0.442
  107   1HB   ARG  14          2HB       ARG  14   4.066  -9.193   1.262
  108   2HB   ARG  14          1HB       ARG  14   3.668  -8.287  -0.198
  109   1HG   ARG  14          2HG       ARG  14   5.107  -9.491  -1.462
  110   2HG   ARG  14          1HG       ARG  14   6.383  -9.387  -0.248
  111   1HD   ARG  14          2HD       ARG  14   4.685 -11.082   1.024
  112   2HD   ARG  14          1HD       ARG  14   4.352 -11.515  -0.665
  113    HE   ARG  14           HE       ARG  14   6.715 -12.254   0.686
  114   1HH1  ARG  14          1HH2      ARG  14   5.464 -11.611  -2.372
  115   2HH1  ARG  14          2HH2      ARG  14   6.996 -11.564  -3.178
  116   1HH2  ARG  14          1HH1      ARG  14   8.842 -11.738  -0.246
  117   2HH2  ARG  14          2HH1      ARG  14   8.910 -11.636  -1.974
  118    H    ILE  15           H        ILE  15   4.857  -6.393  -1.348
  119    HA   ILE  15           HA       ILE  15   4.169  -3.738  -0.341
  120    HB   ILE  15           HB       ILE  15   3.623  -4.791  -3.115
  121   1HG1  ILE  15          2HG1      ILE  15   6.249  -3.800  -3.103
  122   2HG1  ILE  15          1HG1      ILE  15   6.169  -4.875  -1.709
  123   1HG2  ILE  15          1HG2      ILE  15   3.874  -2.586  -3.764
  124   2HG2  ILE  15          2HG2      ILE  15   5.018  -2.229  -2.471
  125   3HG2  ILE  15          3HG2      ILE  15   3.295  -2.337  -2.117
  126   1HD1  ILE  15          1HD1      ILE  15   5.164  -6.631  -3.194
  127   2HD1  ILE  15          2HD1      ILE  15   6.807  -6.186  -3.653
  128   3HD1  ILE  15          3HD1      ILE  15   5.436  -5.561  -4.569
  129    H    CYS  16           H        CYS  16   2.486  -6.677  -0.858
  130    HA   CYS  16           HA       CYS  16  -0.117  -5.311  -0.333
  131   1HB   CYS  16          2HB       CYS  16  -0.085  -5.641  -2.706
  132   2HB   CYS  16          1HB       CYS  16   0.576  -7.264  -2.542
  133    H    TRP  17           H        TRP  17  -1.704  -6.803   0.635
  134    HA   TRP  17           HA       TRP  17  -0.380  -8.973   2.176
  135   1HB   TRP  17          2HB       TRP  17  -1.727  -7.151   3.250
  136   2HB   TRP  17          1HB       TRP  17  -3.147  -7.744   2.389
  137    HD1  TRP  17           HD       TRP  17  -0.393  -9.388   4.571
  138    HE1  TRP  17           1HE      TRP  17  -1.538 -11.041   6.184
  139    HE3  TRP  17           3HE      TRP  17  -5.263  -8.765   3.164
  140    HZ2  TRP  17           2HZ      TRP  17  -4.169 -11.977   6.796
  141    HZ3  TRP  17           3HZ      TRP  17  -7.066 -10.049   4.277
  142    HH2  TRP  17           HH       TRP  17  -6.526 -11.651   6.090
  143    H    TYR  18           H        TYR  18  -3.709  -9.501   1.973
  144    HA   TYR  18           HA       TYR  18  -3.658 -11.138  -0.475
  145   1HB   TYR  18          2HB       TYR  18  -2.719 -12.189   1.923
  146   2HB   TYR  18          1HB       TYR  18  -4.389 -12.756   1.855
  147    HD1  TYR  18           1HD      TYR  18  -1.521 -14.192   1.415
  148    HD2  TYR  18           2HD      TYR  18  -4.723 -12.884  -1.135
  149    HE1  TYR  18           1HE      TYR  18  -0.880 -15.897  -0.268
  150    HE2  TYR  18           2HE      TYR  18  -4.079 -14.589  -2.817
  151    HH   TYR  18           HH       TYR  18  -1.714 -17.056  -2.120
  152    H    ASN  19           H        ASN  19  -5.357  -9.107  -0.209
  153    HA   ASN  19           HA       ASN  19  -7.979 -10.350  -0.122
  154   1HB   ASN  19          2HB       ASN  19  -6.868  -9.590   2.319
  155   2HB   ASN  19          1HB       ASN  19  -7.934  -8.246   1.911
  156   1HD2  ASN  19          1HD2      ASN  19 -10.235  -8.963   1.177
  157   2HD2  ASN  19          2HD2      ASN  19 -10.911 -10.297   1.980
  158    H    ASN  20           H        ASN  20  -9.618  -8.870  -0.896
  159    HA   ASN  20           HA       ASN  20  -8.538  -6.632  -2.472
  160   1HB   ASN  20          2HB       ASN  20 -11.292  -7.849  -2.098
  161   2HB   ASN  20          1HB       ASN  20 -10.923  -6.586  -3.271
  162   1HD2  ASN  20          1HD2      ASN  20 -11.831  -9.245  -4.019
  163   2HD2  ASN  20          2HD2      ASN  20 -10.572  -9.990  -4.881
  164    H    LYS  21           H        LYS  21  -9.674  -6.957   0.692
  165    HA   LYS  21           HA       LYS  21 -10.601  -4.103   0.734
  166   1HB   LYS  21          2HB       LYS  21 -11.833  -6.512   1.531
  167   2HB   LYS  21          1HB       LYS  21 -11.379  -5.691   3.025
  168   1HG   LYS  21          2HG       LYS  21 -13.518  -4.816   2.518
  169   2HG   LYS  21          1HG       LYS  21 -12.400  -3.576   1.947
  170   1HD   LYS  21          2HD       LYS  21 -12.673  -4.199  -0.313
  171   2HD   LYS  21          1HD       LYS  21 -13.360  -5.768   0.112
  172   1HE   LYS  21          2HE       LYS  21 -14.862  -3.433   1.153
  173   2HE   LYS  21          1HE       LYS  21 -14.885  -3.627  -0.611
  174   1HZ   LYS  21          1HZ       LYS  21 -15.789  -5.499   1.471
  175   2HZ   LYS  21          2HZ       LYS  21 -15.219  -6.116  -0.006
  176   3HZ   LYS  21          3HZ       LYS  21 -16.552  -5.062   0.021
  177    H    TYR  22           H        TYR  22  -8.567  -6.546   2.280
  178    HA   TYR  22           HA       TYR  22  -7.800  -5.204   4.635
  179   1HB   TYR  22          2HB       TYR  22  -7.227  -7.536   3.842
  180   2HB   TYR  22          1HB       TYR  22  -6.018  -6.812   2.779
  181    HD1  TYR  22           1HD      TYR  22  -6.764  -7.903   6.136
  182    HD2  TYR  22           2HD      TYR  22  -4.198  -5.356   3.818
  183    HE1  TYR  22           1HE      TYR  22  -5.161  -7.800   8.025
  184    HE2  TYR  22           2HE      TYR  22  -2.593  -5.255   5.706
  185    HH   TYR  22           HH       TYR  22  -3.144  -5.740   8.612
  186    H    CYS  23           H        CYS  23  -6.148  -5.067   1.451
  187    HA   CYS  23           HA       CYS  23  -4.267  -3.037   2.165
  188   1HB   CYS  23          2HB       CYS  23  -3.677  -4.102   0.216
  189   2HB   CYS  23          1HB       CYS  23  -5.349  -4.394  -0.242
  190    H    ASN  24           H        ASN  24  -7.658  -2.877   1.437
  191    HA   ASN  24           HA       ASN  24  -7.635  -0.023   0.705
  192   1HB   ASN  24          2HB       ASN  24  -9.218  -2.059   0.046
  193   2HB   ASN  24          1HB       ASN  24 -10.075  -1.576   1.508
  194   1HD2  ASN  24          1HD2      ASN  24  -9.299   1.311   1.148
  195   2HD2  ASN  24          2HD2      ASN  24 -10.278   1.886  -0.113
  196    H    ASP  25           H        ASP  25  -8.645  -1.997   3.521
  197    HA   ASP  25           HA       ASP  25  -9.713   0.109   5.106
  198   1HB   ASP  25          2HB       ASP  25  -9.763  -2.430   5.434
  199   2HB   ASP  25          1HB       ASP  25  -8.135  -2.281   6.096
  200    H    LEU  26           H        LEU  26  -6.375  -1.140   4.858
  201    HA   LEU  26           HA       LEU  26  -5.279   0.686   6.823
  202   1HB   LEU  26          2HB       LEU  26  -4.393  -1.355   4.875
  203   2HB   LEU  26          1HB       LEU  26  -3.198  -0.102   5.212
  204    HG   LEU  26           HG       LEU  26  -4.658  -1.685   7.348
  205   1HD1  LEU  26          1HD1      LEU  26  -2.706  -3.023   7.582
  206   2HD1  LEU  26          2HD1      LEU  26  -1.755  -1.957   6.548
  207   3HD1  LEU  26          3HD1      LEU  26  -3.016  -2.972   5.847
  208   1HD2  LEU  26          1HD2      LEU  26  -3.560  -0.397   8.878
  209   2HD2  LEU  26          2HD2      LEU  26  -3.448   0.762   7.552
  210   3HD2  LEU  26          3HD2      LEU  26  -2.095  -0.315   7.898
  211    H    CYS  27           H        CYS  27  -5.313   0.652   3.240
  212    HA   CYS  27           HA       CYS  27  -3.863   3.060   2.814
  213   1HB   CYS  27          2HB       CYS  27  -5.762   1.287   1.381
  214   2HB   CYS  27          1HB       CYS  27  -5.607   2.915   0.728
  215    H    LYS  28           H        LYS  28  -7.336   2.497   3.351
  216    HA   LYS  28           HA       LYS  28  -8.177   5.211   2.929
  217   1HB   LYS  28          2HB       LYS  28  -9.204   2.690   4.122
  218   2HB   LYS  28          1HB       LYS  28  -9.977   4.167   4.696
  219   1HG   LYS  28          2HG       LYS  28 -10.699   4.773   2.529
  220   2HG   LYS  28          1HG       LYS  28  -9.571   3.662   1.751
  221   1HD   LYS  28          2HD       LYS  28 -11.347   2.258   1.619
  222   2HD   LYS  28          1HD       LYS  28 -11.037   1.957   3.330
  223   1HE   LYS  28          2HE       LYS  28 -13.105   2.773   3.773
  224   2HE   LYS  28          1HE       LYS  28 -12.547   4.360   3.209
  225   1HZ   LYS  28          1HZ       LYS  28 -13.671   2.170   1.548
  226   2HZ   LYS  28          2HZ       LYS  28 -12.951   3.570   0.910
  227   3HZ   LYS  28          3HZ       LYS  28 -14.371   3.687   1.837
  228    H    GLY  29           H        GLY  29  -6.880   3.469   5.713
  229   1HA   GLY  29          2HA       GLY  29  -7.478   5.293   7.780
  230   2HA   GLY  29          1HA       GLY  29  -6.020   4.296   7.741
  231    H    LEU  30           H        LEU  30  -5.029   5.394   5.245
  232    HA   LEU  30           HA       LEU  30  -3.746   7.809   6.314
  233   1HB   LEU  30          2HB       LEU  30  -3.583   6.436   3.607
  234   2HB   LEU  30          1HB       LEU  30  -2.425   7.599   4.252
  235    HG   LEU  30           HG       LEU  30  -2.649   5.660   6.256
  236   1HD1  LEU  30          1HD1      LEU  30  -2.111   4.191   3.689
  237   2HD1  LEU  30          2HD1      LEU  30  -3.769   4.356   4.267
  238   3HD1  LEU  30          3HD1      LEU  30  -2.563   3.544   5.266
  239   1HD2  LEU  30          1HD2      LEU  30  -0.569   5.844   4.054
  240   2HD2  LEU  30          2HD2      LEU  30  -0.334   5.172   5.668
  241   3HD2  LEU  30          3HD2      LEU  30  -0.620   6.901   5.466
  242    H    LYS  31           H        LYS  31  -6.114   6.949   3.860
  243    HA   LYS  31           HA       LYS  31  -7.893   8.908   3.700
  244   1HB   LYS  31          2HB       LYS  31  -6.334  10.704   3.926
  245   2HB   LYS  31          1HB       LYS  31  -5.279  10.038   2.680
  246   1HG   LYS  31          2HG       LYS  31  -6.807  10.596   0.943
  247   2HG   LYS  31          1HG       LYS  31  -8.112  10.902   2.091
  248   1HD   LYS  31          2HD       LYS  31  -5.794  12.534   2.704
  249   2HD   LYS  31          1HD       LYS  31  -6.331  12.797   1.044
  250   1HE   LYS  31          2HE       LYS  31  -8.647  12.647   2.753
  251   2HE   LYS  31          1HE       LYS  31  -7.512  13.846   3.404
  252   1HZ   LYS  31          1HZ       LYS  31  -8.776  14.951   1.753
  253   2HZ   LYS  31          2HZ       LYS  31  -8.582  13.680   0.642
  254   3HZ   LYS  31          3HZ       LYS  31  -7.255  14.654   1.062
  255    H    ALA  32           H        ALA  32  -5.983   6.679   2.078
  256    HA   ALA  32           HA       ALA  32  -6.866   7.233  -0.656
  257   1HB   ALA  32          1HB       ALA  32  -5.942   4.538  -0.147
  258   2HB   ALA  32          2HB       ALA  32  -4.917   5.698   0.699
  259   3HB   ALA  32          3HB       ALA  32  -5.142   5.826  -1.046
  260    H    ASP  33           H        ASP  33  -9.174   7.166  -0.619
  261    HA   ASP  33           HA       ASP  33 -10.731   5.121   0.649
  262   1HB   ASP  33          2HB       ASP  33 -11.172   7.040  -1.647
  263   2HB   ASP  33          1HB       ASP  33 -12.455   5.998  -1.032
  264    H    SER  34           H        SER  34  -9.601   5.485  -2.712
  265    HA   SER  34           HA       SER  34 -10.666   2.847  -3.465
  266   1HB   SER  34          2HB       SER  34  -9.144   3.693  -5.552
  267   2HB   SER  34          1HB       SER  34 -10.792   4.250  -5.273
  268    HG   SER  34           HG       SER  34  -8.353   5.534  -4.860
  269    H    GLY  35           H        GLY  35  -9.323   1.635  -1.848
  270   1HA   GLY  35          2HA       GLY  35  -6.509   1.288  -2.815
  271   2HA   GLY  35          1HA       GLY  35  -6.969   1.106  -1.121
  272    H    TYR  36           H        TYR  36  -6.690  -0.496  -4.142
  273    HA   TYR  36           HA       TYR  36  -7.959  -2.940  -2.945
  274   1HB   TYR  36          2HB       TYR  36  -8.725  -3.474  -5.209
  275   2HB   TYR  36          1HB       TYR  36  -9.260  -1.849  -4.783
  276    HD1  TYR  36           1HD      TYR  36  -7.912   0.144  -5.594
  277    HD2  TYR  36           2HD      TYR  36  -7.269  -3.845  -7.051
  278    HE1  TYR  36           1HE      TYR  36  -6.713   1.056  -7.565
  279    HE2  TYR  36           2HE      TYR  36  -6.069  -2.933  -9.021
  280    HH   TYR  36           HH       TYR  36  -5.250  -1.108  -9.990
  281    H    CYS  37           H        CYS  37  -6.619  -4.723  -2.903
  282    HA   CYS  37           HA       CYS  37  -3.873  -4.462  -3.929
  283   1HB   CYS  37          2HB       CYS  37  -5.319  -5.894  -1.903
  284   2HB   CYS  37          1HB       CYS  37  -4.457  -7.060  -2.906
  285    H    TRP  38           H        TRP  38  -3.236  -5.238  -5.895
  286    HA   TRP  38           HA       TRP  38  -5.129  -6.659  -7.614
  287   1HB   TRP  38          2HB       TRP  38  -3.098  -4.895  -7.975
  288   2HB   TRP  38          1HB       TRP  38  -2.256  -6.405  -8.324
  289    HD1  TRP  38           HD       TRP  38  -2.186  -6.554 -10.873
  290    HE1  TRP  38           1HE      TRP  38  -3.934  -6.413 -12.763
  291    HE3  TRP  38           3HE      TRP  38  -6.299  -5.177  -8.173
  292    HZ2  TRP  38           2HZ      TRP  38  -6.709  -5.801 -13.086
  293    HZ3  TRP  38           3HZ      TRP  38  -8.481  -4.823  -9.297
  294    HH2  TRP  38           HH       TRP  38  -8.689  -5.134 -11.748
  295    H    GLY  39           H        GLY  39  -5.078  -8.850  -8.131
  296   1HA   GLY  39          2HA       GLY  39  -3.343 -10.566  -6.459
  297   2HA   GLY  39          1HA       GLY  39  -4.710 -11.114  -7.433
  298    H    TRP  40           H        TRP  40  -2.695  -8.968  -9.121
  299    HA   TRP  40           HA       TRP  40  -1.536 -11.254 -10.655
  300   1HB   TRP  40          2HB       TRP  40  -2.961  -9.727 -11.901
  301   2HB   TRP  40          1HB       TRP  40  -2.065  -8.338 -11.294
  302    HD1  TRP  40           HD       TRP  40  -0.739  -7.418 -13.252
  303    HE1  TRP  40           1HE      TRP  40   0.809  -8.418 -15.048
  304    HE3  TRP  40           3HE      TRP  40  -1.275 -12.379 -12.211
  305    HZ2  TRP  40           2HZ      TRP  40   1.712 -10.990 -15.932
  306    HZ3  TRP  40           3HZ      TRP  40  -0.063 -14.088 -13.543
  307    HH2  TRP  40           HH       TRP  40   1.429 -13.397 -15.401
  308    H    THR  41           H        THR  41  -0.518  -7.879 -10.136
  309    HA   THR  41           HA       THR  41   1.909  -8.570  -8.708
  310    HB   THR  41           HB       THR  41   2.309  -9.491 -11.010
  311    HG1  THR  41           1HG      THR  41   4.137  -8.931  -9.987
  312   1HG2  THR  41          1HG2      THR  41   2.185  -8.195 -12.907
  313   2HG2  THR  41          2HG2      THR  41   2.608  -6.714 -12.049
  314   3HG2  THR  41          3HG2      THR  41   0.973  -7.362 -11.932
  315    H    LEU  42           H        LEU  42  -0.293  -6.553  -8.690
  316    HA   LEU  42           HA       LEU  42   1.296  -4.048  -9.118
  317   1HB   LEU  42          2HB       LEU  42  -1.504  -4.899  -9.510
  318   2HB   LEU  42          1HB       LEU  42  -1.326  -3.304  -8.778
  319    HG   LEU  42           HG       LEU  42   0.534  -3.738 -10.996
  320   1HD1  LEU  42          1HD1      LEU  42  -2.416  -4.149 -11.375
  321   2HD1  LEU  42          2HD1      LEU  42  -1.067  -4.974 -12.156
  322   3HD1  LEU  42          3HD1      LEU  42  -1.489  -3.329 -12.632
  323   1HD2  LEU  42          1HD2      LEU  42  -1.546  -1.677 -10.227
  324   2HD2  LEU  42          2HD2      LEU  42  -0.573  -1.544 -11.691
  325   3HD2  LEU  42          3HD2      LEU  42   0.209  -1.536 -10.110
  326    H    SER  43           H        SER  43   0.875  -6.083  -6.696
  327    HA   SER  43           HA       SER  43   0.625  -5.903  -4.352
  328   1HB   SER  43          2HB       SER  43   2.730  -4.796  -4.719
  329   2HB   SER  43          1HB       SER  43   1.924  -3.319  -5.241
  330    HG   SER  43           HG       SER  43   1.739  -2.775  -3.227
  331    H    CYS  44           H        CYS  44   0.108  -3.791  -2.680
  332    HA   CYS  44           HA       CYS  44  -2.736  -3.389  -2.959
  333   1HB   CYS  44          2HB       CYS  44  -1.645  -3.522  -0.800
  334   2HB   CYS  44          1HB       CYS  44  -0.567  -2.189  -1.210
  335    H    TYR  45           H        TYR  45  -3.561  -2.017  -4.511
  336    HA   TYR  45           HA       TYR  45  -1.984   0.390  -5.289
  337   1HB   TYR  45          2HB       TYR  45  -2.919  -1.321  -6.927
  338   2HB   TYR  45          1HB       TYR  45  -4.526  -0.742  -6.491
  339    HD1  TYR  45           1HD      TYR  45  -1.990  -0.388  -8.840
  340    HD2  TYR  45           2HD      TYR  45  -4.638   1.995  -6.438
  341    HE1  TYR  45           1HE      TYR  45  -1.734   1.502 -10.427
  342    HE2  TYR  45           2HE      TYR  45  -4.379   3.882  -8.023
  343    HH   TYR  45           HH       TYR  45  -2.021   4.231 -10.099
  344    H    CYS  46           H        CYS  46  -2.548   2.323  -4.385
  345    HA   CYS  46           HA       CYS  46  -5.407   2.746  -3.603
  346   1HB   CYS  46          2HB       CYS  46  -2.931   3.499  -2.014
  347   2HB   CYS  46          1HB       CYS  46  -4.602   3.753  -1.516
  348    H    GLN  47           H        GLN  47  -6.165   4.629  -4.477
  349    HA   GLN  47           HA       GLN  47  -4.160   6.682  -5.353
  350   1HB   GLN  47          2HB       GLN  47  -5.902   5.192  -6.853
  351   2HB   GLN  47          1HB       GLN  47  -6.871   6.633  -6.545
  352   1HG   GLN  47          2HG       GLN  47  -4.737   7.947  -7.232
  353   2HG   GLN  47          1HG       GLN  47  -4.210   6.422  -7.943
  354   1HE2  GLN  47          1HE2      GLN  47  -7.480   7.941  -7.793
  355   2HE2  GLN  47          2HE2      GLN  47  -7.725   7.921  -9.473
  356    H    GLY  48           H        GLY  48  -4.469   8.752  -4.546
  357   1HA   GLY  48          2HA       GLY  48  -5.869  10.586  -3.781
  358   2HA   GLY  48          1HA       GLY  48  -7.093   9.408  -3.308
  359    H    LEU  49           H        LEU  49  -3.605   9.454  -2.584
  360    HA   LEU  49           HA       LEU  49  -4.336   9.454   0.325
  361   1HB   LEU  49          2HB       LEU  49  -1.809   8.408   0.217
  362   2HB   LEU  49          1HB       LEU  49  -3.274   7.433   0.167
  363    HG   LEU  49           HG       LEU  49  -2.023   8.530  -2.355
  364   1HD1  LEU  49          1HD1      LEU  49  -0.224   7.241  -1.710
  365   2HD1  LEU  49          2HD1      LEU  49  -1.230   5.970  -2.403
  366   3HD1  LEU  49          3HD1      LEU  49  -1.201   6.218  -0.658
  367   1HD2  LEU  49          1HD2      LEU  49  -3.421   5.920  -2.240
  368   2HD2  LEU  49          2HD2      LEU  49  -3.554   7.213  -3.432
  369   3HD2  LEU  49          3HD2      LEU  49  -4.432   7.326  -1.907
  370    HA   PRO  50           HA       PRO  50  -1.849  12.994   0.973
  371   1HB   PRO  50          2HB       PRO  50  -0.313  12.369   3.152
  372   2HB   PRO  50          1HB       PRO  50  -2.059  12.677   3.255
  373   1HG   PRO  50          2HG       PRO  50  -0.596  10.084   3.212
  374   2HG   PRO  50          1HG       PRO  50  -2.013  10.565   4.158
  375   1HD   PRO  50          2HD       PRO  50  -2.162   9.023   1.921
  376   2HD   PRO  50          1HD       PRO  50  -3.469  10.097   2.457
  377    H    ASP  51           H        ASP  51   0.334  13.891   0.732
  378    HA   ASP  51           HA       ASP  51   2.018  12.544  -1.122
  379   1HB   ASP  51          2HB       ASP  51   1.891  14.992  -0.714
  380   2HB   ASP  51          1HB       ASP  51   2.651  14.756   0.860
  381    H    ASN  52           H        ASN  52   1.795  12.296   2.334
  382    HA   ASN  52           HA       ASN  52   4.500  11.208   2.705
  383   1HB   ASN  52          2HB       ASN  52   2.644  12.482   4.260
  384   2HB   ASN  52          1HB       ASN  52   2.411  10.807   4.758
  385   1HD2  ASN  52          1HD2      ASN  52   3.495  10.860   6.789
  386   2HD2  ASN  52          2HD2      ASN  52   5.142  11.237   6.956
  387    H    ALA  53           H        ALA  53   1.902   9.971   1.183
  388    HA   ALA  53           HA       ALA  53   1.422   7.425   2.394
  389   1HB   ALA  53          1HB       ALA  53   0.193   8.732   0.532
  390   2HB   ALA  53          2HB       ALA  53   0.295   6.981   0.350
  391   3HB   ALA  53          3HB       ALA  53   1.380   8.029  -0.566
  392    H    ARG  54           H        ARG  54   3.184   6.107   2.863
  393    HA   ARG  54           HA       ARG  54   5.622   5.977   1.376
  394   1HB   ARG  54          2HB       ARG  54   5.819   3.786   2.667
  395   2HB   ARG  54          1HB       ARG  54   5.480   5.209   3.653
  396   1HG   ARG  54          2HG       ARG  54   3.599   4.237   4.407
  397   2HG   ARG  54          1HG       ARG  54   2.984   4.155   2.755
  398   1HD   ARG  54          2HD       ARG  54   3.244   1.909   2.768
  399   2HD   ARG  54          1HD       ARG  54   4.977   2.107   3.097
  400    HE   ARG  54           HE       ARG  54   3.057   1.330   5.055
  401   1HH1  ARG  54          1HH1      ARG  54   5.967   3.041   4.511
  402   2HH1  ARG  54          2HH1      ARG  54   6.248   3.387   6.185
  403   1HH2  ARG  54          1HH2      ARG  54   3.250   2.005   7.247
  404   2HH2  ARG  54          2HH2      ARG  54   4.709   2.800   7.735
  405    H    ILE  55           H        ILE  55   6.347   4.245  -0.063
  406    HA   ILE  55           HA       ILE  55   4.191   2.601  -1.324
  407    HB   ILE  55           HB       ILE  55   6.208   4.225  -2.879
  408   1HG1  ILE  55          2HG1      ILE  55   4.709   5.689  -1.452
  409   2HG1  ILE  55          1HG1      ILE  55   4.553   5.954  -3.187
  410   1HG2  ILE  55          1HG2      ILE  55   4.171   3.963  -4.548
  411   2HG2  ILE  55          2HG2      ILE  55   3.776   2.596  -3.509
  412   3HG2  ILE  55          3HG2      ILE  55   5.330   2.652  -4.339
  413   1HD1  ILE  55          1HD1      ILE  55   2.489   4.852  -3.307
  414   2HD1  ILE  55          2HD1      ILE  55   2.380   5.693  -1.760
  415   3HD1  ILE  55          3HD1      ILE  55   2.762   3.972  -1.803
  416    H    LYS  56           H        LYS  56   5.401   1.187  -3.127
  417    HA   LYS  56           HA       LYS  56   7.253  -0.549  -1.831
  418   1HB   LYS  56          2HB       LYS  56   7.465  -1.493  -4.107
  419   2HB   LYS  56          1HB       LYS  56   5.782  -1.108  -3.746
  420   1HG   LYS  56          2HG       LYS  56   5.710   0.244  -5.540
  421   2HG   LYS  56          1HG       LYS  56   6.986   1.237  -4.834
  422   1HD   LYS  56          2HD       LYS  56   8.479  -0.830  -5.726
  423   2HD   LYS  56          1HD       LYS  56   7.169  -0.887  -6.907
  424   1HE   LYS  56          2HE       LYS  56   7.797   1.850  -6.645
  425   2HE   LYS  56          1HE       LYS  56   9.357   1.008  -6.730
  426   1HZ   LYS  56          1HZ       LYS  56   7.059   0.551  -8.562
  427   2HZ   LYS  56          2HZ       LYS  56   8.569  -0.222  -8.641
  428   3HZ   LYS  56          3HZ       LYS  56   8.449   1.444  -8.948
  429    H    ARG  57           H        ARG  57   8.910   0.983  -1.002
  430    HA   ARG  57           HA       ARG  57  10.712   2.109  -3.107
  431   1HB   ARG  57          2HB       ARG  57  10.155   2.673  -0.194
  432   2HB   ARG  57          1HB       ARG  57  11.604   3.304  -0.980
  433   1HG   ARG  57          2HG       ARG  57  10.429   4.897  -2.057
  434   2HG   ARG  57          1HG       ARG  57   9.236   3.725  -2.617
  435   1HD   ARG  57          2HD       ARG  57   7.898   5.038  -1.227
  436   2HD   ARG  57          1HD       ARG  57   8.468   3.837  -0.050
  437    HE   ARG  57           HE       ARG  57   9.612   5.617   0.986
  438   1HH1  ARG  57          1HH2      ARG  57   8.952   6.343  -2.307
  439   2HH1  ARG  57          2HH2      ARG  57   9.981   7.736  -2.351
  440   1HH2  ARG  57          1HH1      ARG  57  11.117   7.330   0.902
  441   2HH2  ARG  57          2HH1      ARG  57  11.207   8.295  -0.535
  442    H    SER  58           H        SER  58  10.434  -0.472  -0.890
  443    HA   SER  58           HA       SER  58  13.287  -1.193  -1.347
  444   1HB   SER  58          2HB       SER  58  13.844  -1.005   0.858
  445   2HB   SER  58          1HB       SER  58  12.437   0.050   0.952
  446    HG   SER  58           HG       SER  58  12.361  -1.629   2.504
  447    H    GLY  59           H        GLY  59  13.662  -3.528  -0.662
  448   1HA   GLY  59          2HA       GLY  59  11.207  -5.164  -0.452
  449   2HA   GLY  59          1HA       GLY  59  12.214  -5.430  -1.875
  450    H    ARG  60           H        ARG  60  13.433  -4.638   1.356
  451    HA   ARG  60           HA       ARG  60  14.439  -7.439   1.608
  452   1HB   ARG  60          2HB       ARG  60  15.911  -4.877   1.300
  453   2HB   ARG  60          1HB       ARG  60  16.548  -5.987   2.515
  454   1HG   ARG  60          2HG       ARG  60  17.631  -6.908   0.729
  455   2HG   ARG  60          1HG       ARG  60  16.085  -7.717   0.470
  456   1HD   ARG  60          2HD       ARG  60  15.584  -5.374  -0.805
  457   2HD   ARG  60          1HD       ARG  60  17.333  -5.506  -1.075
  458    HE   ARG  60           HE       ARG  60  15.326  -7.234  -2.248
  459   1HH1  ARG  60          1HH2      ARG  60  18.040  -6.694  -3.420
  460   2HH1  ARG  60          2HH2      ARG  60  18.827  -8.224  -3.223
  461   1HH2  ARG  60          1HH1      ARG  60  16.532  -9.406  -0.908
  462   2HH2  ARG  60          2HH1      ARG  60  17.973  -9.759  -1.802
  463    H    CYS  61           H        CYS  61  12.261  -6.291   2.974
  464    HA   CYS  61           HA       CYS  61  11.435  -5.786   5.138
  465   1HB   CYS  61          2HB       CYS  61  12.027  -8.185   5.125
  466   2HB   CYS  61          1HB       CYS  61  13.652  -7.787   5.677
  467    H    ARG  62           H        ARG  62  11.879  -3.731   5.883
  468    HA   ARG  62           HA       ARG  62  14.597  -2.888   6.617
  469   1HB   ARG  62          2HB       ARG  62  12.057  -1.752   5.933
  470   2HB   ARG  62          1HB       ARG  62  12.551  -1.097   7.493
  471   1HG   ARG  62          2HG       ARG  62  14.750  -1.239   5.558
  472   2HG   ARG  62          1HG       ARG  62  13.431  -0.191   5.035
  473   1HD   ARG  62          2HD       ARG  62  14.859  -0.025   7.716
  474   2HD   ARG  62          1HD       ARG  62  15.038   1.116   6.367
  475    HE   ARG  62           HE       ARG  62  12.905   1.203   8.234
  476   1HH1  ARG  62          1HH1      ARG  62  13.723   2.907   5.671
  477   2HH1  ARG  62          2HH1      ARG  62  12.172   2.989   4.905
  478   1HH2  ARG  62          1HH2      ARG  62  10.765   0.520   6.892
  479   2HH2  ARG  62          2HH2      ARG  62  10.497   1.638   5.595
  480    H    ALA  63           H        ALA  63  13.634  -5.131   8.201
  481    HA   ALA  63           HA       ALA  63  14.042  -4.015  10.873
  482   1HB   ALA  63          1HB       ALA  63  11.442  -5.461  10.515
  483   2HB   ALA  63          2HB       ALA  63  11.532  -3.770  10.022
  484   3HB   ALA  63          3HB       ALA  63  11.875  -4.221  11.692
  Start of MODEL   13
    1   1H    LYS   1          1HT       LYS   1  -2.845  15.548  -2.284
    2   2H    LYS   1          2HT       LYS   1  -1.372  14.928  -2.860
    3   3H    LYS   1          3HT       LYS   1  -1.914  14.528  -1.300
    4    HA   LYS   1           HA       LYS   1  -3.277  12.905  -2.033
    5   1HB   LYS   1          2HB       LYS   1  -4.666  13.300  -4.062
    6   2HB   LYS   1          1HB       LYS   1  -4.755  14.654  -2.935
    7   1HG   LYS   1          2HG       LYS   1  -4.131  15.994  -4.635
    8   2HG   LYS   1          1HG       LYS   1  -2.545  15.224  -4.566
    9   1HD   LYS   1          2HD       LYS   1  -3.028  14.673  -6.733
   10   2HD   LYS   1          1HD       LYS   1  -3.913  13.350  -5.969
   11   1HE   LYS   1          2HE       LYS   1  -5.835  15.237  -5.860
   12   2HE   LYS   1          1HE       LYS   1  -4.964  15.803  -7.301
   13   1HZ   LYS   1          1HZ       LYS   1  -6.643  14.099  -7.831
   14   2HZ   LYS   1          2HZ       LYS   1  -5.825  12.996  -6.832
   15   3HZ   LYS   1          3HZ       LYS   1  -5.072  13.600  -8.229
   16    H    ILE   2           H        ILE   2  -2.061  11.149  -2.601
   17    HA   ILE   2           HA       ILE   2  -0.546  11.263  -5.188
   18    HB   ILE   2           HB       ILE   2   0.836  11.416  -3.095
   19   1HG1  ILE   2          2HG1      ILE   2   1.210   8.778  -4.536
   20   2HG1  ILE   2          1HG1      ILE   2   1.636  10.337  -5.243
   21   1HG2  ILE   2          1HG2      ILE   2   0.968   9.523  -1.598
   22   2HG2  ILE   2          2HG2      ILE   2  -0.117   8.579  -2.619
   23   3HG2  ILE   2          3HG2      ILE   2  -0.731   9.976  -1.735
   24   1HD1  ILE   2          1HD1      ILE   2   2.922  10.648  -2.943
   25   2HD1  ILE   2          2HD1      ILE   2   3.663   9.766  -4.278
   26   3HD1  ILE   2          3HD1      ILE   2   2.902   8.884  -2.953
   27    H    ASP   3           H        ASP   3  -0.268   9.119  -6.202
   28    HA   ASP   3           HA       ASP   3  -2.207   7.037  -5.285
   29   1HB   ASP   3          2HB       ASP   3  -2.886   6.880  -7.736
   30   2HB   ASP   3          1HB       ASP   3  -3.387   8.360  -6.917
   31    H    GLY   4           H        GLY   4  -1.228   5.045  -5.329
   32   1HA   GLY   4          2HA       GLY   4   0.475   4.133  -7.441
   33   2HA   GLY   4          1HA       GLY   4   1.479   4.666  -6.091
   34    H    TYR   5           H        TYR   5   2.199   2.605  -5.484
   35    HA   TYR   5           HA       TYR   5   0.077   0.746  -4.458
   36   1HB   TYR   5          2HB       TYR   5   2.833   0.075  -5.537
   37   2HB   TYR   5          1HB       TYR   5   1.541  -1.063  -5.155
   38    HD1  TYR   5           1HD      TYR   5   2.311   1.894  -7.322
   39    HD2  TYR   5           2HD      TYR   5  -0.017  -1.677  -6.799
   40    HE1  TYR   5           1HE      TYR   5   1.397   2.153  -9.613
   41    HE2  TYR   5           2HE      TYR   5  -0.930  -1.418  -9.090
   42    HH   TYR   5           HH       TYR   5   0.310   1.010 -11.297
   43    HA   PRO   6           HA       PRO   6   2.490   2.020  -0.816
   44   1HB   PRO   6          2HB       PRO   6   0.481   1.466   0.965
   45   2HB   PRO   6          1HB       PRO   6   0.587   2.992   0.063
   46   1HG   PRO   6          2HG       PRO   6  -1.096   0.593  -0.470
   47   2HG   PRO   6          1HG       PRO   6  -1.500   2.312  -0.616
   48   1HD   PRO   6          2HD       PRO   6  -0.884   0.748  -2.751
   49   2HD   PRO   6          1HD       PRO   6  -0.554   2.494  -2.699
   50    H    VAL   7           H        VAL   7   3.882   0.583   0.092
   51    HA   VAL   7           HA       VAL   7   3.320  -2.308   0.004
   52    HB   VAL   7           HB       VAL   7   5.700  -2.345   0.934
   53   1HG1  VAL   7          1HG1      VAL   7   4.801  -2.042  -1.596
   54   2HG1  VAL   7          2HG1      VAL   7   6.517  -2.129  -1.202
   55   3HG1  VAL   7          3HG1      VAL   7   5.746  -0.562  -1.451
   56   1HG2  VAL   7          1HG2      VAL   7   5.095   0.255   1.658
   57   2HG2  VAL   7          2HG2      VAL   7   6.087   0.482   0.218
   58   3HG2  VAL   7          3HG2      VAL   7   6.721  -0.426   1.592
   59    H    ASP   8           H        ASP   8   4.507  -3.310   2.221
   60    HA   ASP   8           HA       ASP   8   2.529  -3.085   4.270
   61   1HB   ASP   8          2HB       ASP   8   4.404  -4.858   3.613
   62   2HB   ASP   8          1HB       ASP   8   5.332  -3.980   4.829
   63    H    TYR   9           H        TYR   9   4.099  -2.888   6.634
   64    HA   TYR   9           HA       TYR   9   4.411   0.053   6.794
   65   1HB   TYR   9          2HB       TYR   9   3.513  -2.064   8.446
   66   2HB   TYR   9          1HB       TYR   9   4.959  -1.417   9.220
   67    HD1  TYR   9           1HD      TYR   9   5.038   1.348   8.864
   68    HD2  TYR   9           2HD      TYR   9   1.543  -1.121   9.246
   69    HE1  TYR   9           1HE      TYR   9   3.740   3.306   9.659
   70    HE2  TYR   9           2HE      TYR   9   0.247   0.837  10.040
   71    HH   TYR   9           HH       TYR   9   1.667   3.685  11.074
   72    H    TRP  10           H        TRP  10   6.383  -2.807   6.612
   73    HA   TRP  10           HA       TRP  10   8.809  -1.129   7.163
   74   1HB   TRP  10          2HB       TRP  10   8.471  -4.079   7.758
   75   2HB   TRP  10          1HB       TRP  10   9.749  -3.007   8.330
   76    HD1  TRP  10           HD       TRP  10   8.981  -1.041  10.071
   77    HE1  TRP  10           1HE      TRP  10   7.123  -1.064  11.858
   78    HE3  TRP  10           3HE      TRP  10   6.195  -4.976   8.394
   79    HZ2  TRP  10           2HZ      TRP  10   4.765  -2.556  12.491
   80    HZ3  TRP  10           3HZ      TRP  10   4.149  -5.676   9.604
   81    HH2  TRP  10           HH       TRP  10   3.431  -4.472  11.650
   82    H    ASN  11           H        ASN  11   7.265  -2.210   4.646
   83    HA   ASN  11           HA       ASN  11   7.901  -2.911   2.484
   84   1HB   ASN  11          2HB       ASN  11  10.669  -2.468   3.642
   85   2HB   ASN  11          1HB       ASN  11  10.223  -2.417   1.935
   86   1HD2  ASN  11          1HD2      ASN  11  11.388  -0.115   2.758
   87   2HD2  ASN  11          2HD2      ASN  11  10.249   1.114   3.025
   88    H    CYS  12           H        CYS  12   8.150  -4.753   5.101
   89    HA   CYS  12           HA       CYS  12  10.008  -6.827   4.207
   90   1HB   CYS  12          2HB       CYS  12   9.141  -6.108   6.597
   91   2HB   CYS  12          1HB       CYS  12   7.819  -7.216   6.230
   92    H    LYS  13           H        LYS  13   6.466  -6.568   4.494
   93    HA   LYS  13           HA       LYS  13   6.021  -9.058   3.018
   94   1HB   LYS  13          2HB       LYS  13   4.516  -7.004   4.505
   95   2HB   LYS  13          1HB       LYS  13   3.631  -7.685   3.141
   96   1HG   LYS  13          2HG       LYS  13   3.132  -9.104   4.992
   97   2HG   LYS  13          1HG       LYS  13   4.318  -9.984   4.027
   98   1HD   LYS  13          2HD       LYS  13   6.025  -9.647   5.562
   99   2HD   LYS  13          1HD       LYS  13   5.303  -8.168   6.196
  100   1HE   LYS  13          2HE       LYS  13   3.816 -10.750   6.570
  101   2HE   LYS  13          1HE       LYS  13   5.194 -10.392   7.629
  102   1HZ   LYS  13          1HZ       LYS  13   2.727  -8.819   7.224
  103   2HZ   LYS  13          2HZ       LYS  13   4.145  -8.080   7.797
  104   3HZ   LYS  13          3HZ       LYS  13   3.423  -9.338   8.681
  105    H    ARG  14           H        ARG  14   5.077  -9.152   0.882
  106    HA   ARG  14           HA       ARG  14   6.118  -7.552  -1.134
  107   1HB   ARG  14          2HB       ARG  14   4.106  -9.554  -0.777
  108   2HB   ARG  14          1HB       ARG  14   3.445  -8.309  -1.837
  109   1HG   ARG  14          2HG       ARG  14   5.959  -8.554  -2.860
  110   2HG   ARG  14          1HG       ARG  14   5.665 -10.205  -2.313
  111   1HD   ARG  14          2HD       ARG  14   3.261  -9.384  -3.552
  112   2HD   ARG  14          1HD       ARG  14   4.573  -8.864  -4.629
  113    HE   ARG  14           HE       ARG  14   3.867 -11.620  -4.056
  114   1HH1  ARG  14          1HH2      ARG  14   5.218 -10.563  -6.557
  115   2HH1  ARG  14          2HH2      ARG  14   6.793 -11.269  -6.420
  116   1HH2  ARG  14          1HH1      ARG  14   6.441 -12.055  -3.062
  117   2HH2  ARG  14          2HH1      ARG  14   7.486 -12.114  -4.441
  118    H    ILE  15           H        ILE  15   4.722  -6.045  -2.612
  119    HA   ILE  15           HA       ILE  15   3.900  -3.735  -1.065
  120    HB   ILE  15           HB       ILE  15   3.519  -4.428  -3.998
  121   1HG1  ILE  15          2HG1      ILE  15   5.725  -2.650  -3.298
  122   2HG1  ILE  15          1HG1      ILE  15   5.901  -4.239  -2.553
  123   1HG2  ILE  15          1HG2      ILE  15   2.796  -2.302  -4.292
  124   2HG2  ILE  15          2HG2      ILE  15   4.071  -1.652  -3.265
  125   3HG2  ILE  15          3HG2      ILE  15   2.577  -2.248  -2.543
  126   1HD1  ILE  15          1HD1      ILE  15   5.165  -5.032  -5.007
  127   2HD1  ILE  15          2HD1      ILE  15   6.849  -4.710  -4.598
  128   3HD1  ILE  15          3HD1      ILE  15   5.898  -3.487  -5.439
  129    H    CYS  16           H        CYS  16   2.333  -6.605  -1.668
  130    HA   CYS  16           HA       CYS  16  -0.329  -5.405  -1.102
  131   1HB   CYS  16          2HB       CYS  16  -0.244  -5.591  -3.513
  132   2HB   CYS  16          1HB       CYS  16   0.417  -7.220  -3.415
  133    H    TRP  17           H        TRP  17  -1.787  -6.970  -0.115
  134    HA   TRP  17           HA       TRP  17  -0.408  -9.460   0.844
  135   1HB   TRP  17          2HB       TRP  17  -0.795  -7.730   2.575
  136   2HB   TRP  17          1HB       TRP  17  -2.513  -7.720   2.178
  137    HD1  TRP  17           HD       TRP  17   0.016 -10.570   2.893
  138    HE1  TRP  17           1HE      TRP  17  -1.065 -12.178   4.588
  139    HE3  TRP  17           3HE      TRP  17  -4.438  -8.215   3.676
  140    HZ2  TRP  17           2HZ      TRP  17  -3.479 -12.449   6.078
  141    HZ3  TRP  17           3HZ      TRP  17  -6.114  -9.167   5.233
  142    HH2  TRP  17           HH       TRP  17  -5.639 -11.280   6.437
  143    H    TYR  18           H        TYR  18  -2.081 -11.203   1.449
  144    HA   TYR  18           HA       TYR  18  -3.889 -11.609  -0.815
  145   1HB   TYR  18          2HB       TYR  18  -2.425 -13.302   0.475
  146   2HB   TYR  18          1HB       TYR  18  -3.667 -13.237   1.726
  147    HD1  TYR  18           1HD      TYR  18  -5.419 -14.765   1.598
  148    HD2  TYR  18           2HD      TYR  18  -3.393 -13.590  -2.004
  149    HE1  TYR  18           1HE      TYR  18  -6.811 -16.352   0.297
  150    HE2  TYR  18           2HE      TYR  18  -4.787 -15.177  -3.303
  151    HH   TYR  18           HH       TYR  18  -6.082 -17.417  -2.683
  152    H    ASN  19           H        ASN  19  -5.518  -9.972  -0.568
  153    HA   ASN  19           HA       ASN  19  -7.723 -10.646   1.194
  154   1HB   ASN  19          2HB       ASN  19  -7.506  -8.536   2.558
  155   2HB   ASN  19          1HB       ASN  19  -6.208  -9.696   2.852
  156   1HD2  ASN  19          1HD2      ASN  19  -6.960  -6.549   1.476
  157   2HD2  ASN  19          2HD2      ASN  19  -5.358  -6.106   1.132
  158    H    ASN  20           H        ASN  20  -9.591  -9.594   0.472
  159    HA   ASN  20           HA       ASN  20  -9.303  -7.860  -1.912
  160   1HB   ASN  20          2HB       ASN  20 -11.807  -8.209  -1.946
  161   2HB   ASN  20          1HB       ASN  20 -10.873  -9.705  -1.989
  162   1HD2  ASN  20          1HD2      ASN  20 -12.899 -10.720  -1.038
  163   2HD2  ASN  20          2HD2      ASN  20 -13.152 -10.608   0.637
  164    H    LYS  21           H        LYS  21  -9.124  -7.239   1.280
  165    HA   LYS  21           HA       LYS  21 -10.221  -4.511   0.947
  166   1HB   LYS  21          2HB       LYS  21 -11.434  -6.714   2.512
  167   2HB   LYS  21          1HB       LYS  21 -11.357  -5.153   3.330
  168   1HG   LYS  21          2HG       LYS  21 -12.197  -4.450   0.798
  169   2HG   LYS  21          1HG       LYS  21 -13.019  -5.990   1.058
  170   1HD   LYS  21          2HD       LYS  21 -13.828  -5.129   3.264
  171   2HD   LYS  21          1HD       LYS  21 -13.112  -3.565   2.876
  172   1HE   LYS  21          2HE       LYS  21 -14.572  -3.297   0.957
  173   2HE   LYS  21          1HE       LYS  21 -15.194  -4.948   1.147
  174   1HZ   LYS  21          1HZ       LYS  21 -15.856  -4.307   3.442
  175   2HZ   LYS  21          2HZ       LYS  21 -16.711  -3.480   2.229
  176   3HZ   LYS  21          3HZ       LYS  21 -15.458  -2.700   3.071
  177    H    TYR  22           H        TYR  22  -8.372  -6.837   2.908
  178    HA   TYR  22           HA       TYR  22  -7.603  -5.288   5.088
  179   1HB   TYR  22          2HB       TYR  22  -6.855  -7.677   4.037
  180   2HB   TYR  22          1HB       TYR  22  -5.414  -6.719   3.690
  181    HD1  TYR  22           1HD      TYR  22  -7.734  -7.764   6.410
  182    HD2  TYR  22           2HD      TYR  22  -3.908  -6.079   5.420
  183    HE1  TYR  22           1HE      TYR  22  -7.044  -7.938   8.785
  184    HE2  TYR  22           2HE      TYR  22  -3.217  -6.256   7.797
  185    HH   TYR  22           HH       TYR  22  -4.829  -6.347  10.176
  186    H    CYS  23           H        CYS  23  -6.820  -4.729   1.738
  187    HA   CYS  23           HA       CYS  23  -4.566  -2.928   2.339
  188   1HB   CYS  23          2HB       CYS  23  -5.450  -4.494   0.199
  189   2HB   CYS  23          1HB       CYS  23  -5.724  -2.838  -0.341
  190    H    ASN  24           H        ASN  24  -7.988  -2.688   1.416
  191    HA   ASN  24           HA       ASN  24  -7.952   0.182   0.966
  192   1HB   ASN  24          2HB       ASN  24  -9.598  -1.644   0.165
  193   2HB   ASN  24          1HB       ASN  24 -10.311  -1.537   1.775
  194   1HD2  ASN  24          1HD2      ASN  24 -10.300  -0.106  -1.348
  195   2HD2  ASN  24          2HD2      ASN  24 -11.189   1.287  -0.961
  196    H    ASP  25           H        ASP  25  -8.781  -1.919   3.730
  197    HA   ASP  25           HA       ASP  25  -9.732   0.124   5.493
  198   1HB   ASP  25          2HB       ASP  25  -8.482  -2.608   5.794
  199   2HB   ASP  25          1HB       ASP  25  -8.936  -1.663   7.212
  200    H    LEU  26           H        LEU  26  -6.473  -1.043   4.735
  201    HA   LEU  26           HA       LEU  26  -5.215   0.569   6.843
  202   1HB   LEU  26          2HB       LEU  26  -3.819  -1.194   6.484
  203   2HB   LEU  26          1HB       LEU  26  -4.583  -1.564   4.942
  204    HG   LEU  26           HG       LEU  26  -3.253   0.252   3.884
  205   1HD1  LEU  26          1HD1      LEU  26  -2.298   1.796   5.220
  206   2HD1  LEU  26          2HD1      LEU  26  -1.182   0.556   5.793
  207   3HD1  LEU  26          3HD1      LEU  26  -2.694   0.848   6.653
  208   1HD2  LEU  26          1HD2      LEU  26  -1.980  -2.086   5.269
  209   2HD2  LEU  26          2HD2      LEU  26  -0.949  -0.953   4.393
  210   3HD2  LEU  26          3HD2      LEU  26  -2.233  -1.814   3.544
  211    H    CYS  27           H        CYS  27  -5.480   0.627   3.287
  212    HA   CYS  27           HA       CYS  27  -3.914   2.942   2.777
  213   1HB   CYS  27          2HB       CYS  27  -6.110   1.386   1.482
  214   2HB   CYS  27          1HB       CYS  27  -5.783   2.987   0.824
  215    H    LYS  28           H        LYS  28  -7.360   2.590   3.598
  216    HA   LYS  28           HA       LYS  28  -8.054   5.365   3.337
  217   1HB   LYS  28          2HB       LYS  28  -9.197   2.866   4.186
  218   2HB   LYS  28          1HB       LYS  28  -9.564   4.088   5.402
  219   1HG   LYS  28          2HG       LYS  28 -10.961   5.221   4.016
  220   2HG   LYS  28          1HG       LYS  28  -9.890   5.022   2.627
  221   1HD   LYS  28          2HD       LYS  28 -11.587   3.640   1.929
  222   2HD   LYS  28          1HD       LYS  28 -10.693   2.470   2.900
  223   1HE   LYS  28          2HE       LYS  28 -12.142   3.070   4.866
  224   2HE   LYS  28          1HE       LYS  28 -13.110   4.087   3.779
  225   1HZ   LYS  28          1HZ       LYS  28 -12.568   1.181   3.462
  226   2HZ   LYS  28          2HZ       LYS  28 -13.377   2.143   2.319
  227   3HZ   LYS  28          3HZ       LYS  28 -14.060   1.886   3.853
  228    H    GLY  29           H        GLY  29  -6.651   3.438   5.938
  229   1HA   GLY  29          2HA       GLY  29  -6.916   5.199   8.113
  230   2HA   GLY  29          1HA       GLY  29  -5.534   4.122   7.890
  231    H    LEU  30           H        LEU  30  -4.636   5.247   5.401
  232    HA   LEU  30           HA       LEU  30  -3.152   7.548   6.443
  233   1HB   LEU  30          2HB       LEU  30  -3.293   6.213   3.718
  234   2HB   LEU  30          1HB       LEU  30  -2.069   7.384   4.208
  235    HG   LEU  30           HG       LEU  30  -2.432   5.081   6.037
  236   1HD1  LEU  30          1HD1      LEU  30  -1.006   3.634   4.555
  237   2HD1  LEU  30          2HD1      LEU  30  -1.266   4.792   3.251
  238   3HD1  LEU  30          3HD1      LEU  30  -2.631   3.901   3.923
  239   1HD2  LEU  30          1HD2      LEU  30  -0.453   7.058   5.296
  240   2HD2  LEU  30          2HD2      LEU  30   0.242   5.440   5.194
  241   3HD2  LEU  30          3HD2      LEU  30  -0.481   5.996   6.703
  242    H    LYS  31           H        LYS  31  -5.745   6.925   4.159
  243    HA   LYS  31           HA       LYS  31  -7.434   8.946   4.183
  244   1HB   LYS  31          2HB       LYS  31  -5.779  10.664   4.455
  245   2HB   LYS  31          1HB       LYS  31  -4.853  10.082   3.068
  246   1HG   LYS  31          2HG       LYS  31  -6.239  11.098   1.560
  247   2HG   LYS  31          1HG       LYS  31  -7.682  10.789   2.527
  248   1HD   LYS  31          2HD       LYS  31  -6.982  12.576   4.105
  249   2HD   LYS  31          1HD       LYS  31  -5.596  12.921   3.070
  250   1HE   LYS  31          2HE       LYS  31  -6.954  13.738   1.315
  251   2HE   LYS  31          1HE       LYS  31  -8.410  12.957   1.963
  252   1HZ   LYS  31          1HZ       LYS  31  -8.654  14.514   3.575
  253   2HZ   LYS  31          2HZ       LYS  31  -7.863  15.493   2.433
  254   3HZ   LYS  31          3HZ       LYS  31  -6.989  14.806   3.718
  255    H    ALA  32           H        ALA  32  -5.837   6.679   2.382
  256    HA   ALA  32           HA       ALA  32  -6.818   7.500  -0.272
  257   1HB   ALA  32          1HB       ALA  32  -5.532   5.653  -1.017
  258   2HB   ALA  32          2HB       ALA  32  -5.664   4.830   0.537
  259   3HB   ALA  32          3HB       ALA  32  -4.638   6.252   0.378
  260    H    ASP  33           H        ASP  33  -9.039   7.263  -0.527
  261    HA   ASP  33           HA       ASP  33 -10.553   5.203   0.885
  262   1HB   ASP  33          2HB       ASP  33 -11.118   7.297  -1.217
  263   2HB   ASP  33          1HB       ASP  33 -12.367   6.176  -0.674
  264    H    SER  34           H        SER  34  -9.583   5.760  -2.499
  265    HA   SER  34           HA       SER  34 -10.754   3.219  -3.393
  266   1HB   SER  34          2HB       SER  34 -10.814   4.888  -5.021
  267   2HB   SER  34          1HB       SER  34  -9.247   5.541  -4.553
  268    HG   SER  34           HG       SER  34  -9.046   4.414  -6.490
  269    H    GLY  35           H        GLY  35  -9.366   1.991  -1.708
  270   1HA   GLY  35          2HA       GLY  35  -6.652   1.458  -2.853
  271   2HA   GLY  35          1HA       GLY  35  -7.010   1.339  -1.129
  272    H    TYR  36           H        TYR  36  -6.522  -0.505  -3.793
  273    HA   TYR  36           HA       TYR  36  -8.003  -2.807  -2.596
  274   1HB   TYR  36          2HB       TYR  36  -8.989  -3.340  -4.738
  275   2HB   TYR  36          1HB       TYR  36  -9.320  -1.636  -4.430
  276    HD1  TYR  36           1HD      TYR  36  -8.567   0.035  -5.919
  277    HD2  TYR  36           2HD      TYR  36  -6.943  -3.934  -6.162
  278    HE1  TYR  36           1HE      TYR  36  -7.387   0.646  -8.014
  279    HE2  TYR  36           2HE      TYR  36  -5.763  -3.324  -8.256
  280    HH   TYR  36           HH       TYR  36  -6.155  -1.541 -10.133
  281    H    CYS  37           H        CYS  37  -7.016  -4.870  -3.175
  282    HA   CYS  37           HA       CYS  37  -4.208  -4.566  -4.156
  283   1HB   CYS  37          2HB       CYS  37  -5.439  -5.820  -1.932
  284   2HB   CYS  37          1HB       CYS  37  -4.811  -7.111  -2.956
  285    H    TRP  38           H        TRP  38  -3.721  -5.403  -6.125
  286    HA   TRP  38           HA       TRP  38  -5.709  -7.064  -7.553
  287   1HB   TRP  38          2HB       TRP  38  -4.356  -5.035  -8.421
  288   2HB   TRP  38          1HB       TRP  38  -2.985  -6.142  -8.497
  289    HD1  TRP  38           HD       TRP  38  -2.761  -7.480 -10.643
  290    HE1  TRP  38           1HE      TRP  38  -4.310  -8.087 -12.613
  291    HE3  TRP  38           3HE      TRP  38  -7.150  -5.495  -8.957
  292    HZ2  TRP  38           2HZ      TRP  38  -7.050  -7.772 -13.374
  293    HZ3  TRP  38           3HZ      TRP  38  -9.213  -5.662 -10.321
  294    HH2  TRP  38           HH       TRP  38  -9.168  -6.796 -12.525
  295    H    GLY  39           H        GLY  39  -5.601  -9.256  -7.192
  296   1HA   GLY  39          2HA       GLY  39  -3.150 -10.519  -6.227
  297   2HA   GLY  39          1HA       GLY  39  -4.674 -11.339  -6.561
  298    H    TRP  40           H        TRP  40  -1.921  -9.809  -8.240
  299    HA   TRP  40           HA       TRP  40  -1.768 -12.078 -10.097
  300   1HB   TRP  40          2HB       TRP  40  -3.500 -10.922 -11.222
  301   2HB   TRP  40          1HB       TRP  40  -2.806  -9.347 -10.848
  302    HD1  TRP  40           HD       TRP  40  -2.704  -8.665 -13.415
  303    HE1  TRP  40           1HE      TRP  40  -1.089  -9.336 -15.309
  304    HE3  TRP  40           3HE      TRP  40  -0.506 -12.757 -11.294
  305    HZ2  TRP  40           2HZ      TRP  40   0.876 -11.343 -15.853
  306    HZ3  TRP  40           3HZ      TRP  40   1.233 -14.028 -12.520
  307    HH2  TRP  40           HH       TRP  40   1.925 -13.328 -14.795
  308    H    THR  41           H        THR  41  -0.859  -8.661 -10.448
  309    HA   THR  41           HA       THR  41   1.903  -9.066  -9.626
  310    HB   THR  41           HB       THR  41   1.703 -10.293 -11.825
  311    HG1  THR  41           1HG      THR  41   3.649  -9.214 -11.065
  312   1HG2  THR  41          1HG2      THR  41   1.188  -9.161 -13.817
  313   2HG2  THR  41          2HG2      THR  41   1.489  -7.576 -13.103
  314   3HG2  THR  41          3HG2      THR  41   0.037  -8.477 -12.669
  315    H    LEU  42           H        LEU  42  -0.200  -7.149  -9.078
  316    HA   LEU  42           HA       LEU  42   1.083  -4.668 -10.172
  317   1HB   LEU  42          2HB       LEU  42  -1.791  -5.530  -9.935
  318   2HB   LEU  42          1HB       LEU  42  -1.390  -3.812  -9.902
  319    HG   LEU  42           HG       LEU  42   0.083  -5.042 -12.030
  320   1HD1  LEU  42          1HD1      LEU  42  -2.906  -5.566 -12.074
  321   2HD1  LEU  42          2HD1      LEU  42  -1.647  -6.798 -11.984
  322   3HD1  LEU  42          3HD1      LEU  42  -1.807  -5.805 -13.432
  323   1HD2  LEU  42          1HD2      LEU  42  -1.818  -2.843 -11.548
  324   2HD2  LEU  42          2HD2      LEU  42  -1.882  -3.496 -13.185
  325   3HD2  LEU  42          3HD2      LEU  42  -0.362  -2.872 -12.544
  326    H    SER  43           H        SER  43   0.557  -6.468  -7.435
  327    HA   SER  43           HA       SER  43   0.628  -5.949  -5.130
  328   1HB   SER  43          2HB       SER  43   1.672  -3.366  -6.328
  329   2HB   SER  43          1HB       SER  43   1.873  -3.865  -4.652
  330    HG   SER  43           HG       SER  43   2.872  -5.121  -6.992
  331    H    CYS  44           H        CYS  44   0.083  -3.667  -3.715
  332    HA   CYS  44           HA       CYS  44  -2.802  -3.403  -4.049
  333   1HB   CYS  44          2HB       CYS  44  -1.331  -3.481  -1.914
  334   2HB   CYS  44          1HB       CYS  44  -1.017  -1.776  -2.241
  335    H    TYR  45           H        TYR  45  -3.924  -1.433  -4.538
  336    HA   TYR  45           HA       TYR  45  -2.244   0.750  -5.704
  337   1HB   TYR  45          2HB       TYR  45  -3.263  -0.999  -7.322
  338   2HB   TYR  45          1HB       TYR  45  -4.810  -0.238  -6.942
  339    HD1  TYR  45           1HD      TYR  45  -5.452   1.154  -8.705
  340    HD2  TYR  45           2HD      TYR  45  -1.352   1.131  -7.428
  341    HE1  TYR  45           1HE      TYR  45  -4.946   2.988 -10.295
  342    HE2  TYR  45           2HE      TYR  45  -0.846   2.963  -9.019
  343    HH   TYR  45           HH       TYR  45  -3.051   4.899 -10.349
  344    H    CYS  46           H        CYS  46  -2.714   2.324  -4.134
  345    HA   CYS  46           HA       CYS  46  -5.622   2.892  -3.645
  346   1HB   CYS  46          2HB       CYS  46  -3.179   3.369  -1.905
  347   2HB   CYS  46          1HB       CYS  46  -4.832   3.796  -1.470
  348    H    GLN  47           H        GLN  47  -6.307   4.933  -4.217
  349    HA   GLN  47           HA       GLN  47  -4.199   6.937  -4.965
  350   1HB   GLN  47          2HB       GLN  47  -7.003   6.688  -6.089
  351   2HB   GLN  47          1HB       GLN  47  -5.641   7.579  -6.770
  352   1HG   GLN  47          2HG       GLN  47  -4.475   5.216  -6.776
  353   2HG   GLN  47          1HG       GLN  47  -6.135   4.619  -6.731
  354   1HE2  GLN  47          1HE2      GLN  47  -7.275   4.603  -8.697
  355   2HE2  GLN  47          2HE2      GLN  47  -6.730   5.344 -10.124
  356    H    GLY  48           H        GLY  48  -4.382   8.925  -3.952
  357   1HA   GLY  48          2HA       GLY  48  -5.749  10.758  -3.061
  358   2HA   GLY  48          1HA       GLY  48  -6.954   9.561  -2.576
  359    H    LEU  49           H        LEU  49  -3.452   9.358  -2.098
  360    HA   LEU  49           HA       LEU  49  -3.964   9.313   0.857
  361   1HB   LEU  49          2HB       LEU  49  -1.552   8.090   0.558
  362   2HB   LEU  49          1HB       LEU  49  -3.080   7.220   0.509
  363    HG   LEU  49           HG       LEU  49  -1.886   8.396  -2.000
  364   1HD1  LEU  49          1HD1      LEU  49  -1.082   5.926  -2.311
  365   2HD1  LEU  49          2HD1      LEU  49  -1.150   5.867  -0.549
  366   3HD1  LEU  49          3HD1      LEU  49  -0.096   7.031  -1.353
  367   1HD2  LEU  49          1HD2      LEU  49  -3.390   5.830  -1.893
  368   2HD2  LEU  49          2HD2      LEU  49  -3.472   7.130  -3.083
  369   3HD2  LEU  49          3HD2      LEU  49  -4.312   7.291  -1.540
  370    HA   PRO  50           HA       PRO  50  -1.146  12.639   1.391
  371   1HB   PRO  50          2HB       PRO  50   0.492  11.837   3.434
  372   2HB   PRO  50          1HB       PRO  50  -1.208  12.289   3.678
  373   1HG   PRO  50          2HG       PRO  50   0.021   9.585   3.483
  374   2HG   PRO  50          1HG       PRO  50  -1.277  10.162   4.541
  375   1HD   PRO  50          2HD       PRO  50  -1.717   8.684   2.294
  376   2HD   PRO  50          1HD       PRO  50  -2.892   9.846   2.948
  377    H    ASP  51           H        ASP  51   1.063  13.357   0.944
  378    HA   ASP  51           HA       ASP  51   2.466  11.875  -1.041
  379   1HB   ASP  51          2HB       ASP  51   2.516  14.346  -0.612
  380   2HB   ASP  51          1HB       ASP  51   3.488  14.038   0.827
  381    H    ASN  52           H        ASN  52   2.557  11.682   2.426
  382    HA   ASN  52           HA       ASN  52   5.215  10.469   2.600
  383   1HB   ASN  52          2HB       ASN  52   3.663  11.812   4.307
  384   2HB   ASN  52          1HB       ASN  52   3.104  10.187   4.703
  385   1HD2  ASN  52          1HD2      ASN  52   4.281   9.288   6.389
  386   2HD2  ASN  52          2HD2      ASN  52   5.924   9.579   6.703
  387    H    ALA  53           H        ALA  53   2.357   9.351   1.346
  388    HA   ALA  53           HA       ALA  53   2.023   6.754   2.487
  389   1HB   ALA  53          1HB       ALA  53   1.210   6.474  -0.083
  390   2HB   ALA  53          2HB       ALA  53   1.303   8.233   0.011
  391   3HB   ALA  53          3HB       ALA  53   0.268   7.344   1.127
  392    H    ARG  54           H        ARG  54   3.954   5.548   2.695
  393    HA   ARG  54           HA       ARG  54   6.117   5.459   0.895
  394   1HB   ARG  54          2HB       ARG  54   6.498   3.193   1.967
  395   2HB   ARG  54          1HB       ARG  54   6.260   4.522   3.102
  396   1HG   ARG  54          2HG       ARG  54   3.716   3.367   2.345
  397   2HG   ARG  54          1HG       ARG  54   4.795   2.126   2.985
  398   1HD   ARG  54          2HD       ARG  54   4.044   4.738   4.337
  399   2HD   ARG  54          1HD       ARG  54   3.618   3.100   4.866
  400    HE   ARG  54           HE       ARG  54   6.067   4.355   5.499
  401   1HH1  ARG  54          1HH1      ARG  54   4.626   1.339   4.996
  402   2HH1  ARG  54          2HH1      ARG  54   6.107   0.442   5.028
  403   1HH2  ARG  54          1HH2      ARG  54   8.122   3.264   5.119
  404   2HH2  ARG  54          2HH2      ARG  54   8.087   1.532   5.098
  405    H    ILE  55           H        ILE  55   6.626   4.035  -0.847
  406    HA   ILE  55           HA       ILE  55   4.397   2.342  -1.904
  407    HB   ILE  55           HB       ILE  55   6.046   4.323  -3.495
  408   1HG1  ILE  55          2HG1      ILE  55   4.596   5.483  -1.862
  409   2HG1  ILE  55          1HG1      ILE  55   4.026   5.736  -3.511
  410   1HG2  ILE  55          1HG2      ILE  55   4.058   2.266  -4.149
  411   2HG2  ILE  55          2HG2      ILE  55   5.237   3.057  -5.190
  412   3HG2  ILE  55          3HG2      ILE  55   3.696   3.843  -4.846
  413   1HD1  ILE  55          1HD1      ILE  55   2.867   3.327  -2.388
  414   2HD1  ILE  55          2HD1      ILE  55   2.056   4.743  -3.055
  415   3HD1  ILE  55          3HD1      ILE  55   2.534   4.720  -1.358
  416    H    LYS  56           H        LYS  56   5.282   0.925  -3.750
  417    HA   LYS  56           HA       LYS  56   7.340  -0.762  -3.023
  418   1HB   LYS  56          2HB       LYS  56   7.557  -1.121  -5.548
  419   2HB   LYS  56          1HB       LYS  56   5.919  -1.226  -4.902
  420   1HG   LYS  56          2HG       LYS  56   5.304   0.380  -6.354
  421   2HG   LYS  56          1HG       LYS  56   6.343   1.505  -5.478
  422   1HD   LYS  56          2HD       LYS  56   7.122   1.588  -7.718
  423   2HD   LYS  56          1HD       LYS  56   8.274   0.547  -6.881
  424   1HE   LYS  56          2HE       LYS  56   7.606  -1.330  -8.025
  425   2HE   LYS  56          1HE       LYS  56   5.908  -0.816  -8.073
  426   1HZ   LYS  56          1HZ       LYS  56   7.874   0.815  -9.499
  427   2HZ   LYS  56          2HZ       LYS  56   6.248   0.501  -9.878
  428   3HZ   LYS  56          3HZ       LYS  56   7.438  -0.667 -10.200
  429    H    ARG  57           H        ARG  57   9.177   0.296  -2.118
  430    HA   ARG  57           HA       ARG  57  10.845   1.844  -4.076
  431   1HB   ARG  57          2HB       ARG  57   9.746   3.133  -2.183
  432   2HB   ARG  57          1HB       ARG  57  10.727   2.185  -1.065
  433   1HG   ARG  57          2HG       ARG  57  12.732   2.959  -2.538
  434   2HG   ARG  57          1HG       ARG  57  11.621   4.204  -3.112
  435   1HD   ARG  57          2HD       ARG  57  11.393   4.088  -0.260
  436   2HD   ARG  57          1HD       ARG  57  13.116   4.198  -0.677
  437    HE   ARG  57           HE       ARG  57  12.558   6.184  -2.069
  438   1HH1  ARG  57          1HH1      ARG  57  11.348   6.078   0.942
  439   2HH1  ARG  57          2HH1      ARG  57   9.963   7.081   0.669
  440   1HH2  ARG  57          1HH2      ARG  57  10.268   7.017  -2.784
  441   2HH2  ARG  57          2HH2      ARG  57   9.351   7.612  -1.441
  442    H    SER  58           H        SER  58  10.619  -1.065  -2.652
  443    HA   SER  58           HA       SER  58  12.187  -2.759  -2.155
  444   1HB   SER  58          2HB       SER  58  13.903  -2.731  -3.673
  445   2HB   SER  58          1HB       SER  58  13.053  -1.323  -4.302
  446    HG   SER  58           HG       SER  58  14.367  -0.085  -2.786
  447    H    GLY  59           H        GLY  59  14.024  -3.231  -0.710
  448   1HA   GLY  59          2HA       GLY  59  15.762  -1.731   0.677
  449   2HA   GLY  59          1HA       GLY  59  14.256  -1.200   1.426
  450    H    ARG  60           H        ARG  60  15.482  -2.224   3.349
  451    HA   ARG  60           HA       ARG  60  15.191  -5.194   3.403
  452   1HB   ARG  60          2HB       ARG  60  16.823  -3.109   4.756
  453   2HB   ARG  60          1HB       ARG  60  16.376  -4.501   5.745
  454   1HG   ARG  60          2HG       ARG  60  17.860  -5.818   4.681
  455   2HG   ARG  60          1HG       ARG  60  17.218  -5.354   3.106
  456   1HD   ARG  60          2HD       ARG  60  18.983  -3.982   2.734
  457   2HD   ARG  60          1HD       ARG  60  18.734  -3.168   4.292
  458    HE   ARG  60           HE       ARG  60  19.976  -5.866   4.326
  459   1HH1  ARG  60          1HH2      ARG  60  21.443  -3.191   3.368
  460   2HH1  ARG  60          2HH2      ARG  60  22.393  -2.899   4.787
  461   1HH2  ARG  60          1HH1      ARG  60  20.657  -5.178   6.741
  462   2HH2  ARG  60          2HH1      ARG  60  21.948  -4.024   6.697
  463    H    CYS  61           H        CYS  61  14.108  -6.156   5.293
  464    HA   CYS  61           HA       CYS  61  11.557  -5.083   5.893
  465   1HB   CYS  61          2HB       CYS  61  13.396  -7.080   7.236
  466   2HB   CYS  61          1HB       CYS  61  11.771  -6.769   7.845
  467    H    ARG  62           H        ARG  62  11.105  -3.266   7.078
  468    HA   ARG  62           HA       ARG  62  13.090  -2.121   8.920
  469   1HB   ARG  62          2HB       ARG  62  10.833  -1.296   7.368
  470   2HB   ARG  62          1HB       ARG  62  10.519  -0.867   9.049
  471   1HG   ARG  62          2HG       ARG  62  13.273  -0.302   8.211
  472   2HG   ARG  62          1HG       ARG  62  12.066   0.608   7.301
  473   1HD   ARG  62          2HD       ARG  62  11.202   0.712   9.987
  474   2HD   ARG  62          1HD       ARG  62  12.949   1.022  10.027
  475    HE   ARG  62           HE       ARG  62  12.425   3.105   9.060
  476   1HH1  ARG  62          1HH2      ARG  62   9.505   1.613   9.042
  477   2HH1  ARG  62          2HH2      ARG  62   8.960   2.226   7.516
  478   1HH2  ARG  62          1HH1      ARG  62  12.064   3.488   6.620
  479   2HH2  ARG  62          2HH1      ARG  62  10.411   3.288   6.144
  480    H    ALA  63           H        ALA  63  12.275  -4.673   9.836
  481    HA   ALA  63           HA       ALA  63  11.142  -3.955  12.458
  482   1HB   ALA  63          1HB       ALA  63   9.735  -5.998  10.723
  483   2HB   ALA  63          2HB       ALA  63   9.250  -4.302  10.760
  484   3HB   ALA  63          3HB       ALA  63   9.161  -5.278  12.227
  Start of MODEL   14
    1   1H    LYS   1          1HT       LYS   1  -2.568  12.614  -1.409
    2   2H    LYS   1          2HT       LYS   1  -3.557  13.973  -1.165
    3   3H    LYS   1          3HT       LYS   1  -1.985  14.162  -1.782
    4    HA   LYS   1           HA       LYS   1  -4.284  12.862  -3.159
    5   1HB   LYS   1          2HB       LYS   1  -4.320  15.324  -2.972
    6   2HB   LYS   1          1HB       LYS   1  -2.681  15.401  -3.621
    7   1HG   LYS   1          2HG       LYS   1  -3.800  13.958  -5.576
    8   2HG   LYS   1          1HG       LYS   1  -5.247  14.800  -5.020
    9   1HD   LYS   1          2HD       LYS   1  -4.591  16.671  -6.077
   10   2HD   LYS   1          1HD       LYS   1  -3.091  16.685  -5.149
   11   1HE   LYS   1          2HE       LYS   1  -2.139  15.021  -6.798
   12   2HE   LYS   1          1HE       LYS   1  -3.597  15.262  -7.783
   13   1HZ   LYS   1          1HZ       LYS   1  -1.879  16.811  -8.460
   14   2HZ   LYS   1          2HZ       LYS   1  -1.731  17.389  -6.869
   15   3HZ   LYS   1          3HZ       LYS   1  -3.163  17.654  -7.743
   16    H    ILE   2           H        ILE   2  -2.554  10.992  -3.127
   17    HA   ILE   2           HA       ILE   2  -0.922  11.262  -5.613
   18    HB   ILE   2           HB       ILE   2   0.496  11.736  -3.640
   19   1HG1  ILE   2          2HG1      ILE   2   0.961   9.027  -4.927
   20   2HG1  ILE   2          1HG1      ILE   2   1.544  10.584  -5.520
   21   1HG2  ILE   2          1HG2      ILE   2  -1.114   9.964  -2.331
   22   2HG2  ILE   2          2HG2      ILE   2   0.468  10.474  -1.745
   23   3HG2  ILE   2          3HG2      ILE   2   0.305   8.960  -2.632
   24   1HD1  ILE   2          1HD1      ILE   2   2.585  10.720  -3.073
   25   2HD1  ILE   2          2HD1      ILE   2   3.426   9.880  -4.375
   26   3HD1  ILE   2          3HD1      ILE   2   2.492   8.963  -3.192
   27    H    ASP   3           H        ASP   3  -0.364   9.113  -6.521
   28    HA   ASP   3           HA       ASP   3  -2.167   6.925  -5.532
   29   1HB   ASP   3          2HB       ASP   3  -2.572   6.411  -7.903
   30   2HB   ASP   3          1HB       ASP   3  -2.977   8.096  -7.574
   31    H    GLY   4           H        GLY   4  -0.970   5.153  -4.953
   32   1HA   GLY   4          2HA       GLY   4   1.175   4.156  -6.647
   33   2HA   GLY   4          1HA       GLY   4   1.780   4.829  -5.132
   34    H    TYR   5           H        TYR   5   2.461   2.499  -4.781
   35    HA   TYR   5           HA       TYR   5   0.160   0.865  -3.770
   36   1HB   TYR   5          2HB       TYR   5   2.895  -0.096  -4.645
   37   2HB   TYR   5          1HB       TYR   5   1.444  -1.067  -4.404
   38    HD1  TYR   5           1HD      TYR   5   3.008   1.530  -6.542
   39    HD2  TYR   5           2HD      TYR   5  -0.244  -1.240  -6.097
   40    HE1  TYR   5           1HE      TYR   5   2.364   1.905  -8.907
   41    HE2  TYR   5           2HE      TYR   5  -0.890  -0.865  -8.461
   42    HH   TYR   5           HH       TYR   5   0.842   1.501 -10.486
   43    HA   PRO   6           HA       PRO   6   2.388   1.768   0.039
   44   1HB   PRO   6          2HB       PRO   6   0.290   1.192   1.688
   45   2HB   PRO   6          1HB       PRO   6   0.454   2.745   0.844
   46   1HG   PRO   6          2HG       PRO   6  -1.277   0.421   0.210
   47   2HG   PRO   6          1HG       PRO   6  -1.585   2.151   0.003
   48   1HD   PRO   6          2HD       PRO   6  -0.863   0.422  -2.024
   49   2HD   PRO   6          1HD       PRO   6  -0.654   2.186  -2.070
   50    H    VAL   7           H        VAL   7   3.655   0.257   1.052
   51    HA   VAL   7           HA       VAL   7   2.789  -2.607   1.001
   52    HB   VAL   7           HB       VAL   7   5.223  -3.010   1.269
   53   1HG1  VAL   7          1HG1      VAL   7   3.920  -2.023  -0.969
   54   2HG1  VAL   7          2HG1      VAL   7   5.535  -2.731  -0.956
   55   3HG1  VAL   7          3HG1      VAL   7   5.339  -0.982  -0.847
   56   1HG2  VAL   7          1HG2      VAL   7   6.451  -1.397   2.248
   57   2HG2  VAL   7          2HG2      VAL   7   5.116  -0.253   2.117
   58   3HG2  VAL   7          3HG2      VAL   7   6.264  -0.423   0.789
   59    H    ASP   8           H        ASP   8   4.390  -3.580   3.025
   60    HA   ASP   8           HA       ASP   8   2.893  -3.057   5.396
   61   1HB   ASP   8          2HB       ASP   8   4.499  -4.996   4.610
   62   2HB   ASP   8          1HB       ASP   8   5.737  -4.036   5.421
   63    H    TYR   9           H        TYR   9   5.496  -2.844   7.043
   64    HA   TYR   9           HA       TYR   9   5.673   0.145   6.938
   65   1HB   TYR   9          2HB       TYR   9   5.572  -1.948   9.043
   66   2HB   TYR   9          1HB       TYR   9   6.648  -0.587   9.366
   67    HD1  TYR   9           1HD      TYR   9   3.443  -1.702   9.939
   68    HD2  TYR   9           2HD      TYR   9   5.500   1.768   8.465
   69    HE1  TYR   9           1HE      TYR   9   1.489  -0.293  10.529
   70    HE2  TYR   9           2HE      TYR   9   3.547   3.178   9.056
   71    HH   TYR   9           HH       TYR   9   1.467   2.699  11.026
   72    H    TRP  10           H        TRP  10   7.390  -2.627   6.136
   73    HA   TRP  10           HA       TRP  10   9.960  -1.111   6.162
   74   1HB   TRP  10          2HB       TRP  10   9.836  -4.004   6.993
   75   2HB   TRP  10          1HB       TRP  10  11.072  -2.804   7.357
   76    HD1  TRP  10           HD       TRP  10  10.487  -0.973   9.257
   77    HE1  TRP  10           1HE      TRP  10   8.836  -1.061  11.234
   78    HE3  TRP  10           3HE      TRP  10   7.592  -4.911   7.804
   79    HZ2  TRP  10           2HZ      TRP  10   6.577  -2.603  12.085
   80    HZ3  TRP  10           3HZ      TRP  10   5.696  -5.671   9.211
   81    HH2  TRP  10           HH       TRP  10   5.186  -4.523  11.348
   82    H    ASN  11           H        ASN  11   7.754  -2.610   4.332
   83    HA   ASN  11           HA       ASN  11   7.791  -3.462   2.139
   84   1HB   ASN  11          2HB       ASN  11  10.770  -2.978   2.377
   85   2HB   ASN  11          1HB       ASN  11   9.821  -3.043   0.896
   86   1HD2  ASN  11          1HD2      ASN  11  11.277  -0.724   1.298
   87   2HD2  ASN  11          2HD2      ASN  11  10.251   0.555   1.738
   88    H    CYS  12           H        CYS  12   9.122  -4.949   4.783
   89    HA   CYS  12           HA       CYS  12  10.354  -7.245   3.424
   90   1HB   CYS  12          2HB       CYS  12  10.699  -6.028   5.813
   91   2HB   CYS  12          1HB       CYS  12   9.590  -7.312   6.294
   92    H    LYS  13           H        LYS  13   7.609  -6.894   5.688
   93    HA   LYS  13           HA       LYS  13   6.453  -9.386   5.578
   94   1HB   LYS  13          2HB       LYS  13   5.463  -6.581   5.750
   95   2HB   LYS  13          1HB       LYS  13   4.250  -7.836   5.501
   96   1HG   LYS  13          2HG       LYS  13   6.365  -8.002   7.659
   97   2HG   LYS  13          1HG       LYS  13   4.767  -7.305   7.933
   98   1HD   LYS  13          2HD       LYS  13   3.673  -9.357   7.558
   99   2HD   LYS  13          1HD       LYS  13   5.068 -10.051   6.731
  100   1HE   LYS  13          2HE       LYS  13   6.332 -10.046   8.870
  101   2HE   LYS  13          1HE       LYS  13   4.900  -9.399   9.696
  102   1HZ   LYS  13          1HZ       LYS  13   4.944 -11.903   8.094
  103   2HZ   LYS  13          2HZ       LYS  13   3.626 -11.290   8.973
  104   3HZ   LYS  13          3HZ       LYS  13   5.009 -11.846   9.788
  105    H    ARG  14           H        ARG  14   5.177  -6.825   3.429
  106    HA   ARG  14           HA       ARG  14   5.446  -8.400   1.008
  107   1HB   ARG  14          2HB       ARG  14   3.123  -9.094   0.813
  108   2HB   ARG  14          1HB       ARG  14   3.735  -9.657   2.370
  109   1HG   ARG  14          2HG       ARG  14   2.717  -6.984   2.668
  110   2HG   ARG  14          1HG       ARG  14   1.490  -7.990   1.900
  111   1HD   ARG  14          2HD       ARG  14   1.169  -9.241   3.785
  112   2HD   ARG  14          1HD       ARG  14   2.902  -9.276   4.165
  113    HE   ARG  14           HE       ARG  14   2.648  -6.917   4.984
  114   1HH1  ARG  14          1HH1      ARG  14   0.982  -8.859   6.665
  115   2HH1  ARG  14          2HH1      ARG  14  -0.500  -7.974   6.815
  116   1HH2  ARG  14          1HH2      ARG  14   0.248  -5.770   4.245
  117   2HH2  ARG  14          2HH2      ARG  14  -0.915  -6.226   5.444
  118    H    ILE  15           H        ILE  15   3.718  -7.412  -0.678
  119    HA   ILE  15           HA       ILE  15   3.885  -4.447  -0.341
  120    HB   ILE  15           HB       ILE  15   3.201  -5.799  -2.931
  121   1HG1  ILE  15          2HG1      ILE  15   5.927  -5.775  -3.058
  122   2HG1  ILE  15          1HG1      ILE  15   5.689  -6.243  -1.375
  123   1HG2  ILE  15          1HG2      ILE  15   3.604  -3.244  -2.349
  124   2HG2  ILE  15          2HG2      ILE  15   4.193  -3.916  -3.869
  125   3HG2  ILE  15          3HG2      ILE  15   5.298  -3.700  -2.515
  126   1HD1  ILE  15          1HD1      ILE  15   4.998  -8.310  -1.959
  127   2HD1  ILE  15          2HD1      ILE  15   5.551  -7.937  -3.592
  128   3HD1  ILE  15          3HD1      ILE  15   3.866  -7.664  -3.148
  129    H    CYS  16           H        CYS  16   1.681  -7.090  -0.487
  130    HA   CYS  16           HA       CYS  16  -0.611  -5.279  -0.114
  131   1HB   CYS  16          2HB       CYS  16  -0.053  -5.641  -2.625
  132   2HB   CYS  16          1HB       CYS  16  -0.718  -7.257  -2.385
  133    H    TRP  17           H        TRP  17  -2.688  -6.714   0.095
  134    HA   TRP  17           HA       TRP  17  -1.963  -9.088   1.749
  135   1HB   TRP  17          2HB       TRP  17  -3.672  -6.891   2.036
  136   2HB   TRP  17          1HB       TRP  17  -4.755  -8.242   1.708
  137    HD1  TRP  17           HD       TRP  17  -3.087 -10.534   3.123
  138    HE1  TRP  17           1HE      TRP  17  -2.956 -10.601   5.697
  139    HE3  TRP  17           3HE      TRP  17  -4.240  -5.675   4.191
  140    HZ2  TRP  17           2HZ      TRP  17  -3.296  -8.827   7.917
  141    HZ3  TRP  17           3HZ      TRP  17  -4.328  -4.891   6.540
  142    HH2  TRP  17           HH       TRP  17  -3.858  -6.459   8.403
  143    H    TYR  18           H        TYR  18  -4.738 -10.108   1.505
  144    HA   TYR  18           HA       TYR  18  -4.556 -11.284  -1.250
  145   1HB   TYR  18          2HB       TYR  18  -3.959 -12.753   0.706
  146   2HB   TYR  18          1HB       TYR  18  -5.604 -12.535   1.305
  147    HD1  TYR  18           1HD      TYR  18  -6.891 -14.437   0.927
  148    HD2  TYR  18           2HD      TYR  18  -4.139 -13.132  -2.099
  149    HE1  TYR  18           1HE      TYR  18  -7.679 -16.251  -0.571
  150    HE2  TYR  18           2HE      TYR  18  -4.925 -14.944  -3.599
  151    HH   TYR  18           HH       TYR  18  -7.092 -16.322  -3.835
  152    H    ASN  19           H        ASN  19  -6.716 -10.217   1.351
  153    HA   ASN  19           HA       ASN  19  -9.141 -10.646  -0.244
  154   1HB   ASN  19          2HB       ASN  19  -8.334  -9.920   2.481
  155   2HB   ASN  19          1HB       ASN  19  -9.753  -9.031   1.927
  156   1HD2  ASN  19          1HD2      ASN  19 -10.097 -10.927   3.969
  157   2HD2  ASN  19          2HD2      ASN  19 -10.935 -12.273   3.364
  158    H    ASN  20           H        ASN  20 -10.274  -9.062  -1.372
  159    HA   ASN  20           HA       ASN  20  -8.888  -6.681  -2.235
  160   1HB   ASN  20          2HB       ASN  20 -10.415  -7.689  -3.732
  161   2HB   ASN  20          1HB       ASN  20 -11.662  -7.841  -2.495
  162   1HD2  ASN  20          1HD2      ASN  20  -9.900  -5.374  -4.426
  163   2HD2  ASN  20          2HD2      ASN  20 -11.147  -4.224  -4.378
  164    H    LYS  21           H        LYS  21 -10.506  -7.345   0.646
  165    HA   LYS  21           HA       LYS  21 -11.359  -4.499   1.015
  166   1HB   LYS  21          2HB       LYS  21 -12.445  -7.079   1.630
  167   2HB   LYS  21          1HB       LYS  21 -12.146  -6.232   3.148
  168   1HG   LYS  21          2HG       LYS  21 -13.244  -4.205   1.794
  169   2HG   LYS  21          1HG       LYS  21 -14.011  -5.536   0.927
  170   1HD   LYS  21          2HD       LYS  21 -15.532  -5.408   2.629
  171   2HD   LYS  21          1HD       LYS  21 -14.337  -6.386   3.483
  172   1HE   LYS  21          2HE       LYS  21 -13.393  -3.798   3.853
  173   2HE   LYS  21          1HE       LYS  21 -15.154  -3.620   3.990
  174   1HZ   LYS  21          1HZ       LYS  21 -14.381  -4.294   6.112
  175   2HZ   LYS  21          2HZ       LYS  21 -13.407  -5.520   5.454
  176   3HZ   LYS  21          3HZ       LYS  21 -15.099  -5.663   5.415
  177    H    TYR  22           H        TYR  22  -9.301  -7.062   2.315
  178    HA   TYR  22           HA       TYR  22  -8.559  -5.812   4.774
  179   1HB   TYR  22          2HB       TYR  22  -7.894  -8.088   3.160
  180   2HB   TYR  22          1HB       TYR  22  -6.396  -7.322   3.691
  181    HD1  TYR  22           1HD      TYR  22  -8.733  -9.729   4.576
  182    HD2  TYR  22           2HD      TYR  22  -6.595  -6.408   6.262
  183    HE1  TYR  22           1HE      TYR  22  -9.051 -10.677   6.845
  184    HE2  TYR  22           2HE      TYR  22  -6.914  -7.355   8.532
  185    HH   TYR  22           HH       TYR  22  -7.878  -8.951   9.735
  186    H    CYS  23           H        CYS  23  -7.698  -5.071   1.492
  187    HA   CYS  23           HA       CYS  23  -5.235  -3.628   2.272
  188   1HB   CYS  23          2HB       CYS  23  -6.190  -4.945   0.004
  189   2HB   CYS  23          1HB       CYS  23  -6.253  -3.238  -0.437
  190    H    ASN  24           H        ASN  24  -8.320  -2.787   0.634
  191    HA   ASN  24           HA       ASN  24  -8.070  -0.005   0.542
  192   1HB   ASN  24          2HB       ASN  24  -9.928  -1.678  -0.207
  193   2HB   ASN  24          1HB       ASN  24 -10.619  -1.379   1.388
  194   1HD2  ASN  24          1HD2      ASN  24 -12.464  -0.246   0.384
  195   2HD2  ASN  24          2HD2      ASN  24 -12.279   1.323  -0.238
  196    H    ASP  25           H        ASP  25  -8.976  -2.042   3.310
  197    HA   ASP  25           HA       ASP  25  -9.808  -0.029   5.126
  198   1HB   ASP  25          2HB       ASP  25 -10.120  -2.346   5.628
  199   2HB   ASP  25          1HB       ASP  25  -8.404  -2.694   5.417
  200    H    LEU  26           H        LEU  26  -6.535  -1.465   4.774
  201    HA   LEU  26           HA       LEU  26  -5.263   0.364   6.588
  202   1HB   LEU  26          2HB       LEU  26  -4.651  -1.893   4.956
  203   2HB   LEU  26          1HB       LEU  26  -3.477  -0.632   4.574
  204    HG   LEU  26           HG       LEU  26  -4.168  -1.543   7.380
  205   1HD1  LEU  26          1HD1      LEU  26  -2.008  -2.671   7.366
  206   2HD1  LEU  26          2HD1      LEU  26  -1.686  -2.100   5.728
  207   3HD1  LEU  26          3HD1      LEU  26  -2.974  -3.270   6.018
  208   1HD2  LEU  26          1HD2      LEU  26  -3.367   0.639   7.608
  209   2HD2  LEU  26          2HD2      LEU  26  -2.323   0.510   6.192
  210   3HD2  LEU  26          3HD2      LEU  26  -1.871  -0.288   7.699
  211    H    CYS  27           H        CYS  27  -5.588   0.344   3.023
  212    HA   CYS  27           HA       CYS  27  -3.981   2.630   2.492
  213   1HB   CYS  27          2HB       CYS  27  -6.173   1.097   1.193
  214   2HB   CYS  27          1HB       CYS  27  -5.882   2.722   0.566
  215    H    LYS  28           H        LYS  28  -7.334   2.329   3.590
  216    HA   LYS  28           HA       LYS  28  -8.127   5.056   3.196
  217   1HB   LYS  28          2HB       LYS  28  -9.331   2.763   3.956
  218   2HB   LYS  28          1HB       LYS  28  -9.103   3.493   5.546
  219   1HG   LYS  28          2HG       LYS  28 -11.200   4.327   4.871
  220   2HG   LYS  28          1HG       LYS  28 -10.093   5.637   4.457
  221   1HD   LYS  28          2HD       LYS  28  -9.981   4.825   2.135
  222   2HD   LYS  28          1HD       LYS  28 -11.072   3.500   2.541
  223   1HE   LYS  28          2HE       LYS  28 -11.838   6.398   2.981
  224   2HE   LYS  28          1HE       LYS  28 -12.190   5.537   1.468
  225   1HZ   LYS  28          1HZ       LYS  28 -13.175   3.746   2.868
  226   2HZ   LYS  28          2HZ       LYS  28 -14.037   5.209   2.915
  227   3HZ   LYS  28          3HZ       LYS  28 -13.030   4.770   4.211
  228    H    GLY  29           H        GLY  29  -6.267   3.419   5.693
  229   1HA   GLY  29          2HA       GLY  29  -6.338   5.479   7.681
  230   2HA   GLY  29          1HA       GLY  29  -5.055   4.273   7.518
  231    H    LEU  30           H        LEU  30  -4.477   4.979   4.751
  232    HA   LEU  30           HA       LEU  30  -2.772   7.349   5.258
  233   1HB   LEU  30          2HB       LEU  30  -3.023   5.447   2.900
  234   2HB   LEU  30          1HB       LEU  30  -1.727   6.619   3.142
  235    HG   LEU  30           HG       LEU  30  -2.192   4.809   5.427
  236   1HD1  LEU  30          1HD1      LEU  30  -2.132   2.869   4.289
  237   2HD1  LEU  30          2HD1      LEU  30  -0.545   3.324   3.669
  238   3HD1  LEU  30          3HD1      LEU  30  -1.998   3.735   2.758
  239   1HD2  LEU  30          1HD2      LEU  30   0.443   4.659   4.738
  240   2HD2  LEU  30          2HD2      LEU  30  -0.231   5.937   5.749
  241   3HD2  LEU  30          3HD2      LEU  30   0.008   6.211   4.024
  242    H    LYS  31           H        LYS  31  -5.814   7.332   4.772
  243    HA   LYS  31           HA       LYS  31  -7.339   8.806   3.752
  244   1HB   LYS  31          2HB       LYS  31  -5.469  10.397   4.307
  245   2HB   LYS  31          1HB       LYS  31  -4.816  10.117   2.694
  246   1HG   LYS  31          2HG       LYS  31  -6.614  11.163   1.631
  247   2HG   LYS  31          1HG       LYS  31  -7.687  10.936   3.013
  248   1HD   LYS  31          2HD       LYS  31  -5.878  12.477   4.217
  249   2HD   LYS  31          1HD       LYS  31  -5.594  13.020   2.562
  250   1HE   LYS  31          2HE       LYS  31  -8.453  12.813   3.258
  251   2HE   LYS  31          1HE       LYS  31  -7.566  14.034   4.191
  252   1HZ   LYS  31          1HZ       LYS  31  -8.421  14.314   1.610
  253   2HZ   LYS  31          2HZ       LYS  31  -6.768  13.961   1.441
  254   3HZ   LYS  31          3HZ       LYS  31  -7.265  15.283   2.384
  255    H    ALA  32           H        ALA  32  -5.955   6.421   2.267
  256    HA   ALA  32           HA       ALA  32  -6.251   7.301  -0.548
  257   1HB   ALA  32          1HB       ALA  32  -5.228   5.185  -1.026
  258   2HB   ALA  32          2HB       ALA  32  -5.646   4.552   0.565
  259   3HB   ALA  32          3HB       ALA  32  -4.412   5.802   0.410
  260    H    ASP  33           H        ASP  33  -8.555   7.666  -0.603
  261    HA   ASP  33           HA       ASP  33 -10.625   6.039   0.321
  262   1HB   ASP  33          2HB       ASP  33 -10.842   8.250  -0.751
  263   2HB   ASP  33          1HB       ASP  33 -10.393   7.545  -2.303
  264    H    SER  34           H        SER  34  -9.956   5.970  -3.161
  265    HA   SER  34           HA       SER  34 -10.884   3.246  -3.425
  266   1HB   SER  34          2HB       SER  34  -9.364   5.139  -5.242
  267   2HB   SER  34          1HB       SER  34 -10.053   3.607  -5.773
  268    HG   SER  34           HG       SER  34 -11.264   6.006  -5.233
  269    H    GLY  35           H        GLY  35  -9.512   1.952  -2.037
  270   1HA   GLY  35          2HA       GLY  35  -6.776   1.539  -3.163
  271   2HA   GLY  35          1HA       GLY  35  -7.029   1.608  -1.418
  272    H    TYR  36           H        TYR  36  -6.548  -0.552  -3.823
  273    HA   TYR  36           HA       TYR  36  -7.964  -2.694  -2.298
  274   1HB   TYR  36          2HB       TYR  36  -8.691  -3.614  -4.545
  275   2HB   TYR  36          1HB       TYR  36  -9.462  -2.096  -4.092
  276    HD1  TYR  36           1HD      TYR  36  -6.373  -3.312  -5.853
  277    HD2  TYR  36           2HD      TYR  36  -9.511  -0.383  -5.668
  278    HE1  TYR  36           1HE      TYR  36  -5.513  -2.259  -7.927
  279    HE2  TYR  36           2HE      TYR  36  -8.650   0.670  -7.740
  280    HH   TYR  36           HH       TYR  36  -7.302   0.042  -9.692
  281    H    CYS  37           H        CYS  37  -7.269  -4.905  -3.583
  282    HA   CYS  37           HA       CYS  37  -4.280  -4.762  -3.839
  283   1HB   CYS  37          2HB       CYS  37  -5.511  -5.975  -1.891
  284   2HB   CYS  37          1HB       CYS  37  -5.911  -7.193  -3.103
  285    H    TRP  38           H        TRP  38  -3.383  -5.600  -5.724
  286    HA   TRP  38           HA       TRP  38  -5.191  -6.388  -7.893
  287   1HB   TRP  38          2HB       TRP  38  -2.795  -5.114  -7.730
  288   2HB   TRP  38          1HB       TRP  38  -2.247  -6.749  -8.111
  289    HD1  TRP  38           HD       TRP  38  -1.997  -7.083 -10.598
  290    HE1  TRP  38           1HE      TRP  38  -3.230  -6.286 -12.718
  291    HE3  TRP  38           3HE      TRP  38  -5.581  -4.136  -8.472
  292    HZ2  TRP  38           2HZ      TRP  38  -5.447  -4.617 -13.417
  293    HZ3  TRP  38           3HZ      TRP  38  -7.239  -2.954  -9.885
  294    HH2  TRP  38           HH       TRP  38  -7.177  -3.189 -12.352
  295    H    GLY  39           H        GLY  39  -5.206  -8.489  -8.894
  296   1HA   GLY  39          2HA       GLY  39  -4.422 -10.673  -7.039
  297   2HA   GLY  39          1HA       GLY  39  -5.569 -10.824  -8.370
  298    H    TRP  40           H        TRP  40  -3.374  -9.176  -9.922
  299    HA   TRP  40           HA       TRP  40  -2.096 -11.561 -11.070
  300   1HB   TRP  40          2HB       TRP  40  -2.961  -9.785 -12.494
  301   2HB   TRP  40          1HB       TRP  40  -1.990  -8.586 -11.647
  302    HD1  TRP  40           HD       TRP  40  -0.034  -7.901 -13.066
  303    HE1  TRP  40           1HE      TRP  40   1.614  -9.098 -14.641
  304    HE3  TRP  40           3HE      TRP  40  -1.891 -12.648 -12.849
  305    HZ2  TRP  40           2HZ      TRP  40   2.091 -11.725 -15.675
  306    HZ3  TRP  40           3HZ      TRP  40  -0.825 -14.479 -14.134
  307    HH2  TRP  40           HH       TRP  40   1.163 -14.025 -15.546
  308    H    THR  41           H        THR  41  -0.638  -8.424 -10.262
  309    HA   THR  41           HA       THR  41   1.188  -9.369  -8.264
  310    HB   THR  41           HB       THR  41   1.987 -10.738 -10.154
  311    HG1  THR  41           1HG      THR  41   4.158  -9.637 -10.281
  312   1HG2  THR  41          1HG2      THR  41   3.178  -8.838 -11.851
  313   2HG2  THR  41          2HG2      THR  41   1.534  -8.259 -11.576
  314   3HG2  THR  41          3HG2      THR  41   1.803  -9.878 -12.222
  315    H    LEU  42           H        LEU  42  -0.293  -7.047  -8.449
  316    HA   LEU  42           HA       LEU  42   1.754  -4.947  -9.099
  317   1HB   LEU  42          2HB       LEU  42  -0.857  -5.393 -10.054
  318   2HB   LEU  42          1HB       LEU  42  -0.992  -4.024  -8.951
  319    HG   LEU  42           HG       LEU  42   0.973  -4.260 -11.251
  320   1HD1  LEU  42          1HD1      LEU  42  -0.796  -2.004 -11.384
  321   2HD1  LEU  42          2HD1      LEU  42  -1.762  -3.464 -11.163
  322   3HD1  LEU  42          3HD1      LEU  42  -0.642  -3.344 -12.520
  323   1HD2  LEU  42          1HD2      LEU  42   2.090  -2.529 -10.330
  324   2HD2  LEU  42          2HD2      LEU  42   1.117  -2.746  -8.873
  325   3HD2  LEU  42          3HD2      LEU  42   0.594  -1.618 -10.123
  326    H    SER  43           H        SER  43   1.003  -6.496  -6.492
  327    HA   SER  43           HA       SER  43   0.749  -5.959  -4.208
  328   1HB   SER  43          2HB       SER  43   2.817  -4.813  -4.676
  329   2HB   SER  43          1HB       SER  43   1.966  -3.472  -5.437
  330    HG   SER  43           HG       SER  43   2.192  -2.704  -3.459
  331    H    CYS  44           H        CYS  44  -0.001  -3.704  -2.858
  332    HA   CYS  44           HA       CYS  44  -2.829  -3.434  -3.549
  333   1HB   CYS  44          2HB       CYS  44  -1.513  -3.434  -1.241
  334   2HB   CYS  44          1HB       CYS  44  -1.387  -1.707  -1.559
  335    H    TYR  45           H        TYR  45  -3.761  -1.730  -4.674
  336    HA   TYR  45           HA       TYR  45  -1.962   0.570  -5.351
  337   1HB   TYR  45          2HB       TYR  45  -2.488  -1.088  -7.185
  338   2HB   TYR  45          1HB       TYR  45  -4.183  -0.627  -7.033
  339    HD1  TYR  45           1HD      TYR  45  -4.553   0.451  -9.129
  340    HD2  TYR  45           2HD      TYR  45  -1.231   1.618  -6.670
  341    HE1  TYR  45           1HE      TYR  45  -4.160   2.414 -10.591
  342    HE2  TYR  45           2HE      TYR  45  -0.838   3.579  -8.132
  343    HH   TYR  45           HH       TYR  45  -1.398   4.106 -10.690
  344    H    CYS  46           H        CYS  46  -2.700   2.254  -4.118
  345    HA   CYS  46           HA       CYS  46  -5.659   2.756  -4.071
  346   1HB   CYS  46          2HB       CYS  46  -3.631   3.432  -1.920
  347   2HB   CYS  46          1HB       CYS  46  -5.389   3.484  -1.785
  348    H    GLN  47           H        GLN  47  -6.264   4.976  -4.276
  349    HA   GLN  47           HA       GLN  47  -4.030   6.868  -4.940
  350   1HB   GLN  47          2HB       GLN  47  -6.720   6.641  -6.322
  351   2HB   GLN  47          1HB       GLN  47  -5.334   7.601  -6.841
  352   1HG   GLN  47          2HG       GLN  47  -4.078   5.298  -6.830
  353   2HG   GLN  47          1HG       GLN  47  -5.704   4.620  -6.922
  354   1HE2  GLN  47          1HE2      GLN  47  -6.697   4.602  -8.965
  355   2HE2  GLN  47          2HE2      GLN  47  -6.088   5.404 -10.331
  356    H    GLY  48           H        GLY  48  -4.265   8.905  -4.038
  357   1HA   GLY  48          2HA       GLY  48  -5.776  10.753  -3.352
  358   2HA   GLY  48          1HA       GLY  48  -6.882   9.526  -2.734
  359    H    LEU  49           H        LEU  49  -3.478   9.080  -2.232
  360    HA   LEU  49           HA       LEU  49  -3.931   9.522   0.686
  361   1HB   LEU  49          2HB       LEU  49  -1.457   8.374   0.502
  362   2HB   LEU  49          1HB       LEU  49  -2.951   7.458   0.632
  363    HG   LEU  49           HG       LEU  49  -1.836   8.275  -2.053
  364   1HD1  LEU  49          1HD1      LEU  49  -1.123   5.695  -1.908
  365   2HD1  LEU  49          2HD1      LEU  49  -0.970   6.104  -0.199
  366   3HD1  LEU  49          3HD1      LEU  49  -0.037   6.990  -1.406
  367   1HD2  LEU  49          1HD2      LEU  49  -4.245   7.214  -1.356
  368   2HD2  LEU  49          2HD2      LEU  49  -3.306   5.740  -1.588
  369   3HD2  LEU  49          3HD2      LEU  49  -3.461   6.903  -2.905
  370    HA   PRO  50           HA       PRO  50  -1.341  13.009   0.990
  371   1HB   PRO  50          2HB       PRO  50   0.399  12.404   3.023
  372   2HB   PRO  50          1HB       PRO  50  -1.316  12.782   3.291
  373   1HG   PRO  50          2HG       PRO  50   0.030  10.121   3.138
  374   2HG   PRO  50          1HG       PRO  50  -1.210  10.692   4.269
  375   1HD   PRO  50          2HD       PRO  50  -1.814   9.115   2.172
  376   2HD   PRO  50          1HD       PRO  50  -2.929  10.372   2.757
  377    H    ASP  51           H        ASP  51   0.773  13.844   0.417
  378    HA   ASP  51           HA       ASP  51   2.220  12.402  -1.541
  379   1HB   ASP  51          2HB       ASP  51   2.243  14.830  -1.310
  380   2HB   ASP  51          1HB       ASP  51   2.997  14.704   0.279
  381    H    ASN  52           H        ASN  52   2.466  12.346   1.939
  382    HA   ASN  52           HA       ASN  52   5.138  11.091   1.935
  383   1HB   ASN  52          2HB       ASN  52   4.286  12.725   3.649
  384   2HB   ASN  52          1HB       ASN  52   3.123  11.504   4.166
  385   1HD2  ASN  52          1HD2      ASN  52   3.961  10.828   6.175
  386   2HD2  ASN  52          2HD2      ASN  52   5.543  10.258   6.402
  387    H    ALA  53           H        ALA  53   2.375   9.888   0.891
  388    HA   ALA  53           HA       ALA  53   1.784   7.589   2.477
  389   1HB   ALA  53          1HB       ALA  53   1.591   7.995  -0.526
  390   2HB   ALA  53          2HB       ALA  53   0.402   8.568   0.645
  391   3HB   ALA  53          3HB       ALA  53   0.663   6.838   0.428
  392    H    ARG  54           H        ARG  54   3.257   6.007   2.971
  393    HA   ARG  54           HA       ARG  54   5.673   5.546   1.438
  394   1HB   ARG  54          2HB       ARG  54   5.576   5.169   3.831
  395   2HB   ARG  54          1HB       ARG  54   4.241   4.031   3.639
  396   1HG   ARG  54          2HG       ARG  54   6.217   3.050   1.930
  397   2HG   ARG  54          1HG       ARG  54   7.106   3.570   3.362
  398   1HD   ARG  54          2HD       ARG  54   4.590   2.084   3.901
  399   2HD   ARG  54          1HD       ARG  54   5.912   1.138   3.189
  400    HE   ARG  54           HE       ARG  54   5.888   2.084   5.876
  401   1HH1  ARG  54          1HH1      ARG  54   7.844   0.106   4.632
  402   2HH1  ARG  54          2HH1      ARG  54   9.344   0.947   4.833
  403   1HH2  ARG  54          1HH2      ARG  54   7.846   4.008   5.471
  404   2HH2  ARG  54          2HH2      ARG  54   9.345   3.156   5.307
  405    H    ILE  55           H        ILE  55   5.994   4.126  -0.222
  406    HA   ILE  55           HA       ILE  55   4.015   1.956  -0.698
  407    HB   ILE  55           HB       ILE  55   4.176   2.739  -3.184
  408   1HG1  ILE  55          2HG1      ILE  55   4.583   5.136  -3.458
  409   2HG1  ILE  55          1HG1      ILE  55   4.888   5.306  -1.729
  410   1HG2  ILE  55          1HG2      ILE  55   2.078   3.492  -2.826
  411   2HG2  ILE  55          2HG2      ILE  55   2.651   4.820  -1.818
  412   3HG2  ILE  55          3HG2      ILE  55   2.384   3.229  -1.110
  413   1HD1  ILE  55          1HD1      ILE  55   6.871   3.974  -1.855
  414   2HD1  ILE  55          2HD1      ILE  55   6.965   5.126  -3.187
  415   3HD1  ILE  55          3HD1      ILE  55   6.494   3.455  -3.496
  416    H    LYS  56           H        LYS  56   5.007   0.975  -3.048
  417    HA   LYS  56           HA       LYS  56   7.100  -0.693  -2.443
  418   1HB   LYS  56          2HB       LYS  56   7.529  -0.695  -4.915
  419   2HB   LYS  56          1HB       LYS  56   5.815  -0.782  -4.509
  420   1HG   LYS  56          2HG       LYS  56   5.437   1.097  -5.684
  421   2HG   LYS  56          1HG       LYS  56   6.552   1.976  -4.637
  422   1HD   LYS  56          2HD       LYS  56   8.270   0.539  -6.243
  423   2HD   LYS  56          1HD       LYS  56   6.963   0.942  -7.357
  424   1HE   LYS  56          2HE       LYS  56   7.526   3.263  -5.761
  425   2HE   LYS  56          1HE       LYS  56   9.046   2.663  -6.452
  426   1HZ   LYS  56          1HZ       LYS  56   7.748   2.375  -8.582
  427   2HZ   LYS  56          2HZ       LYS  56   8.076   3.978  -8.127
  428   3HZ   LYS  56          3HZ       LYS  56   6.531   3.321  -7.874
  429    H    ARG  57           H        ARG  57   8.711   0.365  -1.128
  430    HA   ARG  57           HA       ARG  57  10.515   2.238  -2.634
  431   1HB   ARG  57          2HB       ARG  57   9.669   2.042   0.265
  432   2HB   ARG  57          1HB       ARG  57  11.102   2.951  -0.220
  433   1HG   ARG  57          2HG       ARG  57   9.882   4.623  -1.157
  434   2HG   ARG  57          1HG       ARG  57   8.681   3.509  -1.814
  435   1HD   ARG  57          2HD       ARG  57   7.661   4.916  -0.064
  436   2HD   ARG  57          1HD       ARG  57   7.738   3.232   0.491
  437    HE   ARG  57           HE       ARG  57   9.783   3.837   1.764
  438   1HH1  ARG  57          1HH2      ARG  57   9.846   6.485   0.009
  439   2HH1  ARG  57          2HH2      ARG  57   9.578   7.645   1.266
  440   1HH2  ARG  57          1HH1      ARG  57   8.573   5.278   3.595
  441   2HH2  ARG  57          2HH1      ARG  57   8.855   6.961   3.299
  442    H    SER  58           H        SER  58  10.356  -0.789  -2.259
  443    HA   SER  58           HA       SER  58  11.850  -2.403  -0.961
  444   1HB   SER  58          2HB       SER  58  13.418  -2.608  -3.169
  445   2HB   SER  58          1HB       SER  58  11.752  -3.177  -3.097
  446    HG   SER  58           HG       SER  58  12.621  -0.603  -3.940
  447    H    GLY  59           H        GLY  59  13.521  -2.301   0.441
  448   1HA   GLY  59          2HA       GLY  59  15.944  -0.751  -0.309
  449   2HA   GLY  59          1HA       GLY  59  15.182  -0.402   1.245
  450    H    ARG  60           H        ARG  60  15.638  -1.742   2.966
  451    HA   ARG  60           HA       ARG  60  17.076  -4.302   2.377
  452   1HB   ARG  60          2HB       ARG  60  17.763  -2.413   4.639
  453   2HB   ARG  60          1HB       ARG  60  18.744  -3.723   3.983
  454   1HG   ARG  60          2HG       ARG  60  17.955  -1.295   2.353
  455   2HG   ARG  60          1HG       ARG  60  19.449  -1.380   3.285
  456   1HD   ARG  60          2HD       ARG  60  19.314  -3.801   1.821
  457   2HD   ARG  60          1HD       ARG  60  18.907  -2.500   0.683
  458    HE   ARG  60           HE       ARG  60  21.073  -1.573   2.246
  459   1HH1  ARG  60          1HH1      ARG  60  20.275  -3.365  -0.530
  460   2HH1  ARG  60          2HH1      ARG  60  21.910  -3.780  -0.924
  461   1HH2  ARG  60          1HH2      ARG  60  23.238  -2.401   1.966
  462   2HH2  ARG  60          2HH2      ARG  60  23.587  -3.234   0.489
  463    H    CYS  61           H        CYS  61  14.351  -4.257   2.939
  464    HA   CYS  61           HA       CYS  61  12.705  -4.945   4.537
  465   1HB   CYS  61          2HB       CYS  61  15.081  -6.666   4.419
  466   2HB   CYS  61          1HB       CYS  61  14.189  -6.852   5.928
  467    H    ARG  62           H        ARG  62  12.565  -3.024   5.881
  468    HA   ARG  62           HA       ARG  62  14.449  -2.620   8.089
  469   1HB   ARG  62          2HB       ARG  62  12.255  -1.260   6.725
  470   2HB   ARG  62          1HB       ARG  62  12.166  -1.057   8.474
  471   1HG   ARG  62          2HG       ARG  62  14.818  -0.657   8.106
  472   2HG   ARG  62          1HG       ARG  62  14.206  -0.064   6.561
  473   1HD   ARG  62          2HD       ARG  62  12.617   0.854   8.864
  474   2HD   ARG  62          1HD       ARG  62  14.293   1.438   8.872
  475    HE   ARG  62           HE       ARG  62  13.833   2.657   6.889
  476   1HH1  ARG  62          1HH2      ARG  62  10.991   1.441   8.136
  477   2HH1  ARG  62          2HH2      ARG  62  10.102   1.481   6.650
  478   1HH2  ARG  62          1HH1      ARG  62  12.872   2.232   4.704
  479   2HH2  ARG  62          2HH1      ARG  62  11.167   1.930   4.706
  480    H    ALA  63           H        ALA  63  13.361  -5.195   8.342
  481    HA   ALA  63           HA       ALA  63  12.281  -5.129  11.014
  482   1HB   ALA  63          1HB       ALA  63  10.177  -4.542  10.334
  483   2HB   ALA  63          2HB       ALA  63  10.049  -6.249   9.909
  484   3HB   ALA  63          3HB       ALA  63  10.467  -5.062   8.673
  Start of MODEL   15
    1   1H    LYS   1          1HT       LYS   1  -2.921  14.842  -1.522
    2   2H    LYS   1          2HT       LYS   1  -1.555  13.924  -1.942
    3   3H    LYS   1          3HT       LYS   1  -2.896  13.175  -1.217
    4    HA   LYS   1           HA       LYS   1  -4.104  13.119  -3.133
    5   1HB   LYS   1          2HB       LYS   1  -3.817  14.952  -4.816
    6   2HB   LYS   1          1HB       LYS   1  -4.180  15.564  -3.201
    7   1HG   LYS   1          2HG       LYS   1  -1.707  15.850  -2.831
    8   2HG   LYS   1          1HG       LYS   1  -1.459  15.429  -4.526
    9   1HD   LYS   1          2HD       LYS   1  -3.104  17.757  -3.491
   10   2HD   LYS   1          1HD       LYS   1  -1.527  17.868  -4.272
   11   1HE   LYS   1          2HE       LYS   1  -2.817  16.468  -6.176
   12   2HE   LYS   1          1HE       LYS   1  -4.200  17.340  -5.484
   13   1HZ   LYS   1          1HZ       LYS   1  -3.009  19.401  -5.692
   14   2HZ   LYS   1          2HZ       LYS   1  -3.031  18.637  -7.208
   15   3HZ   LYS   1          3HZ       LYS   1  -1.623  18.603  -6.257
   16    H    ILE   2           H        ILE   2  -2.140  11.367  -2.830
   17    HA   ILE   2           HA       ILE   2  -0.593  11.438  -5.401
   18    HB   ILE   2           HB       ILE   2   0.681  11.780  -3.223
   19   1HG1  ILE   2          2HG1      ILE   2   1.311   9.307  -4.867
   20   2HG1  ILE   2          1HG1      ILE   2   1.782  10.958  -5.267
   21   1HG2  ILE   2          1HG2      ILE   2  -0.091   8.870  -2.837
   22   2HG2  ILE   2          2HG2      ILE   2  -0.669  10.217  -1.857
   23   3HG2  ILE   2          3HG2      ILE   2   1.038   9.776  -1.831
   24   1HD1  ILE   2          1HD1      ILE   2   3.549   9.502  -4.091
   25   2HD1  ILE   2          2HD1      ILE   2   2.559   9.682  -2.644
   26   3HD1  ILE   2          3HD1      ILE   2   3.260  11.105  -3.415
   27    H    ASP   3           H        ASP   3  -0.096   9.230  -6.232
   28    HA   ASP   3           HA       ASP   3  -2.028   7.134  -5.308
   29   1HB   ASP   3          2HB       ASP   3  -1.487   8.132  -8.125
   30   2HB   ASP   3          1HB       ASP   3  -2.484   6.728  -7.743
   31    H    GLY   4           H        GLY   4  -1.087   5.093  -5.235
   32   1HA   GLY   4          2HA       GLY   4   1.006   4.204  -6.969
   33   2HA   GLY   4          1HA       GLY   4   1.727   4.775  -5.464
   34    H    TYR   5           H        TYR   5   2.389   2.513  -5.141
   35    HA   TYR   5           HA       TYR   5   0.139   0.788  -4.155
   36   1HB   TYR   5          2HB       TYR   5   2.859  -0.098  -5.154
   37   2HB   TYR   5          1HB       TYR   5   1.422  -1.092  -4.932
   38    HD1  TYR   5           1HD      TYR   5   2.679   1.863  -6.866
   39    HD2  TYR   5           2HD      TYR   5  -0.044  -1.458  -6.731
   40    HE1  TYR   5           1HE      TYR   5   1.993   2.329  -9.202
   41    HE2  TYR   5           2HE      TYR   5  -0.732  -0.988  -9.066
   42    HH   TYR   5           HH       TYR   5   0.002   0.123 -11.006
   43    HA   PRO   6           HA       PRO   6   2.452   1.617  -0.383
   44   1HB   PRO   6          2HB       PRO   6   0.542   0.605   1.300
   45   2HB   PRO   6          1HB       PRO   6   0.453   2.234   0.601
   46   1HG   PRO   6          2HG       PRO   6  -0.945  -0.259  -0.227
   47   2HG   PRO   6          1HG       PRO   6  -1.543   1.406  -0.177
   48   1HD   PRO   6          2HD       PRO   6  -0.754   0.160  -2.470
   49   2HD   PRO   6          1HD       PRO   6  -0.673   1.918  -2.230
   50    H    VAL   7           H        VAL   7   3.730   0.239   0.895
   51    HA   VAL   7           HA       VAL   7   3.634  -2.662   0.200
   52    HB   VAL   7           HB       VAL   7   5.941  -2.559   1.280
   53   1HG1  VAL   7          1HG1      VAL   7   5.179  -0.846  -1.087
   54   2HG1  VAL   7          2HG1      VAL   7   5.895  -2.456  -1.088
   55   3HG1  VAL   7          3HG1      VAL   7   6.862  -1.062  -0.608
   56   1HG2  VAL   7          1HG2      VAL   7   4.989  -0.212   2.350
   57   2HG2  VAL   7          2HG2      VAL   7   5.976   0.378   1.013
   58   3HG2  VAL   7          3HG2      VAL   7   6.694  -0.648   2.254
   59    H    ASP   8           H        ASP   8   4.839  -3.792   2.367
   60    HA   ASP   8           HA       ASP   8   2.702  -3.937   4.323
   61   1HB   ASP   8          2HB       ASP   8   4.315  -5.539   5.381
   62   2HB   ASP   8          1HB       ASP   8   4.077  -5.851   3.661
   63    H    TYR   9           H        TYR   9   5.204  -4.211   6.339
   64    HA   TYR   9           HA       TYR   9   5.089  -1.333   7.166
   65   1HB   TYR   9          2HB       TYR   9   4.461  -3.804   8.458
   66   2HB   TYR   9          1HB       TYR   9   5.860  -3.109   9.276
   67    HD1  TYR   9           1HD      TYR   9   2.310  -2.998   8.939
   68    HD2  TYR   9           2HD      TYR   9   5.733  -0.570   9.860
   69    HE1  TYR   9           1HE      TYR   9   0.838  -1.349  10.066
   70    HE2  TYR   9           2HE      TYR   9   4.260   1.078  10.986
   71    HH   TYR   9           HH       TYR   9   1.091   0.417  11.859
   72    H    TRP  10           H        TRP  10   7.173  -4.172   6.744
   73    HA   TRP  10           HA       TRP  10   9.559  -2.449   7.325
   74   1HB   TRP  10          2HB       TRP  10   9.412  -5.471   7.221
   75   2HB   TRP  10          1HB       TRP  10  10.645  -4.475   7.993
   76    HD1  TRP  10           HD       TRP  10  10.095  -3.414  10.340
   77    HE1  TRP  10           1HE      TRP  10   8.243  -3.867  12.073
   78    HE3  TRP  10           3HE      TRP  10   6.878  -6.167   7.486
   79    HZ2  TRP  10           2HZ      TRP  10   5.728  -5.222  12.228
   80    HZ3  TRP  10           3HZ      TRP  10   4.763  -7.025   8.452
   81    HH2  TRP  10           HH       TRP  10   4.184  -6.558  10.816
   82    H    ASN  11           H        ASN  11   7.842  -3.171   4.739
   83    HA   ASN  11           HA       ASN  11   8.320  -3.316   2.433
   84   1HB   ASN  11          2HB       ASN  11  10.856  -2.422   3.750
   85   2HB   ASN  11          1HB       ASN  11  10.940  -2.917   2.062
   86   1HD2  ASN  11          1HD2      ASN  11  11.159  -0.824   1.119
   87   2HD2  ASN  11          2HD2      ASN  11   9.963   0.373   1.238
   88    H    CYS  12           H        CYS  12   9.148  -5.591   4.625
   89    HA   CYS  12           HA       CYS  12  10.953  -7.280   3.091
   90   1HB   CYS  12          2HB       CYS  12   9.255  -7.486   5.564
   91   2HB   CYS  12          1HB       CYS  12  10.026  -8.929   4.908
   92    H    LYS  13           H        LYS  13   7.619  -7.934   4.166
   93    HA   LYS  13           HA       LYS  13   7.089 -10.020   2.319
   94   1HB   LYS  13          2HB       LYS  13   5.691  -8.310   4.229
   95   2HB   LYS  13          1HB       LYS  13   4.662  -8.756   2.867
   96   1HG   LYS  13          2HG       LYS  13   4.315 -10.621   4.168
   97   2HG   LYS  13          1HG       LYS  13   5.779 -11.153   3.340
   98   1HD   LYS  13          2HD       LYS  13   7.166 -10.517   5.188
   99   2HD   LYS  13          1HD       LYS  13   5.841  -9.650   5.966
  100   1HE   LYS  13          2HE       LYS  13   5.645 -12.616   5.396
  101   2HE   LYS  13          1HE       LYS  13   6.373 -12.002   6.893
  102   1HZ   LYS  13          1HZ       LYS  13   3.733 -11.097   5.889
  103   2HZ   LYS  13          2HZ       LYS  13   4.414 -10.813   7.419
  104   3HZ   LYS  13          3HZ       LYS  13   3.904 -12.377   6.989
  105    H    ARG  14           H        ARG  14   5.262  -9.791   0.601
  106    HA   ARG  14           HA       ARG  14   6.105  -8.291  -1.608
  107   1HB   ARG  14          2HB       ARG  14   4.057 -10.052  -0.917
  108   2HB   ARG  14          1HB       ARG  14   3.200  -8.597  -1.424
  109   1HG   ARG  14          2HG       ARG  14   4.523  -8.564  -3.521
  110   2HG   ARG  14          1HG       ARG  14   5.328 -10.052  -3.022
  111   1HD   ARG  14          2HD       ARG  14   3.368 -10.411  -4.596
  112   2HD   ARG  14          1HD       ARG  14   3.210 -11.266  -3.049
  113    HE   ARG  14           HE       ARG  14   2.040  -8.538  -3.301
  114   1HH1  ARG  14          1HH2      ARG  14   0.559 -10.936  -4.590
  115   2HH1  ARG  14          2HH2      ARG  14  -0.569 -11.313  -3.332
  116   1HH2  ARG  14          1HH1      ARG  14   1.088  -9.449  -0.923
  117   2HH2  ARG  14          2HH1      ARG  14  -0.270 -10.471  -1.255
  118    H    ILE  15           H        ILE  15   4.429  -6.577  -2.635
  119    HA   ILE  15           HA       ILE  15   4.350  -4.309  -0.714
  120    HB   ILE  15           HB       ILE  15   3.963  -4.502  -3.721
  121   1HG1  ILE  15          2HG1      ILE  15   6.377  -3.195  -2.744
  122   2HG1  ILE  15          1HG1      ILE  15   6.280  -4.869  -2.196
  123   1HG2  ILE  15          1HG2      ILE  15   4.902  -1.966  -2.652
  124   2HG2  ILE  15          2HG2      ILE  15   3.339  -2.406  -1.964
  125   3HG2  ILE  15          3HG2      ILE  15   3.531  -2.285  -3.713
  126   1HD1  ILE  15          1HD1      ILE  15   5.756  -5.520  -4.585
  127   2HD1  ILE  15          2HD1      ILE  15   7.383  -4.889  -4.336
  128   3HD1  ILE  15          3HD1      ILE  15   6.139  -3.862  -5.048
  129    H    CYS  16           H        CYS  16   2.351  -6.600  -0.801
  130    HA   CYS  16           HA       CYS  16  -0.088  -4.913  -0.757
  131   1HB   CYS  16          2HB       CYS  16  -0.057  -5.635  -3.039
  132   2HB   CYS  16          1HB       CYS  16   0.432  -7.268  -2.588
  133    H    TRP  17           H        TRP  17  -1.879  -6.046   0.353
  134    HA   TRP  17           HA       TRP  17  -0.891  -7.878   2.440
  135   1HB   TRP  17          2HB       TRP  17  -2.796  -5.854   2.206
  136   2HB   TRP  17          1HB       TRP  17  -3.760  -7.326   2.334
  137    HD1  TRP  17           HD       TRP  17  -2.219  -9.066   4.288
  138    HE1  TRP  17           1HE      TRP  17  -1.842  -8.372   6.742
  139    HE3  TRP  17           3HE      TRP  17  -2.872  -4.018   3.889
  140    HZ2  TRP  17           2HZ      TRP  17  -1.818  -5.990   8.327
  141    HZ3  TRP  17           3HZ      TRP  17  -2.663  -2.562   5.881
  142    HH2  TRP  17           HH       TRP  17  -2.139  -3.541   8.099
  143    H    TYR  18           H        TYR  18  -3.459  -9.242   2.767
  144    HA   TYR  18           HA       TYR  18  -3.333 -11.117   0.426
  145   1HB   TYR  18          2HB       TYR  18  -2.755 -11.493   3.151
  146   2HB   TYR  18          1HB       TYR  18  -4.332 -12.246   2.911
  147    HD1  TYR  18           1HD      TYR  18  -4.314 -13.322   0.265
  148    HD2  TYR  18           2HD      TYR  18  -1.078 -13.112   3.081
  149    HE1  TYR  18           1HE      TYR  18  -3.224 -15.255  -0.844
  150    HE2  TYR  18           2HE      TYR  18   0.013 -15.043   1.973
  151    HH   TYR  18           HH       TYR  18  -1.088 -16.279  -1.066
  152    H    ASN  19           H        ASN  19  -5.133  -8.918   0.407
  153    HA   ASN  19           HA       ASN  19  -7.653 -10.253  -0.002
  154   1HB   ASN  19          2HB       ASN  19  -6.964  -9.495   2.672
  155   2HB   ASN  19          1HB       ASN  19  -8.290  -8.462   2.137
  156   1HD2  ASN  19          1HD2      ASN  19 -10.174  -9.727   1.037
  157   2HD2  ASN  19          2HD2      ASN  19 -10.567 -11.239   1.702
  158    H    ASN  20           H        ASN  20  -9.318  -8.719  -0.730
  159    HA   ASN  20           HA       ASN  20  -8.162  -6.341  -2.006
  160   1HB   ASN  20          2HB       ASN  20  -9.722  -7.831  -3.170
  161   2HB   ASN  20          1HB       ASN  20 -10.942  -7.557  -1.927
  162   1HD2  ASN  20          1HD2      ASN  20 -12.428  -6.594  -3.509
  163   2HD2  ASN  20          2HD2      ASN  20 -12.150  -5.042  -4.137
  164    H    LYS  21           H        LYS  21  -9.552  -6.990   1.007
  165    HA   LYS  21           HA       LYS  21 -10.585  -4.192   1.289
  166   1HB   LYS  21          2HB       LYS  21 -12.065  -6.215   1.700
  167   2HB   LYS  21          1HB       LYS  21 -11.024  -6.607   3.068
  168   1HG   LYS  21          2HG       LYS  21 -12.882  -5.345   3.935
  169   2HG   LYS  21          1HG       LYS  21 -11.476  -4.281   3.958
  170   1HD   LYS  21          2HD       LYS  21 -12.231  -3.018   2.146
  171   2HD   LYS  21          1HD       LYS  21 -13.265  -4.315   1.545
  172   1HE   LYS  21          2HE       LYS  21 -14.616  -4.001   3.734
  173   2HE   LYS  21          1HE       LYS  21 -13.762  -2.451   3.870
  174   1HZ   LYS  21          1HZ       LYS  21 -15.088  -3.320   1.368
  175   2HZ   LYS  21          2HZ       LYS  21 -14.538  -1.765   1.776
  176   3HZ   LYS  21          3HZ       LYS  21 -15.902  -2.418   2.551
  177    H    TYR  22           H        TYR  22  -8.345  -6.587   2.589
  178    HA   TYR  22           HA       TYR  22  -7.558  -5.370   5.006
  179   1HB   TYR  22          2HB       TYR  22  -6.484  -7.239   2.992
  180   2HB   TYR  22          1HB       TYR  22  -5.247  -6.436   3.958
  181    HD1  TYR  22           1HD      TYR  22  -4.837  -7.085   6.194
  182    HD2  TYR  22           2HD      TYR  22  -8.415  -8.394   4.210
  183    HE1  TYR  22           1HE      TYR  22  -5.339  -8.595   8.095
  184    HE2  TYR  22           2HE      TYR  22  -8.918  -9.904   6.113
  185    HH   TYR  22           HH       TYR  22  -8.027 -10.878   7.967
  186    H    CYS  23           H        CYS  23  -6.712  -4.536   1.675
  187    HA   CYS  23           HA       CYS  23  -4.697  -2.557   2.561
  188   1HB   CYS  23          2HB       CYS  23  -5.098  -4.197   0.344
  189   2HB   CYS  23          1HB       CYS  23  -5.480  -2.582  -0.256
  190    H    ASN  24           H        ASN  24  -7.985  -2.651   1.245
  191    HA   ASN  24           HA       ASN  24  -8.194   0.182   0.679
  192   1HB   ASN  24          2HB       ASN  24  -9.595  -2.005   0.036
  193   2HB   ASN  24          1HB       ASN  24 -10.546  -1.504   1.434
  194   1HD2  ASN  24          1HD2      ASN  24 -12.350  -0.916  -0.032
  195   2HD2  ASN  24          2HD2      ASN  24 -12.279   0.513  -0.945
  196    H    ASP  25           H        ASP  25  -9.187  -1.847   3.460
  197    HA   ASP  25           HA       ASP  25 -10.462   0.136   5.020
  198   1HB   ASP  25          2HB       ASP  25 -10.121  -2.449   5.283
  199   2HB   ASP  25          1HB       ASP  25  -8.680  -1.991   6.192
  200    H    LEU  26           H        LEU  26  -7.002  -0.788   4.955
  201    HA   LEU  26           HA       LEU  26  -6.253   1.264   6.894
  202   1HB   LEU  26          2HB       LEU  26  -5.085  -0.970   5.414
  203   2HB   LEU  26          1HB       LEU  26  -3.983   0.405   5.521
  204    HG   LEU  26           HG       LEU  26  -5.418  -0.221   8.024
  205   1HD1  LEU  26          1HD1      LEU  26  -4.418  -2.398   6.595
  206   2HD1  LEU  26          2HD1      LEU  26  -4.743  -2.355   8.328
  207   3HD1  LEU  26          3HD1      LEU  26  -3.125  -1.998   7.725
  208   1HD2  LEU  26          1HD2      LEU  26  -3.646   0.910   8.842
  209   2HD2  LEU  26          2HD2      LEU  26  -3.139   1.182   7.175
  210   3HD2  LEU  26          3HD2      LEU  26  -2.512  -0.202   8.074
  211    H    CYS  27           H        CYS  27  -6.041   0.911   3.346
  212    HA   CYS  27           HA       CYS  27  -4.533   3.246   2.777
  213   1HB   CYS  27          2HB       CYS  27  -6.539   1.513   1.400
  214   2HB   CYS  27          1HB       CYS  27  -6.175   3.069   0.656
  215    H    LYS  28           H        LYS  28  -8.003   2.800   3.374
  216    HA   LYS  28           HA       LYS  28  -8.851   5.453   2.711
  217   1HB   LYS  28          2HB       LYS  28  -9.960   3.053   3.568
  218   2HB   LYS  28          1HB       LYS  28 -10.250   4.133   4.934
  219   1HG   LYS  28          2HG       LYS  28 -11.881   5.198   3.808
  220   2HG   LYS  28          1HG       LYS  28 -10.787   5.522   2.462
  221   1HD   LYS  28          2HD       LYS  28 -11.701   3.880   1.215
  222   2HD   LYS  28          1HD       LYS  28 -11.579   2.721   2.540
  223   1HE   LYS  28          2HE       LYS  28 -13.620   4.207   3.488
  224   2HE   LYS  28          1HE       LYS  28 -13.879   4.443   1.749
  225   1HZ   LYS  28          1HZ       LYS  28 -14.965   2.439   2.255
  226   2HZ   LYS  28          2HZ       LYS  28 -13.694   1.891   3.241
  227   3HZ   LYS  28          3HZ       LYS  28 -13.496   1.962   1.554
  228    H    GLY  29           H        GLY  29  -7.298   4.086   5.552
  229   1HA   GLY  29          2HA       GLY  29  -7.881   6.191   7.402
  230   2HA   GLY  29          1HA       GLY  29  -6.467   5.132   7.490
  231    H    LEU  30           H        LEU  30  -5.485   5.785   4.856
  232    HA   LEU  30           HA       LEU  30  -4.173   8.362   5.485
  233   1HB   LEU  30          2HB       LEU  30  -3.821   6.304   3.275
  234   2HB   LEU  30          1HB       LEU  30  -2.747   7.675   3.558
  235    HG   LEU  30           HG       LEU  30  -3.174   6.196   6.013
  236   1HD1  LEU  30          1HD1      LEU  30  -2.318   4.071   5.453
  237   2HD1  LEU  30          2HD1      LEU  30  -1.752   4.617   3.874
  238   3HD1  LEU  30          3HD1      LEU  30  -3.477   4.397   4.164
  239   1HD2  LEU  30          1HD2      LEU  30  -1.055   7.458   4.450
  240   2HD2  LEU  30          2HD2      LEU  30  -0.515   5.950   5.188
  241   3HD2  LEU  30          3HD2      LEU  30  -1.175   7.238   6.196
  242    H    LYS  31           H        LYS  31  -7.070   7.882   4.421
  243    HA   LYS  31           HA       LYS  31  -8.533   9.231   3.151
  244   1HB   LYS  31          2HB       LYS  31  -6.615  10.896   3.786
  245   2HB   LYS  31          1HB       LYS  31  -6.122  10.696   2.104
  246   1HG   LYS  31          2HG       LYS  31  -7.697  12.184   1.500
  247   2HG   LYS  31          1HG       LYS  31  -8.935  11.071   2.088
  248   1HD   LYS  31          2HD       LYS  31  -9.091  12.123   4.159
  249   2HD   LYS  31          1HD       LYS  31  -7.458  12.784   4.059
  250   1HE   LYS  31          2HE       LYS  31  -9.353  13.715   1.962
  251   2HE   LYS  31          1HE       LYS  31  -9.654  14.301   3.610
  252   1HZ   LYS  31          1HZ       LYS  31  -7.058  14.557   3.582
  253   2HZ   LYS  31          2HZ       LYS  31  -8.059  15.780   2.957
  254   3HZ   LYS  31          3HZ       LYS  31  -7.296  14.681   1.908
  255    H    ALA  32           H        ALA  32  -6.623   6.912   2.018
  256    HA   ALA  32           HA       ALA  32  -6.662   7.570  -0.851
  257   1HB   ALA  32          1HB       ALA  32  -5.371   5.615  -1.040
  258   2HB   ALA  32          2HB       ALA  32  -6.136   4.866   0.358
  259   3HB   ALA  32          3HB       ALA  32  -4.970   6.166   0.587
  260    H    ASP  33           H        ASP  33  -9.065   7.851  -0.941
  261    HA   ASP  33           HA       ASP  33 -11.113   6.169  -0.263
  262   1HB   ASP  33          2HB       ASP  33 -10.511   8.094  -2.326
  263   2HB   ASP  33          1HB       ASP  33 -11.537   6.819  -2.985
  264    H    SER  34           H        SER  34 -10.042   5.835  -3.619
  265    HA   SER  34           HA       SER  34 -10.815   3.057  -3.751
  266   1HB   SER  34          2HB       SER  34  -9.188   4.913  -5.505
  267   2HB   SER  34          1HB       SER  34  -9.619   3.276  -5.990
  268    HG   SER  34           HG       SER  34 -11.086   5.486  -6.121
  269    H    GLY  35           H        GLY  35  -9.578   1.978  -2.061
  270   1HA   GLY  35          2HA       GLY  35  -6.673   1.698  -2.722
  271   2HA   GLY  35          1HA       GLY  35  -7.270   1.684  -1.062
  272    H    TYR  36           H        TYR  36  -7.099  -0.151  -4.057
  273    HA   TYR  36           HA       TYR  36  -8.098  -2.553  -2.556
  274   1HB   TYR  36          2HB       TYR  36  -8.975  -3.321  -4.665
  275   2HB   TYR  36          1HB       TYR  36  -9.448  -1.630  -4.508
  276    HD1  TYR  36           1HD      TYR  36  -8.080   0.150  -5.672
  277    HD2  TYR  36           2HD      TYR  36  -7.554  -4.045  -6.435
  278    HE1  TYR  36           1HE      TYR  36  -6.903   0.683  -7.788
  279    HE2  TYR  36           2HE      TYR  36  -6.375  -3.511  -8.552
  280    HH   TYR  36           HH       TYR  36  -6.559  -0.755 -10.111
  281    H    CYS  37           H        CYS  37  -6.934  -4.551  -2.959
  282    HA   CYS  37           HA       CYS  37  -4.123  -4.089  -3.868
  283   1HB   CYS  37          2HB       CYS  37  -5.263  -5.180  -1.563
  284   2HB   CYS  37          1HB       CYS  37  -4.709  -6.585  -2.474
  285    H    TRP  38           H        TRP  38  -3.356  -5.208  -5.623
  286    HA   TRP  38           HA       TRP  38  -5.218  -6.862  -7.187
  287   1HB   TRP  38          2HB       TRP  38  -3.422  -5.082  -7.906
  288   2HB   TRP  38          1HB       TRP  38  -2.293  -6.429  -7.758
  289    HD1  TRP  38           HD       TRP  38  -1.932  -7.614  -9.959
  290    HE1  TRP  38           1HE      TRP  38  -3.362  -8.151 -12.037
  291    HE3  TRP  38           3HE      TRP  38  -6.352  -5.458  -8.573
  292    HZ2  TRP  38           2HZ      TRP  38  -6.025  -7.723 -12.985
  293    HZ3  TRP  38           3HZ      TRP  38  -8.316  -5.538 -10.081
  294    HH2  TRP  38           HH       TRP  38  -8.158  -6.667 -12.284
  295    H    GLY  39           H        GLY  39  -5.319  -9.068  -6.971
  296   1HA   GLY  39          2HA       GLY  39  -3.267 -10.440  -5.354
  297   2HA   GLY  39          1HA       GLY  39  -4.785 -11.145  -5.913
  298    H    TRP  40           H        TRP  40  -1.791  -9.800  -7.335
  299    HA   TRP  40           HA       TRP  40  -1.425 -12.269  -8.912
  300   1HB   TRP  40          2HB       TRP  40  -2.919 -11.172 -10.379
  301   2HB   TRP  40          1HB       TRP  40  -2.247  -9.583 -10.017
  302    HD1  TRP  40           HD       TRP  40  -1.761  -9.132 -12.607
  303    HE1  TRP  40           1HE      TRP  40   0.121  -9.964 -14.160
  304    HE3  TRP  40           3HE      TRP  40   0.033 -13.012  -9.816
  305    HZ2  TRP  40           2HZ      TRP  40   2.124 -12.007 -14.211
  306    HZ3  TRP  40           3HZ      TRP  40   1.927 -14.383 -10.638
  307    HH2  TRP  40           HH       TRP  40   2.973 -13.886 -12.830
  308    H    THR  41           H        THR  41  -0.291  -8.996  -9.626
  309    HA   THR  41           HA       THR  41   2.275  -9.370  -8.265
  310    HB   THR  41           HB       THR  41   2.178 -10.779 -10.459
  311    HG1  THR  41           1HG      THR  41   4.289  -8.931 -10.413
  312   1HG2  THR  41          1HG2      THR  41   3.056  -8.330 -11.881
  313   2HG2  THR  41          2HG2      THR  41   1.324  -8.460 -11.577
  314   3HG2  THR  41          3HG2      THR  41   2.158  -9.723 -12.484
  315    H    LEU  42           H        LEU  42   0.109  -7.355  -8.394
  316    HA   LEU  42           HA       LEU  42   1.640  -5.047  -9.559
  317   1HB   LEU  42          2HB       LEU  42  -1.185  -5.918  -9.570
  318   2HB   LEU  42          1HB       LEU  42  -0.949  -4.197  -9.261
  319    HG   LEU  42           HG       LEU  42   0.679  -5.362 -11.456
  320   1HD1  LEU  42          1HD1      LEU  42  -2.328  -5.193 -11.492
  321   2HD1  LEU  42          2HD1      LEU  42  -1.284  -6.470 -12.117
  322   3HD1  LEU  42          3HD1      LEU  42  -1.404  -4.931 -12.971
  323   1HD2  LEU  42          1HD2      LEU  42  -0.030  -3.179 -12.505
  324   2HD2  LEU  42          2HD2      LEU  42   0.815  -2.990 -10.969
  325   3HD2  LEU  42          3HD2      LEU  42  -0.939  -2.830 -11.035
  326    H    SER  43           H        SER  43   1.058  -6.499  -6.677
  327    HA   SER  43           HA       SER  43   1.168  -5.732  -4.445
  328   1HB   SER  43          2HB       SER  43   1.944  -3.131  -5.792
  329   2HB   SER  43          1HB       SER  43   2.378  -3.658  -4.170
  330    HG   SER  43           HG       SER  43   3.299  -5.558  -5.435
  331    H    CYS  44           H        CYS  44   0.435  -3.462  -3.191
  332    HA   CYS  44           HA       CYS  44  -2.451  -3.372  -3.547
  333   1HB   CYS  44          2HB       CYS  44  -1.095  -3.238  -1.400
  334   2HB   CYS  44          1HB       CYS  44  -0.649  -1.600  -1.876
  335    H    TYR  45           H        TYR  45  -3.669  -1.398  -4.061
  336    HA   TYR  45           HA       TYR  45  -2.097   0.733  -5.449
  337   1HB   TYR  45          2HB       TYR  45  -3.031  -1.219  -6.907
  338   2HB   TYR  45          1HB       TYR  45  -4.598  -0.457  -6.638
  339    HD1  TYR  45           1HD      TYR  45  -2.940   2.364  -6.397
  340    HD2  TYR  45           2HD      TYR  45  -3.449  -0.701  -9.367
  341    HE1  TYR  45           1HE      TYR  45  -2.446   4.011  -8.184
  342    HE2  TYR  45           2HE      TYR  45  -2.954   0.949 -11.151
  343    HH   TYR  45           HH       TYR  45  -3.227   3.748 -11.190
  344    H    CYS  46           H        CYS  46  -2.667   2.337  -3.929
  345    HA   CYS  46           HA       CYS  46  -5.604   2.891  -3.667
  346   1HB   CYS  46          2HB       CYS  46  -3.337   3.481  -1.730
  347   2HB   CYS  46          1HB       CYS  46  -5.044   3.816  -1.453
  348    H    GLN  47           H        GLN  47  -6.244   4.989  -4.169
  349    HA   GLN  47           HA       GLN  47  -4.072   6.928  -4.898
  350   1HB   GLN  47          2HB       GLN  47  -6.762   6.531  -6.246
  351   2HB   GLN  47          1HB       GLN  47  -5.424   7.528  -6.821
  352   1HG   GLN  47          2HG       GLN  47  -4.014   5.478  -6.994
  353   2HG   GLN  47          1HG       GLN  47  -5.411   4.510  -6.522
  354   1HE2  GLN  47          1HE2      GLN  47  -5.719   3.423  -8.546
  355   2HE2  GLN  47          2HE2      GLN  47  -6.144   4.240  -9.972
  356    H    GLY  48           H        GLY  48  -4.376   9.017  -4.127
  357   1HA   GLY  48          2HA       GLY  48  -5.814  10.870  -3.425
  358   2HA   GLY  48          1HA       GLY  48  -7.014   9.685  -2.904
  359    H    LEU  49           H        LEU  49  -3.577   9.393  -2.247
  360    HA   LEU  49           HA       LEU  49  -4.196   9.660   0.675
  361   1HB   LEU  49          2HB       LEU  49  -1.816   8.374   0.615
  362   2HB   LEU  49          1HB       LEU  49  -3.350   7.521   0.484
  363    HG   LEU  49           HG       LEU  49  -1.932   8.544  -1.975
  364   1HD1  LEU  49          1HD1      LEU  49  -0.219   7.160  -1.337
  365   2HD1  LEU  49          2HD1      LEU  49  -1.298   5.914  -1.964
  366   3HD1  LEU  49          3HD1      LEU  49  -1.239   6.238  -0.232
  367   1HD2  LEU  49          1HD2      LEU  49  -3.400   5.998  -2.006
  368   2HD2  LEU  49          2HD2      LEU  49  -3.547   7.389  -3.080
  369   3HD2  LEU  49          3HD2      LEU  49  -4.402   7.371  -1.538
  370    HA   PRO  50           HA       PRO  50  -1.392  13.023   1.085
  371   1HB   PRO  50          2HB       PRO  50   0.293  12.314   3.129
  372   2HB   PRO  50          1HB       PRO  50  -1.402  12.780   3.385
  373   1HG   PRO  50          2HG       PRO  50  -0.194  10.054   3.227
  374   2HG   PRO  50          1HG       PRO  50  -1.414  10.681   4.349
  375   1HD   PRO  50          2HD       PRO  50  -2.077   9.150   2.240
  376   2HD   PRO  50          1HD       PRO  50  -3.128  10.457   2.823
  377    H    ASP  51           H        ASP  51   0.883  13.723   0.755
  378    HA   ASP  51           HA       ASP  51   2.242  12.223  -1.274
  379   1HB   ASP  51          2HB       ASP  51   2.313  14.685  -0.933
  380   2HB   ASP  51          1HB       ASP  51   3.226  14.437   0.556
  381    H    ASN  52           H        ASN  52   2.352  12.078   2.189
  382    HA   ASN  52           HA       ASN  52   4.978  10.700   2.223
  383   1HB   ASN  52          2HB       ASN  52   4.052  12.454   3.897
  384   2HB   ASN  52          1HB       ASN  52   3.072  11.128   4.526
  385   1HD2  ASN  52          1HD2      ASN  52   4.111  10.457   6.421
  386   2HD2  ASN  52          2HD2      ASN  52   5.769  10.112   6.541
  387    H    ALA  53           H        ALA  53   2.182   9.669   1.149
  388    HA   ALA  53           HA       ALA  53   1.365   7.469   2.775
  389   1HB   ALA  53          1HB       ALA  53   0.047   6.943   0.918
  390   2HB   ALA  53          2HB       ALA  53   1.300   7.421  -0.227
  391   3HB   ALA  53          3HB       ALA  53   0.379   8.652   0.637
  392    H    ARG  54           H        ARG  54   2.110   5.329   2.872
  393    HA   ARG  54           HA       ARG  54   4.840   4.757   2.168
  394   1HB   ARG  54          2HB       ARG  54   2.560   3.539   3.498
  395   2HB   ARG  54          1HB       ARG  54   3.430   2.346   2.533
  396   1HG   ARG  54          2HG       ARG  54   5.419   3.890   3.797
  397   2HG   ARG  54          1HG       ARG  54   4.207   3.567   5.038
  398   1HD   ARG  54          2HD       ARG  54   5.700   1.538   3.344
  399   2HD   ARG  54          1HD       ARG  54   5.702   1.691   5.112
  400    HE   ARG  54           HE       ARG  54   3.639   0.387   3.542
  401   1HH1  ARG  54          1HH2      ARG  54   4.680   1.284   6.620
  402   2HH1  ARG  54          2HH2      ARG  54   3.119   1.183   7.363
  403   1HH2  ARG  54          1HH1      ARG  54   1.433   0.686   4.373
  404   2HH2  ARG  54          2HH1      ARG  54   1.281   0.845   6.091
  405    H    ILE  55           H        ILE  55   5.672   3.711   0.330
  406    HA   ILE  55           HA       ILE  55   3.704   2.665  -1.666
  407    HB   ILE  55           HB       ILE  55   6.063   4.368  -2.467
  408   1HG1  ILE  55          2HG1      ILE  55   4.588   5.602  -0.791
  409   2HG1  ILE  55          1HG1      ILE  55   4.717   6.357  -2.378
  410   1HG2  ILE  55          1HG2      ILE  55   5.198   3.514  -4.407
  411   2HG2  ILE  55          2HG2      ILE  55   4.073   4.861  -4.225
  412   3HG2  ILE  55          3HG2      ILE  55   3.605   3.244  -3.700
  413   1HD1  ILE  55          1HD1      ILE  55   2.510   4.389  -1.896
  414   2HD1  ILE  55          2HD1      ILE  55   2.555   5.774  -2.988
  415   3HD1  ILE  55          3HD1      ILE  55   2.347   6.025  -1.255
  416    H    LYS  56           H        LYS  56   5.170   1.730  -3.603
  417    HA   LYS  56           HA       LYS  56   6.527  -0.563  -2.627
  418   1HB   LYS  56          2HB       LYS  56   7.329  -0.621  -5.063
  419   2HB   LYS  56          1HB       LYS  56   5.584  -0.524  -4.820
  420   1HG   LYS  56          2HG       LYS  56   5.453   1.587  -5.670
  421   2HG   LYS  56          1HG       LYS  56   6.979   2.082  -4.938
  422   1HD   LYS  56          2HD       LYS  56   8.091   1.703  -6.858
  423   2HD   LYS  56          1HD       LYS  56   7.445   0.065  -6.959
  424   1HE   LYS  56          2HE       LYS  56   5.631   0.715  -8.277
  425   2HE   LYS  56          1HE       LYS  56   5.663   2.383  -7.672
  426   1HZ   LYS  56          1HZ       LYS  56   6.615   2.145  -9.935
  427   2HZ   LYS  56          2HZ       LYS  56   7.832   1.153  -9.288
  428   3HZ   LYS  56          3HZ       LYS  56   7.713   2.779  -8.808
  429    H    ARG  57           H        ARG  57   8.016   0.554  -1.018
  430    HA   ARG  57           HA       ARG  57  10.453   1.707  -2.322
  431   1HB   ARG  57          2HB       ARG  57   8.955   2.085   0.193
  432   2HB   ARG  57          1HB       ARG  57  10.710   2.057   0.389
  433   1HG   ARG  57          2HG       ARG  57  10.959   4.049  -0.634
  434   2HG   ARG  57          1HG       ARG  57   9.862   3.600  -1.940
  435   1HD   ARG  57          2HD       ARG  57   8.555   5.236  -0.960
  436   2HD   ARG  57          1HD       ARG  57   8.069   3.879   0.075
  437    HE   ARG  57           HE       ARG  57  10.111   5.932   0.795
  438   1HH1  ARG  57          1HH1      ARG  57   7.350   4.485   1.877
  439   2HH1  ARG  57          2HH1      ARG  57   7.962   4.010   3.426
  440   1HH2  ARG  57          1HH2      ARG  57  11.258   4.771   2.654
  441   2HH2  ARG  57          2HH2      ARG  57  10.174   4.173   3.866
  442    H    SER  58           H        SER  58   9.479  -1.196  -1.815
  443    HA   SER  58           HA       SER  58  10.848  -2.679   0.036
  444   1HB   SER  58          2HB       SER  58  11.193  -3.629  -2.742
  445   2HB   SER  58          1HB       SER  58  10.361  -4.393  -1.392
  446    HG   SER  58           HG       SER  58   9.424  -2.656  -3.336
  447    H    GLY  59           H        GLY  59  12.978  -3.125   0.531
  448   1HA   GLY  59          2HA       GLY  59  15.201  -3.356  -1.044
  449   2HA   GLY  59          1HA       GLY  59  15.063  -1.607  -0.857
  450    H    ARG  60           H        ARG  60  13.965  -1.732   1.841
  451    HA   ARG  60           HA       ARG  60  16.448  -2.570   3.302
  452   1HB   ARG  60          2HB       ARG  60  14.406  -0.458   4.053
  453   2HB   ARG  60          1HB       ARG  60  16.017  -0.679   4.739
  454   1HG   ARG  60          2HG       ARG  60  15.343   0.185   1.913
  455   2HG   ARG  60          1HG       ARG  60  16.131   1.151   3.160
  456   1HD   ARG  60          2HD       ARG  60  18.005  -0.554   3.183
  457   2HD   ARG  60          1HD       ARG  60  17.254  -1.294   1.756
  458    HE   ARG  60           HE       ARG  60  17.643   0.781   0.531
  459   1HH1  ARG  60          1HH2      ARG  60  20.079   0.012   2.512
  460   2HH1  ARG  60          2HH2      ARG  60  20.642   1.619   2.831
  461   1HH2  ARG  60          1HH1      ARG  60  17.850   3.153   1.464
  462   2HH2  ARG  60          2HH1      ARG  60  19.381   3.397   2.238
  463    H    CYS  61           H        CYS  61  15.098  -4.733   3.266
  464    HA   CYS  61           HA       CYS  61  12.727  -5.280   4.580
  465   1HB   CYS  61          2HB       CYS  61  14.990  -6.646   3.731
  466   2HB   CYS  61          1HB       CYS  61  14.965  -6.978   5.463
  467    H    ARG  62           H        ARG  62  12.184  -3.968   6.366
  468    HA   ARG  62           HA       ARG  62  14.076  -3.543   8.576
  469   1HB   ARG  62          2HB       ARG  62  11.569  -2.492   7.547
  470   2HB   ARG  62          1HB       ARG  62  11.473  -2.749   9.290
  471   1HG   ARG  62          2HG       ARG  62  12.522  -0.746   9.459
  472   2HG   ARG  62          1HG       ARG  62  13.977  -1.634   9.004
  473   1HD   ARG  62          2HD       ARG  62  14.044  -0.076   7.307
  474   2HD   ARG  62          1HD       ARG  62  12.885  -1.181   6.542
  475    HE   ARG  62           HE       ARG  62  12.241   1.422   7.665
  476   1HH1  ARG  62          1HH1      ARG  62  10.832  -0.068   5.398
  477   2HH1  ARG  62          2HH1      ARG  62   9.293  -0.391   6.123
  478   1HH2  ARG  62          1HH2      ARG  62  10.374   0.265   9.352
  479   2HH2  ARG  62          2HH2      ARG  62   9.033  -0.202   8.359
  480    H    ALA  63           H        ALA  63  13.630  -6.309   8.222
  481    HA   ALA  63           HA       ALA  63  12.688  -7.073  10.862
  482   1HB   ALA  63          1HB       ALA  63  10.552  -6.617   9.724
  483   2HB   ALA  63          2HB       ALA  63  10.714  -8.344  10.042
  484   3HB   ALA  63          3HB       ALA  63  11.003  -7.716   8.419
  Start of MODEL   16
    1   1H    LYS   1          1HT       LYS   1  -1.503  14.604  -2.188
    2   2H    LYS   1          2HT       LYS   1  -2.884  14.929  -1.255
    3   3H    LYS   1          3HT       LYS   1  -2.593  15.807  -2.679
    4    HA   LYS   1           HA       LYS   1  -3.748  13.159  -2.338
    5   1HB   LYS   1          2HB       LYS   1  -5.027  15.096  -3.067
    6   2HB   LYS   1          1HB       LYS   1  -3.851  15.443  -4.336
    7   1HG   LYS   1          2HG       LYS   1  -4.753  13.910  -5.735
    8   2HG   LYS   1          1HG       LYS   1  -4.870  12.699  -4.458
    9   1HD   LYS   1          2HD       LYS   1  -7.104  13.372  -5.337
   10   2HD   LYS   1          1HD       LYS   1  -6.922  13.726  -3.619
   11   1HE   LYS   1          2HE       LYS   1  -6.016  16.063  -4.612
   12   2HE   LYS   1          1HE       LYS   1  -7.129  15.609  -5.919
   13   1HZ   LYS   1          1HZ       LYS   1  -8.780  15.073  -4.142
   14   2HZ   LYS   1          2HZ       LYS   1  -8.409  16.726  -4.276
   15   3HZ   LYS   1          3HZ       LYS   1  -7.738  15.801  -3.019
   16    H    ILE   2           H        ILE   2  -2.555  11.417  -3.006
   17    HA   ILE   2           HA       ILE   2  -1.098  11.626  -5.604
   18    HB   ILE   2           HB       ILE   2   0.456  11.993  -3.699
   19   1HG1  ILE   2          2HG1      ILE   2   0.712   9.354  -5.169
   20   2HG1  ILE   2          1HG1      ILE   2   1.365  10.915  -5.667
   21   1HG2  ILE   2          1HG2      ILE   2  -0.634   9.302  -2.845
   22   2HG2  ILE   2          2HG2      ILE   2  -0.631  10.806  -1.927
   23   3HG2  ILE   2          3HG2      ILE   2   0.884   9.955  -2.228
   24   1HD1  ILE   2          1HD1      ILE   2   2.182   9.304  -3.235
   25   2HD1  ILE   2          2HD1      ILE   2   2.746  10.940  -3.574
   26   3HD1  ILE   2          3HD1      ILE   2   3.158   9.619  -4.668
   27    H    ASP   3           H        ASP   3  -0.788   9.524  -6.614
   28    HA   ASP   3           HA       ASP   3  -2.588   7.377  -5.537
   29   1HB   ASP   3          2HB       ASP   3  -3.350   8.799  -7.545
   30   2HB   ASP   3          1HB       ASP   3  -2.059   8.009  -8.450
   31    H    GLY   4           H        GLY   4  -1.510   5.451  -5.247
   32   1HA   GLY   4          2HA       GLY   4   0.449   4.440  -7.091
   33   2HA   GLY   4          1HA       GLY   4   1.260   5.119  -5.680
   34    H    TYR   5           H        TYR   5   1.966   2.876  -5.260
   35    HA   TYR   5           HA       TYR   5  -0.183   1.277  -3.901
   36   1HB   TYR   5          2HB       TYR   5   2.285   0.143  -5.229
   37   2HB   TYR   5          1HB       TYR   5   0.790  -0.692  -4.811
   38    HD1  TYR   5           1HD      TYR   5  -1.013  -0.809  -6.342
   39    HD2  TYR   5           2HD      TYR   5   2.220   1.931  -7.047
   40    HE1  TYR   5           1HE      TYR   5  -1.908  -0.335  -8.605
   41    HE2  TYR   5           2HE      TYR   5   1.323   2.406  -9.310
   42    HH   TYR   5           HH       TYR   5  -0.597   0.601 -10.939
   43    HA   PRO   6           HA       PRO   6   2.912   2.222  -0.695
   44   1HB   PRO   6          2HB       PRO   6   1.185   1.824   1.396
   45   2HB   PRO   6          1HB       PRO   6   1.288   3.355   0.506
   46   1HG   PRO   6          2HG       PRO   6  -0.681   1.137   0.233
   47   2HG   PRO   6          1HG       PRO   6  -0.943   2.888   0.192
   48   1HD   PRO   6          2HD       PRO   6  -0.856   1.374  -2.047
   49   2HD   PRO   6          1HD       PRO   6  -0.324   3.066  -2.014
   50    H    VAL   7           H        VAL   7   4.278   0.616  -0.087
   51    HA   VAL   7           HA       VAL   7   3.461  -2.189  -0.145
   52    HB   VAL   7           HB       VAL   7   5.902  -2.455   0.513
   53   1HG1  VAL   7          1HG1      VAL   7   5.328  -0.573  -1.799
   54   2HG1  VAL   7          2HG1      VAL   7   5.121  -2.324  -1.850
   55   3HG1  VAL   7          3HG1      VAL   7   6.730  -1.632  -1.642
   56   1HG2  VAL   7          1HG2      VAL   7   7.084  -0.680   1.277
   57   2HG2  VAL   7          2HG2      VAL   7   5.554   0.189   1.390
   58   3HG2  VAL   7          3HG2      VAL   7   6.543   0.332  -0.063
   59    H    ASP   8           H        ASP   8   4.293  -3.572   1.819
   60    HA   ASP   8           HA       ASP   8   2.713  -3.123   4.091
   61   1HB   ASP   8          2HB       ASP   8   5.325  -4.580   3.631
   62   2HB   ASP   8          1HB       ASP   8   4.448  -4.692   5.156
   63    H    TYR   9           H        TYR   9   3.560  -2.648   6.359
   64    HA   TYR   9           HA       TYR   9   4.762  -0.041   6.478
   65   1HB   TYR   9          2HB       TYR   9   3.561  -2.035   8.198
   66   2HB   TYR   9          1HB       TYR   9   4.984  -1.344   8.977
   67    HD1  TYR   9           1HD      TYR   9   1.638  -0.640   7.608
   68    HD2  TYR   9           2HD      TYR   9   5.093   1.030   9.536
   69    HE1  TYR   9           1HE      TYR   9   0.351   1.413   8.136
   70    HE2  TYR   9           2HE      TYR   9   3.807   3.083  10.063
   71    HH   TYR   9           HH       TYR   9   0.394   3.417   9.078
   72    H    TRP  10           H        TRP  10   6.167  -3.098   6.018
   73    HA   TRP  10           HA       TRP  10   8.855  -2.006   6.748
   74   1HB   TRP  10          2HB       TRP  10   8.070  -4.865   7.306
   75   2HB   TRP  10          1HB       TRP  10   9.369  -3.922   8.031
   76    HD1  TRP  10           HD       TRP  10   8.717  -2.164   9.927
   77    HE1  TRP  10           1HE      TRP  10   6.648  -1.984  11.456
   78    HE3  TRP  10           3HE      TRP  10   5.514  -5.258   7.437
   79    HZ2  TRP  10           2HZ      TRP  10   3.985  -3.021  11.603
   80    HZ3  TRP  10           3HZ      TRP  10   3.218  -5.645   8.290
   81    HH2  TRP  10           HH       TRP  10   2.450  -4.531  10.368
   82    H    ASN  11           H        ASN  11   7.021  -2.977   4.286
   83    HA   ASN  11           HA       ASN  11   7.476  -3.932   2.166
   84   1HB   ASN  11          2HB       ASN  11  10.307  -3.455   3.164
   85   2HB   ASN  11          1HB       ASN  11   9.824  -3.646   1.476
   86   1HD2  ASN  11          1HD2      ASN  11   9.889  -1.609   0.514
   87   2HD2  ASN  11          2HD2      ASN  11   9.282  -0.184   1.209
   88    H    CYS  12           H        CYS  12   7.614  -5.564   4.828
   89    HA   CYS  12           HA       CYS  12   9.435  -7.768   4.207
   90   1HB   CYS  12          2HB       CYS  12   8.535  -6.761   6.469
   91   2HB   CYS  12          1HB       CYS  12   7.182  -7.856   6.190
   92    H    LYS  13           H        LYS  13   5.928  -7.198   4.036
   93    HA   LYS  13           HA       LYS  13   5.479  -9.930   2.976
   94   1HB   LYS  13          2HB       LYS  13   3.978  -7.781   4.275
   95   2HB   LYS  13          1HB       LYS  13   3.098  -8.484   2.918
   96   1HG   LYS  13          2HG       LYS  13   2.659 -10.352   4.094
   97   2HG   LYS  13          1HG       LYS  13   4.368 -10.567   4.473
   98   1HD   LYS  13          2HD       LYS  13   4.219  -9.184   6.408
   99   2HD   LYS  13          1HD       LYS  13   2.637  -8.565   5.933
  100   1HE   LYS  13          2HE       LYS  13   2.440 -10.280   7.730
  101   2HE   LYS  13          1HE       LYS  13   1.669 -10.835   6.231
  102   1HZ   LYS  13          1HZ       LYS  13   3.394 -12.238   5.741
  103   2HZ   LYS  13          2HZ       LYS  13   3.411 -12.339   7.437
  104   3HZ   LYS  13          3HZ       LYS  13   4.530 -11.348   6.631
  105    H    ARG  14           H        ARG  14   7.052  -8.629   1.158
  106    HA   ARG  14           HA       ARG  14   7.122  -8.088  -1.145
  107   1HB   ARG  14          2HB       ARG  14   5.048  -9.845  -0.699
  108   2HB   ARG  14          1HB       ARG  14   4.229  -8.514  -1.517
  109   1HG   ARG  14          2HG       ARG  14   5.085  -9.179  -3.486
  110   2HG   ARG  14          1HG       ARG  14   6.719  -8.995  -2.848
  111   1HD   ARG  14          2HD       ARG  14   5.156 -11.433  -2.058
  112   2HD   ARG  14          1HD       ARG  14   5.891 -11.375  -3.673
  113    HE   ARG  14           HE       ARG  14   7.977 -10.543  -2.186
  114   1HH1  ARG  14          1HH1      ARG  14   6.355 -13.456  -2.568
  115   2HH1  ARG  14          2HH1      ARG  14   7.139 -14.269  -1.255
  116   1HH2  ARG  14          1HH2      ARG  14   8.712 -11.412  -0.076
  117   2HH2  ARG  14          2HH2      ARG  14   8.473 -13.113   0.156
  118    H    ILE  15           H        ILE  15   4.649  -6.999  -2.506
  119    HA   ILE  15           HA       ILE  15   4.817  -4.230  -1.372
  120    HB   ILE  15           HB       ILE  15   4.220  -3.572  -3.709
  121   1HG1  ILE  15          2HG1      ILE  15   4.485  -6.547  -4.264
  122   2HG1  ILE  15          1HG1      ILE  15   2.968  -5.648  -4.282
  123   1HG2  ILE  15          1HG2      ILE  15   6.521  -3.522  -3.419
  124   2HG2  ILE  15          2HG2      ILE  15   6.389  -4.704  -4.721
  125   3HG2  ILE  15          3HG2      ILE  15   6.619  -5.247  -3.059
  126   1HD1  ILE  15          1HD1      ILE  15   5.188  -5.660  -6.252
  127   2HD1  ILE  15          2HD1      ILE  15   4.449  -4.092  -5.931
  128   3HD1  ILE  15          3HD1      ILE  15   3.457  -5.432  -6.507
  129    H    CYS  16           H        CYS  16   2.799  -6.819  -1.256
  130    HA   CYS  16           HA       CYS  16   0.439  -5.080  -0.788
  131   1HB   CYS  16          2HB       CYS  16   0.781  -6.138  -3.242
  132   2HB   CYS  16          1HB       CYS  16   0.000  -7.508  -2.462
  133    H    TRP  17           H        TRP  17  -1.469  -6.867  -0.221
  134    HA   TRP  17           HA       TRP  17  -0.204  -8.758   1.737
  135   1HB   TRP  17          2HB       TRP  17  -1.764  -6.566   2.218
  136   2HB   TRP  17          1HB       TRP  17  -2.988  -7.833   2.136
  137    HD1  TRP  17           HD       TRP  17   0.600  -7.990   3.570
  138    HE1  TRP  17           1HE      TRP  17   0.454  -8.824   6.004
  139    HE3  TRP  17           3HE      TRP  17  -4.468  -8.296   4.089
  140    HZ2  TRP  17           2HZ      TRP  17  -1.550  -9.532   7.919
  141    HZ3  TRP  17           3HZ      TRP  17  -5.470  -9.056   6.227
  142    HH2  TRP  17           HH       TRP  17  -4.018  -9.672   8.141
  143    H    TYR  18           H        TYR  18  -2.287 -10.336   2.409
  144    HA   TYR  18           HA       TYR  18  -2.844 -11.801  -0.101
  145   1HB   TYR  18          2HB       TYR  18  -2.422 -12.358   2.697
  146   2HB   TYR  18          1HB       TYR  18  -3.944 -13.081   2.176
  147    HD1  TYR  18           1HD      TYR  18  -0.531 -12.554   0.691
  148    HD2  TYR  18           2HD      TYR  18  -3.768 -15.278   1.437
  149    HE1  TYR  18           1HE      TYR  18   0.716 -14.353  -0.473
  150    HE2  TYR  18           2HE      TYR  18  -2.520 -17.078   0.273
  151    HH   TYR  18           HH       TYR  18   0.709 -16.957  -0.367
  152    H    ASN  19           H        ASN  19  -4.589 -10.156   2.506
  153    HA   ASN  19           HA       ASN  19  -7.231 -10.888   1.493
  154   1HB   ASN  19          2HB       ASN  19  -6.126  -8.981   3.562
  155   2HB   ASN  19          1HB       ASN  19  -7.856  -9.109   3.242
  156   1HD2  ASN  19          1HD2      ASN  19  -8.302 -11.800   2.937
  157   2HD2  ASN  19          2HD2      ASN  19  -7.821 -12.659   4.320
  158    H    ASN  20           H        ASN  20  -8.676  -9.487   0.377
  159    HA   ASN  20           HA       ASN  20  -7.372  -7.400  -1.260
  160   1HB   ASN  20          2HB       ASN  20  -9.637  -9.214  -1.376
  161   2HB   ASN  20          1HB       ASN  20 -10.130  -7.575  -1.804
  162   1HD2  ASN  20          1HD2      ASN  20  -9.687 -10.031  -3.569
  163   2HD2  ASN  20          2HD2      ASN  20  -8.587  -9.511  -4.752
  164    H    LYS  21           H        LYS  21  -9.299  -7.614   1.595
  165    HA   LYS  21           HA       LYS  21 -10.307  -4.830   1.349
  166   1HB   LYS  21          2HB       LYS  21 -11.619  -5.448   3.302
  167   2HB   LYS  21          1HB       LYS  21 -11.695  -6.781   2.147
  168   1HG   LYS  21          2HG       LYS  21 -11.137  -8.002   4.013
  169   2HG   LYS  21          1HG       LYS  21  -9.508  -7.541   3.517
  170   1HD   LYS  21          2HD       LYS  21  -9.236  -6.480   5.480
  171   2HD   LYS  21          1HD       LYS  21 -10.546  -5.383   5.044
  172   1HE   LYS  21          2HE       LYS  21 -11.123  -8.122   6.194
  173   2HE   LYS  21          1HE       LYS  21 -10.847  -6.712   7.237
  174   1HZ   LYS  21          1HZ       LYS  21 -12.644  -5.587   6.349
  175   2HZ   LYS  21          2HZ       LYS  21 -13.229  -7.181   6.399
  176   3HZ   LYS  21          3HZ       LYS  21 -12.677  -6.522   4.934
  177    H    TYR  22           H        TYR  22  -7.635  -6.538   2.694
  178    HA   TYR  22           HA       TYR  22  -7.140  -4.825   4.983
  179   1HB   TYR  22          2HB       TYR  22  -6.274  -7.231   4.170
  180   2HB   TYR  22          1HB       TYR  22  -4.947  -6.255   3.542
  181    HD1  TYR  22           1HD      TYR  22  -7.012  -6.667   6.647
  182    HD2  TYR  22           2HD      TYR  22  -3.174  -5.712   4.967
  183    HE1  TYR  22           1HE      TYR  22  -6.053  -6.508   8.928
  184    HE2  TYR  22           2HE      TYR  22  -2.216  -5.554   7.250
  185    HH   TYR  22           HH       TYR  22  -3.604  -5.020   9.793
  186    H    CYS  23           H        CYS  23  -5.996  -4.877   1.608
  187    HA   CYS  23           HA       CYS  23  -4.090  -2.750   1.822
  188   1HB   CYS  23          2HB       CYS  23  -3.992  -4.121  -0.089
  189   2HB   CYS  23          1HB       CYS  23  -5.733  -4.055  -0.341
  190    H    ASN  24           H        ASN  24  -7.596  -2.782   1.289
  191    HA   ASN  24           HA       ASN  24  -7.757   0.081   0.724
  192   1HB   ASN  24          2HB       ASN  24  -9.851  -0.535   0.076
  193   2HB   ASN  24          1HB       ASN  24  -9.314  -2.188   0.354
  194   1HD2  ASN  24          1HD2      ASN  24 -11.115   0.515   1.821
  195   2HD2  ASN  24          2HD2      ASN  24 -11.909  -0.427   2.988
  196    H    ASP  25           H        ASP  25  -8.731  -1.973   3.508
  197    HA   ASP  25           HA       ASP  25  -9.610   0.024   5.272
  198   1HB   ASP  25          2HB       ASP  25  -8.319  -2.662   5.475
  199   2HB   ASP  25          1HB       ASP  25  -8.445  -1.711   6.956
  200    H    LEU  26           H        LEU  26  -6.264  -1.208   4.895
  201    HA   LEU  26           HA       LEU  26  -5.119   0.680   6.768
  202   1HB   LEU  26          2HB       LEU  26  -4.320  -1.483   4.975
  203   2HB   LEU  26          1HB       LEU  26  -3.131  -0.181   5.003
  204    HG   LEU  26           HG       LEU  26  -4.277  -1.553   7.454
  205   1HD1  LEU  26          1HD1      LEU  26  -1.899  -2.032   5.745
  206   2HD1  LEU  26          2HD1      LEU  26  -2.788  -3.153   6.776
  207   3HD1  LEU  26          3HD1      LEU  26  -1.609  -2.049   7.484
  208   1HD2  LEU  26          1HD2      LEU  26  -3.705   0.639   8.116
  209   2HD2  LEU  26          2HD2      LEU  26  -2.325   0.707   7.019
  210   3HD2  LEU  26          3HD2      LEU  26  -2.248  -0.285   8.475
  211    H    CYS  27           H        CYS  27  -5.525   0.643   3.227
  212    HA   CYS  27           HA       CYS  27  -3.941   2.953   2.652
  213   1HB   CYS  27          2HB       CYS  27  -6.159   1.402   1.387
  214   2HB   CYS  27          1HB       CYS  27  -5.785   2.991   0.712
  215    H    LYS  28           H        LYS  28  -7.352   2.579   3.591
  216    HA   LYS  28           HA       LYS  28  -8.149   5.301   3.242
  217   1HB   LYS  28          2HB       LYS  28  -9.048   3.213   5.260
  218   2HB   LYS  28          1HB       LYS  28  -9.974   4.633   4.769
  219   1HG   LYS  28          2HG       LYS  28  -9.000   2.821   2.609
  220   2HG   LYS  28          1HG       LYS  28 -10.338   2.249   3.606
  221   1HD   LYS  28          2HD       LYS  28 -10.511   5.053   2.626
  222   2HD   LYS  28          1HD       LYS  28 -10.718   3.779   1.423
  223   1HE   LYS  28          2HE       LYS  28 -12.621   2.897   2.501
  224   2HE   LYS  28          1HE       LYS  28 -12.219   3.678   4.043
  225   1HZ   LYS  28          1HZ       LYS  28 -12.696   5.791   3.171
  226   2HZ   LYS  28          2HZ       LYS  28 -13.984   4.812   2.650
  227   3HZ   LYS  28          3HZ       LYS  28 -12.737   5.227   1.573
  228    H    GLY  29           H        GLY  29  -6.290   3.670   5.731
  229   1HA   GLY  29          2HA       GLY  29  -6.533   5.649   7.794
  230   2HA   GLY  29          1HA       GLY  29  -5.171   4.531   7.617
  231    H    LEU  30           H        LEU  30  -4.584   5.328   4.902
  232    HA   LEU  30           HA       LEU  30  -3.050   7.798   5.466
  233   1HB   LEU  30          2HB       LEU  30  -3.139   5.864   3.123
  234   2HB   LEU  30          1HB       LEU  30  -1.966   7.169   3.312
  235    HG   LEU  30           HG       LEU  30  -2.298   5.191   5.539
  236   1HD1  LEU  30          1HD1      LEU  30  -0.746   4.739   2.973
  237   2HD1  LEU  30          2HD1      LEU  30  -2.061   3.746   3.602
  238   3HD1  LEU  30          3HD1      LEU  30  -0.514   3.797   4.446
  239   1HD2  LEU  30          1HD2      LEU  30  -0.270   6.021   6.219
  240   2HD2  LEU  30          2HD2      LEU  30  -0.760   7.401   5.237
  241   3HD2  LEU  30          3HD2      LEU  30   0.329   6.186   4.569
  242    H    LYS  31           H        LYS  31  -6.082   7.583   4.926
  243    HA   LYS  31           HA       LYS  31  -7.650   9.061   3.956
  244   1HB   LYS  31          2HB       LYS  31  -5.523  10.565   4.254
  245   2HB   LYS  31          1HB       LYS  31  -5.365  10.379   2.507
  246   1HG   LYS  31          2HG       LYS  31  -6.944  11.947   2.192
  247   2HG   LYS  31          1HG       LYS  31  -8.102  10.962   3.089
  248   1HD   LYS  31          2HD       LYS  31  -7.732  12.085   5.077
  249   2HD   LYS  31          1HD       LYS  31  -6.077  12.519   4.644
  250   1HE   LYS  31          2HE       LYS  31  -8.087  13.696   2.843
  251   2HE   LYS  31          1HE       LYS  31  -8.219  14.254   4.523
  252   1HZ   LYS  31          1HZ       LYS  31  -5.525  13.973   3.466
  253   2HZ   LYS  31          2HZ       LYS  31  -6.171  15.168   4.487
  254   3HZ   LYS  31          3HZ       LYS  31  -6.440  15.243   2.811
  255    H    ALA  32           H        ALA  32  -5.956   6.728   2.413
  256    HA   ALA  32           HA       ALA  32  -6.656   7.437  -0.360
  257   1HB   ALA  32          1HB       ALA  32  -4.580   6.199   0.440
  258   2HB   ALA  32          2HB       ALA  32  -5.462   5.408  -0.865
  259   3HB   ALA  32          3HB       ALA  32  -5.632   4.829   0.791
  260    H    ASP  33           H        ASP  33  -8.900   7.363  -0.650
  261    HA   ASP  33           HA       ASP  33 -10.669   5.534   0.683
  262   1HB   ASP  33          2HB       ASP  33 -10.719   7.518  -1.520
  263   2HB   ASP  33          1HB       ASP  33 -12.003   6.308  -1.552
  264    H    SER  34           H        SER  34 -10.282   5.623  -2.839
  265    HA   SER  34           HA       SER  34 -10.998   2.866  -3.191
  266   1HB   SER  34          2HB       SER  34 -10.180   5.198  -4.751
  267   2HB   SER  34          1HB       SER  34  -9.573   3.695  -5.440
  268    HG   SER  34           HG       SER  34 -11.660   2.915  -5.505
  269    H    GLY  35           H        GLY  35  -9.581   1.545  -1.907
  270   1HA   GLY  35          2HA       GLY  35  -6.820   1.328  -3.025
  271   2HA   GLY  35          1HA       GLY  35  -7.075   1.303  -1.279
  272    H    TYR  36           H        TYR  36  -6.429  -0.721  -3.718
  273    HA   TYR  36           HA       TYR  36  -7.744  -3.010  -2.330
  274   1HB   TYR  36          2HB       TYR  36  -8.686  -3.821  -4.403
  275   2HB   TYR  36          1HB       TYR  36  -9.150  -2.126  -4.249
  276    HD1  TYR  36           1HD      TYR  36  -7.052  -4.537  -6.063
  277    HD2  TYR  36           2HD      TYR  36  -8.100  -0.395  -5.632
  278    HE1  TYR  36           1HE      TYR  36  -5.946  -4.033  -8.225
  279    HE2  TYR  36           2HE      TYR  36  -6.996   0.110  -7.794
  280    HH   TYR  36           HH       TYR  36  -6.291  -2.070 -10.050
  281    H    CYS  37           H        CYS  37  -6.600  -5.011  -2.647
  282    HA   CYS  37           HA       CYS  37  -3.783  -4.653  -3.527
  283   1HB   CYS  37          2HB       CYS  37  -4.368  -5.566  -1.287
  284   2HB   CYS  37          1HB       CYS  37  -5.199  -6.908  -2.074
  285    H    TRP  38           H        TRP  38  -3.008  -5.609  -5.383
  286    HA   TRP  38           HA       TRP  38  -4.896  -7.279  -6.973
  287   1HB   TRP  38          2HB       TRP  38  -3.351  -5.156  -7.615
  288   2HB   TRP  38          1HB       TRP  38  -2.217  -6.457  -7.979
  289    HD1  TRP  38           HD       TRP  38  -2.331  -6.772 -10.507
  290    HE1  TRP  38           1HE      TRP  38  -4.217  -7.146 -12.224
  291    HE3  TRP  38           3HE      TRP  38  -6.401  -6.129  -7.494
  292    HZ2  TRP  38           2HZ      TRP  38  -7.078  -7.169 -12.306
  293    HZ3  TRP  38           3HZ      TRP  38  -8.694  -6.333  -8.415
  294    HH2  TRP  38           HH       TRP  38  -9.038  -6.852 -10.815
  295    H    GLY  39           H        GLY  39  -4.456  -9.446  -7.407
  296   1HA   GLY  39          2HA       GLY  39  -2.254 -10.682  -5.879
  297   2HA   GLY  39          1HA       GLY  39  -3.550 -11.545  -6.708
  298    H    TRP  40           H        TRP  40  -2.245  -9.168  -8.714
  299    HA   TRP  40           HA       TRP  40  -0.756 -11.251 -10.238
  300   1HB   TRP  40          2HB       TRP  40  -2.514 -10.039 -11.405
  301   2HB   TRP  40          1HB       TRP  40  -1.831  -8.495 -10.904
  302    HD1  TRP  40           HD       TRP  40  -0.839  -7.437 -12.988
  303    HE1  TRP  40           1HE      TRP  40   0.727  -8.222 -14.873
  304    HE3  TRP  40           3HE      TRP  40  -0.412 -12.368 -11.776
  305    HZ2  TRP  40           2HZ      TRP  40   2.004 -10.629 -15.756
  306    HZ3  TRP  40           3HZ      TRP  40   0.984 -13.891 -13.151
  307    HH2  TRP  40           HH       TRP  40   2.191 -13.026 -15.139
  308    H    THR  41           H        THR  41  -0.270  -7.742 -10.093
  309    HA   THR  41           HA       THR  41   2.295  -7.900  -8.725
  310    HB   THR  41           HB       THR  41   2.663  -8.924 -11.031
  311    HG1  THR  41           1HG      THR  41   4.444  -7.265 -11.430
  312   1HG2  THR  41          1HG2      THR  41   1.079  -7.029 -11.988
  313   2HG2  THR  41          2HG2      THR  41   2.408  -7.663 -12.960
  314   3HG2  THR  41          3HG2      THR  41   2.593  -6.132 -12.105
  315    H    LEU  42           H        LEU  42  -0.231  -6.310  -8.751
  316    HA   LEU  42           HA       LEU  42   0.813  -3.614  -9.523
  317   1HB   LEU  42          2HB       LEU  42  -1.868  -4.922  -9.226
  318   2HB   LEU  42          1HB       LEU  42  -1.758  -3.172  -9.037
  319    HG   LEU  42           HG       LEU  42  -0.676  -2.993 -11.243
  320   1HD1  LEU  42          1HD1      LEU  42   0.479  -4.899 -11.776
  321   2HD1  LEU  42          2HD1      LEU  42  -1.039  -5.326 -12.566
  322   3HD1  LEU  42          3HD1      LEU  42  -0.677  -5.950 -10.957
  323   1HD2  LEU  42          1HD2      LEU  42  -2.788  -2.778 -11.998
  324   2HD2  LEU  42          2HD2      LEU  42  -3.372  -3.853 -10.727
  325   3HD2  LEU  42          3HD2      LEU  42  -2.843  -4.520 -12.272
  326    H    SER  43           H        SER  43   1.112  -5.424  -6.906
  327    HA   SER  43           HA       SER  43   1.162  -5.016  -4.577
  328   1HB   SER  43          2HB       SER  43   2.860  -3.486  -5.192
  329   2HB   SER  43          1HB       SER  43   1.712  -2.388  -5.949
  330    HG   SER  43           HG       SER  43   2.552  -2.525  -3.378
  331    H    CYS  44           H        CYS  44   0.267  -3.008  -2.980
  332    HA   CYS  44           HA       CYS  44  -2.657  -3.223  -3.204
  333   1HB   CYS  44          2HB       CYS  44  -1.758  -3.436  -1.021
  334   2HB   CYS  44          1HB       CYS  44  -0.637  -2.098  -1.259
  335    H    TYR  45           H        TYR  45  -3.275  -1.925  -4.999
  336    HA   TYR  45           HA       TYR  45  -2.185   0.748  -5.389
  337   1HB   TYR  45          2HB       TYR  45  -2.963  -0.877  -7.154
  338   2HB   TYR  45          1HB       TYR  45  -4.614  -0.584  -6.612
  339    HD1  TYR  45           1HD      TYR  45  -2.031   2.070  -6.609
  340    HD2  TYR  45           2HD      TYR  45  -5.365   0.365  -8.720
  341    HE1  TYR  45           1HE      TYR  45  -2.146   4.077  -8.048
  342    HE2  TYR  45           2HE      TYR  45  -5.479   2.381 -10.159
  343    HH   TYR  45           HH       TYR  45  -3.138   5.043  -9.780
  344    H    CYS  46           H        CYS  46  -2.976   2.627  -4.554
  345    HA   CYS  46           HA       CYS  46  -5.816   2.769  -3.676
  346   1HB   CYS  46          2HB       CYS  46  -3.399   3.434  -1.956
  347   2HB   CYS  46          1HB       CYS  46  -5.080   3.687  -1.492
  348    H    GLN  47           H        GLN  47  -6.630   4.920  -3.832
  349    HA   GLN  47           HA       GLN  47  -4.672   6.969  -4.829
  350   1HB   GLN  47          2HB       GLN  47  -7.545   6.834  -5.727
  351   2HB   GLN  47          1HB       GLN  47  -6.152   7.509  -6.571
  352   1HG   GLN  47          2HG       GLN  47  -5.250   5.125  -6.714
  353   2HG   GLN  47          1HG       GLN  47  -6.841   4.590  -6.177
  354   1HE2  GLN  47          1HE2      GLN  47  -8.482   6.462  -7.571
  355   2HE2  GLN  47          2HE2      GLN  47  -8.318   6.190  -9.238
  356    H    GLY  48           H        GLY  48  -4.961   9.054  -3.992
  357   1HA   GLY  48          2HA       GLY  48  -6.321  10.797  -2.968
  358   2HA   GLY  48          1HA       GLY  48  -7.360   9.541  -2.297
  359    H    LEU  49           H        LEU  49  -3.849   9.363  -2.179
  360    HA   LEU  49           HA       LEU  49  -4.055   9.597   0.804
  361   1HB   LEU  49          2HB       LEU  49  -1.633   8.449   0.388
  362   2HB   LEU  49          1HB       LEU  49  -3.118   7.516   0.511
  363    HG   LEU  49           HG       LEU  49  -2.205   8.568  -2.158
  364   1HD1  LEU  49          1HD1      LEU  49  -0.269   7.390  -1.703
  365   2HD1  LEU  49          2HD1      LEU  49  -1.284   6.070  -2.282
  366   3HD1  LEU  49          3HD1      LEU  49  -1.067   6.319  -0.551
  367   1HD2  LEU  49          1HD2      LEU  49  -3.696   7.004  -3.016
  368   2HD2  LEU  49          2HD2      LEU  49  -4.497   7.389  -1.493
  369   3HD2  LEU  49          3HD2      LEU  49  -3.521   5.927  -1.630
  370    HA   PRO  50           HA       PRO  50  -1.397  13.095   0.863
  371   1HB   PRO  50          2HB       PRO  50   0.533  12.485   2.707
  372   2HB   PRO  50          1HB       PRO  50  -1.144  12.862   3.150
  373   1HG   PRO  50          2HG       PRO  50   0.186  10.205   2.873
  374   2HG   PRO  50          1HG       PRO  50  -0.949  10.774   4.110
  375   1HD   PRO  50          2HD       PRO  50  -1.721   9.188   2.067
  376   2HD   PRO  50          1HD       PRO  50  -2.790  10.416   2.779
  377    H    ASP  51           H        ASP  51   0.738  13.912   0.202
  378    HA   ASP  51           HA       ASP  51   1.968  12.455  -1.919
  379   1HB   ASP  51          2HB       ASP  51   2.005  14.901  -1.664
  380   2HB   ASP  51          1HB       ASP  51   2.961  14.746  -0.189
  381    H    ASN  52           H        ASN  52   2.515  12.449   1.530
  382    HA   ASN  52           HA       ASN  52   5.152  11.134   1.304
  383   1HB   ASN  52          2HB       ASN  52   4.187  12.842   3.075
  384   2HB   ASN  52          1HB       ASN  52   3.521  11.386   3.815
  385   1HD2  ASN  52          1HD2      ASN  52   5.792   9.673   2.909
  386   2HD2  ASN  52          2HD2      ASN  52   7.113  10.099   3.887
  387    H    ALA  53           H        ALA  53   2.186  10.050   0.648
  388    HA   ALA  53           HA       ALA  53   1.708   7.785   2.295
  389   1HB   ALA  53          1HB       ALA  53   0.266   7.122   0.489
  390   2HB   ALA  53          2HB       ALA  53   1.234   8.008  -0.690
  391   3HB   ALA  53          3HB       ALA  53   0.268   8.885   0.495
  392    H    ARG  54           H        ARG  54   2.895   5.935   2.534
  393    HA   ARG  54           HA       ARG  54   5.369   5.392   1.303
  394   1HB   ARG  54          2HB       ARG  54   4.189   4.389   3.367
  395   2HB   ARG  54          1HB       ARG  54   3.409   3.288   2.230
  396   1HG   ARG  54          2HG       ARG  54   5.682   2.637   1.391
  397   2HG   ARG  54          1HG       ARG  54   6.388   3.622   2.673
  398   1HD   ARG  54          2HD       ARG  54   4.318   1.602   3.451
  399   2HD   ARG  54          1HD       ARG  54   5.952   1.027   3.065
  400    HE   ARG  54           HE       ARG  54   5.269   2.426   5.451
  401   1HH1  ARG  54          1HH1      ARG  54   7.852   1.025   5.171
  402   2HH1  ARG  54          2HH1      ARG  54   8.995   2.325   5.119
  403   1HH2  ARG  54          1HH2      ARG  54   6.613   4.740   4.400
  404   2HH2  ARG  54          2HH2      ARG  54   8.294   4.428   4.683
  405    H    ILE  55           H        ILE  55   5.965   4.010  -0.449
  406    HA   ILE  55           HA       ILE  55   3.799   2.918  -2.182
  407    HB   ILE  55           HB       ILE  55   6.021   4.593  -3.333
  408   1HG1  ILE  55          2HG1      ILE  55   4.726   5.937  -1.605
  409   2HG1  ILE  55          1HG1      ILE  55   4.652   6.573  -3.246
  410   1HG2  ILE  55          1HG2      ILE  55   3.877   4.966  -4.917
  411   2HG2  ILE  55          2HG2      ILE  55   3.451   3.398  -4.232
  412   3HG2  ILE  55          3HG2      ILE  55   4.968   3.594  -5.107
  413   1HD1  ILE  55          1HD1      ILE  55   2.554   4.599  -2.647
  414   2HD1  ILE  55          2HD1      ILE  55   2.427   6.174  -3.431
  415   3HD1  ILE  55          3HD1      ILE  55   2.456   6.066  -1.672
  416    H    LYS  56           H        LYS  56   4.941   1.713  -4.104
  417    HA   LYS  56           HA       LYS  56   6.520  -0.407  -3.237
  418   1HB   LYS  56          2HB       LYS  56   5.685   0.817  -5.710
  419   2HB   LYS  56          1HB       LYS  56   7.342   0.237  -5.874
  420   1HG   LYS  56          2HG       LYS  56   6.004  -1.797  -4.479
  421   2HG   LYS  56          1HG       LYS  56   4.875  -1.289  -5.733
  422   1HD   LYS  56          2HD       LYS  56   6.364  -3.068  -6.569
  423   2HD   LYS  56          1HD       LYS  56   6.640  -1.558  -7.438
  424   1HE   LYS  56          2HE       LYS  56   8.680  -1.142  -6.311
  425   2HE   LYS  56          1HE       LYS  56   8.291  -2.283  -5.008
  426   1HZ   LYS  56          1HZ       LYS  56   8.566  -3.082  -7.854
  427   2HZ   LYS  56          2HZ       LYS  56   8.437  -4.103  -6.502
  428   3HZ   LYS  56          3HZ       LYS  56   9.840  -3.176  -6.739
  429    H    ARG  57           H        ARG  57   8.215   0.257  -1.810
  430    HA   ARG  57           HA       ARG  57  10.417   1.853  -3.081
  431   1HB   ARG  57          2HB       ARG  57   9.418   2.967  -1.183
  432   2HB   ARG  57          1HB       ARG  57   9.506   1.496  -0.213
  433   1HG   ARG  57          2HG       ARG  57  11.349   2.924   0.436
  434   2HG   ARG  57          1HG       ARG  57  12.006   1.562  -0.472
  435   1HD   ARG  57          2HD       ARG  57  13.015   3.102  -1.805
  436   2HD   ARG  57          1HD       ARG  57  11.398   3.485  -2.429
  437    HE   ARG  57           HE       ARG  57  12.660   4.876  -0.097
  438   1HH1  ARG  57          1HH1      ARG  57  12.534   6.373  -2.634
  439   2HH1  ARG  57          2HH1      ARG  57  11.040   7.238  -2.501
  440   1HH2  ARG  57          1HH2      ARG  57   9.809   5.248   0.058
  441   2HH2  ARG  57          2HH2      ARG  57   9.497   6.601  -0.978
  442    H    SER  58           H        SER  58   9.521  -1.215  -1.822
  443    HA   SER  58           HA       SER  58  10.779  -3.162  -1.342
  444   1HB   SER  58          2HB       SER  58  11.313  -2.365  -3.782
  445   2HB   SER  58          1HB       SER  58  12.881  -1.925  -3.111
  446    HG   SER  58           HG       SER  58  13.336  -3.958  -3.350
  447    H    GLY  59           H        GLY  59  13.379  -3.715  -0.925
  448   1HA   GLY  59          2HA       GLY  59  15.365  -2.411   0.122
  449   2HA   GLY  59          1HA       GLY  59  14.146  -1.828   1.258
  450    H    ARG  60           H        ARG  60  14.474  -2.878   3.164
  451    HA   ARG  60           HA       ARG  60  14.836  -5.855   3.064
  452   1HB   ARG  60          2HB       ARG  60  16.203  -5.430   5.179
  453   2HB   ARG  60          1HB       ARG  60  16.917  -4.829   3.682
  454   1HG   ARG  60          2HG       ARG  60  15.102  -2.952   5.093
  455   2HG   ARG  60          1HG       ARG  60  16.630  -3.299   5.903
  456   1HD   ARG  60          2HD       ARG  60  16.945  -2.827   3.014
  457   2HD   ARG  60          1HD       ARG  60  16.318  -1.422   3.900
  458    HE   ARG  60           HE       ARG  60  18.340  -2.370   5.536
  459   1HH1  ARG  60          1HH1      ARG  60  18.505   0.254   4.049
  460   2HH1  ARG  60          2HH1      ARG  60  19.949   0.038   3.117
  461   1HH2  ARG  60          1HH2      ARG  60  20.033  -3.401   3.550
  462   2HH2  ARG  60          2HH2      ARG  60  20.814  -2.030   2.836
  463    H    CYS  61           H        CYS  61  13.478  -7.010   4.427
  464    HA   CYS  61           HA       CYS  61  11.054  -6.091   5.392
  465   1HB   CYS  61          2HB       CYS  61  11.692  -8.435   5.324
  466   2HB   CYS  61          1HB       CYS  61  12.955  -8.171   6.525
  467    H    ARG  62           H        ARG  62  10.722  -4.334   6.715
  468    HA   ARG  62           HA       ARG  62  12.712  -3.567   8.753
  469   1HB   ARG  62          2HB       ARG  62  10.772  -2.326   7.127
  470   2HB   ARG  62          1HB       ARG  62  10.196  -2.125   8.782
  471   1HG   ARG  62          2HG       ARG  62  13.042  -1.670   8.692
  472   2HG   ARG  62          1HG       ARG  62  12.238  -0.652   7.496
  473   1HD   ARG  62          2HD       ARG  62  10.938  -0.819  10.174
  474   2HD   ARG  62          1HD       ARG  62  12.453   0.100  10.074
  475    HE   ARG  62           HE       ARG  62  11.321   1.701   8.757
  476   1HH1  ARG  62          1HH1      ARG  62  10.476  -0.242   6.621
  477   2HH1  ARG  62          2HH1      ARG  62   8.749  -0.127   6.697
  478   1HH2  ARG  62          1HH2      ARG  62   8.720   1.398   9.808
  479   2HH2  ARG  62          2HH2      ARG  62   7.756   0.800   8.499
  480    H    ALA  63           H        ALA  63  11.296  -6.126   9.154
  481    HA   ALA  63           HA       ALA  63  10.423  -5.699  11.912
  482   1HB   ALA  63          1HB       ALA  63   8.337  -6.916  10.148
  483   2HB   ALA  63          2HB       ALA  63   8.533  -5.164  10.092
  484   3HB   ALA  63          3HB       ALA  63   8.140  -5.960  11.616
  Start of MODEL   17
    1   1H    LYS   1          1HT       LYS   1  -3.033  13.326  -1.718
    2   2H    LYS   1          2HT       LYS   1  -4.075  14.668  -1.760
    3   3H    LYS   1          3HT       LYS   1  -2.652  14.664  -2.688
    4    HA   LYS   1           HA       LYS   1  -4.907  12.763  -3.094
    5   1HB   LYS   1          2HB       LYS   1  -5.309  14.296  -5.075
    6   2HB   LYS   1          1HB       LYS   1  -5.630  15.036  -3.504
    7   1HG   LYS   1          2HG       LYS   1  -3.620  16.280  -3.545
    8   2HG   LYS   1          1HG       LYS   1  -2.923  15.272  -4.814
    9   1HD   LYS   1          2HD       LYS   1  -5.392  16.376  -5.770
   10   2HD   LYS   1          1HD       LYS   1  -4.399  17.683  -5.124
   11   1HE   LYS   1          2HE       LYS   1  -2.574  17.155  -6.582
   12   2HE   LYS   1          1HE       LYS   1  -3.298  15.597  -7.031
   13   1HZ   LYS   1          1HZ       LYS   1  -4.356  18.306  -7.623
   14   2HZ   LYS   1          2HZ       LYS   1  -5.249  16.878  -7.850
   15   3HZ   LYS   1          3HZ       LYS   1  -3.828  17.146  -8.741
   16    H    ILE   2           H        ILE   2  -2.763  11.369  -3.077
   17    HA   ILE   2           HA       ILE   2  -1.531  11.492  -5.809
   18    HB   ILE   2           HB       ILE   2  -0.155  11.985  -3.668
   19   1HG1  ILE   2          2HG1      ILE   2   0.615   9.877  -5.697
   20   2HG1  ILE   2          1HG1      ILE   2   0.981  11.601  -5.743
   21   1HG2  ILE   2          1HG2      ILE   2   0.682   9.958  -2.515
   22   2HG2  ILE   2          2HG2      ILE   2  -0.439   8.973  -3.455
   23   3HG2  ILE   2          3HG2      ILE   2  -1.058  10.154  -2.300
   24   1HD1  ILE   2          1HD1      ILE   2   2.963  10.363  -5.025
   25   2HD1  ILE   2          2HD1      ILE   2   2.043   9.596  -3.731
   26   3HD1  ILE   2          3HD1      ILE   2   2.354  11.331  -3.682
   27    H    ASP   3           H        ASP   3  -0.878   9.335  -6.643
   28    HA   ASP   3           HA       ASP   3  -2.631   7.124  -5.617
   29   1HB   ASP   3          2HB       ASP   3  -2.874   6.512  -8.026
   30   2HB   ASP   3          1HB       ASP   3  -3.482   8.134  -7.691
   31    H    GLY   4           H        GLY   4  -1.295   5.526  -4.830
   32   1HA   GLY   4          2HA       GLY   4   0.976   4.639  -6.496
   33   2HA   GLY   4          1HA       GLY   4   1.402   5.246  -4.896
   34    H    TYR   5           H        TYR   5   2.209   2.963  -4.645
   35    HA   TYR   5           HA       TYR   5  -0.029   1.138  -3.819
   36   1HB   TYR   5          2HB       TYR   5   2.700   0.456  -4.964
   37   2HB   TYR   5          1HB       TYR   5   1.421  -0.695  -4.582
   38    HD1  TYR   5           1HD      TYR   5  -0.166  -1.269  -6.206
   39    HD2  TYR   5           2HD      TYR   5   2.105   2.348  -6.661
   40    HE1  TYR   5           1HE      TYR   5  -1.138  -0.943  -8.465
   41    HE2  TYR   5           2HE      TYR   5   1.133   2.675  -8.920
   42    HH   TYR   5           HH       TYR   5  -1.498   1.405  -9.990
   43    HA   PRO   6           HA       PRO   6   2.426   1.896  -0.049
   44   1HB   PRO   6          2HB       PRO   6   0.375   1.326   1.671
   45   2HB   PRO   6          1HB       PRO   6   0.594   2.921   0.921
   46   1HG   PRO   6          2HG       PRO   6  -1.245   0.707   0.153
   47   2HG   PRO   6          1HG       PRO   6  -1.536   2.453   0.186
   48   1HD   PRO   6          2HD       PRO   6  -1.021   1.095  -2.099
   49   2HD   PRO   6          1HD       PRO   6  -0.557   2.791  -1.863
   50    H    VAL   7           H        VAL   7   3.667   0.278   0.828
   51    HA   VAL   7           HA       VAL   7   2.988  -2.535   0.329
   52    HB   VAL   7           HB       VAL   7   5.199  -2.844   1.542
   53   1HG1  VAL   7          1HG1      VAL   7   6.515  -1.739  -0.270
   54   2HG1  VAL   7          2HG1      VAL   7   5.056  -0.879  -0.765
   55   3HG1  VAL   7          3HG1      VAL   7   5.128  -2.636  -0.886
   56   1HG2  VAL   7          1HG2      VAL   7   5.976  -0.070   1.357
   57   2HG2  VAL   7          2HG2      VAL   7   6.051  -1.149   2.750
   58   3HG2  VAL   7          3HG2      VAL   7   4.581  -0.229   2.426
   59    H    ASP   8           H        ASP   8   3.986  -3.759   2.617
   60    HA   ASP   8           HA       ASP   8   1.667  -3.677   4.371
   61   1HB   ASP   8          2HB       ASP   8   4.126  -5.237   3.934
   62   2HB   ASP   8          1HB       ASP   8   3.619  -5.171   5.624
   63    H    TYR   9           H        TYR   9   4.888  -3.790   5.756
   64    HA   TYR   9           HA       TYR   9   4.484  -1.138   7.068
   65   1HB   TYR   9          2HB       TYR   9   3.926  -3.658   8.203
   66   2HB   TYR   9          1HB       TYR   9   5.459  -3.152   8.914
   67    HD1  TYR   9           1HD      TYR   9   1.888  -2.326   8.514
   68    HD2  TYR   9           2HD      TYR   9   5.615  -1.156  10.302
   69    HE1  TYR   9           1HE      TYR   9   0.683  -0.739   9.989
   70    HE2  TYR   9           2HE      TYR   9   4.409   0.431  11.778
   71    HH   TYR   9           HH       TYR   9   1.871   0.506  12.703
   72    H    TRP  10           H        TRP  10   6.707  -3.924   7.436
   73    HA   TRP  10           HA       TRP  10   9.025  -2.082   7.356
   74   1HB   TRP  10          2HB       TRP  10   9.001  -5.098   7.615
   75   2HB   TRP  10          1HB       TRP  10  10.210  -3.968   8.222
   76    HD1  TRP  10           HD       TRP  10   9.533  -2.466  10.348
   77    HE1  TRP  10           1HE      TRP  10   7.817  -2.877  12.227
   78    HE3  TRP  10           3HE      TRP  10   6.728  -6.146   8.190
   79    HZ2  TRP  10           2HZ      TRP  10   5.554  -4.548  12.746
   80    HZ3  TRP  10           3HZ      TRP  10   4.801  -7.129   9.397
   81    HH2  TRP  10           HH       TRP  10   4.210  -6.336  11.671
   82    H    ASN  11           H        ASN  11   7.187  -3.271   5.005
   83    HA   ASN  11           HA       ASN  11   7.545  -3.627   2.703
   84   1HB   ASN  11          2HB       ASN  11  10.439  -3.098   3.386
   85   2HB   ASN  11          1HB       ASN  11   9.630  -2.798   1.854
   86   1HD2  ASN  11          1HD2      ASN  11  11.019  -0.717   3.262
   87   2HD2  ASN  11          2HD2      ASN  11   9.876   0.421   3.792
   88    H    CYS  12           H        CYS  12   8.592  -5.598   5.120
   89    HA   CYS  12           HA       CYS  12  10.359  -7.399   3.689
   90   1HB   CYS  12          2HB       CYS  12   9.862  -6.962   6.255
   91   2HB   CYS  12          1HB       CYS  12   8.633  -8.203   6.010
   92    H    LYS  13           H        LYS  13   6.878  -7.236   4.285
   93    HA   LYS  13           HA       LYS  13   6.387  -9.778   2.871
   94   1HB   LYS  13          2HB       LYS  13   5.166  -8.518   4.914
   95   2HB   LYS  13          1HB       LYS  13   4.224  -7.845   3.582
   96   1HG   LYS  13          2HG       LYS  13   3.185  -9.818   3.169
   97   2HG   LYS  13          1HG       LYS  13   4.675 -10.742   3.357
   98   1HD   LYS  13          2HD       LYS  13   4.466 -10.760   5.748
   99   2HD   LYS  13          1HD       LYS  13   3.157  -9.578   5.702
  100   1HE   LYS  13          2HE       LYS  13   1.588 -11.139   4.969
  101   2HE   LYS  13          1HE       LYS  13   2.821 -12.173   4.219
  102   1HZ   LYS  13          1HZ       LYS  13   3.717 -12.387   6.597
  103   2HZ   LYS  13          2HZ       LYS  13   2.331 -13.280   6.186
  104   3HZ   LYS  13          3HZ       LYS  13   2.185 -11.845   7.085
  105    H    ARG  14           H        ARG  14   5.223  -9.862   0.849
  106    HA   ARG  14           HA       ARG  14   5.971  -8.321  -1.275
  107   1HB   ARG  14          2HB       ARG  14   3.674  -8.932  -2.217
  108   2HB   ARG  14          1HB       ARG  14   4.611 -10.270  -1.551
  109   1HG   ARG  14          2HG       ARG  14   3.381 -10.045   0.592
  110   2HG   ARG  14          1HG       ARG  14   2.415  -8.750  -0.114
  111   1HD   ARG  14          2HD       ARG  14   1.045 -10.638  -0.454
  112   2HD   ARG  14          1HD       ARG  14   1.920 -10.539  -1.996
  113    HE   ARG  14           HE       ARG  14   2.401 -12.525   0.131
  114   1HH1  ARG  14          1HH2      ARG  14   2.534 -12.002  -3.131
  115   2HH1  ARG  14          2HH2      ARG  14   4.067 -12.763  -3.394
  116   1HH2  ARG  14          1HH1      ARG  14   4.806 -13.048  -0.019
  117   2HH2  ARG  14          2HH1      ARG  14   5.354 -13.355  -1.633
  118    H    ILE  15           H        ILE  15   4.929  -6.547  -2.470
  119    HA   ILE  15           HA       ILE  15   4.260  -4.288  -0.797
  120    HB   ILE  15           HB       ILE  15   3.926  -3.196  -3.035
  121   1HG1  ILE  15          2HG1      ILE  15   4.540  -5.974  -4.105
  122   2HG1  ILE  15          1HG1      ILE  15   2.958  -5.201  -4.173
  123   1HG2  ILE  15          1HG2      ILE  15   6.366  -4.544  -3.688
  124   2HG2  ILE  15          2HG2      ILE  15   6.271  -4.388  -1.934
  125   3HG2  ILE  15          3HG2      ILE  15   6.157  -2.953  -2.953
  126   1HD1  ILE  15          1HD1      ILE  15   5.515  -4.254  -5.495
  127   2HD1  ILE  15          2HD1      ILE  15   4.037  -3.296  -5.429
  128   3HD1  ILE  15          3HD1      ILE  15   4.054  -4.833  -6.294
  129    H    CYS  16           H        CYS  16   2.381  -6.885  -1.593
  130    HA   CYS  16           HA       CYS  16  -0.128  -5.330  -1.182
  131   1HB   CYS  16          2HB       CYS  16  -0.126  -5.597  -3.523
  132   2HB   CYS  16          1HB       CYS  16   0.627  -7.186  -3.438
  133    H    TRP  17           H        TRP  17  -1.124  -6.263   0.576
  134    HA   TRP  17           HA       TRP  17  -0.293  -8.703   1.794
  135   1HB   TRP  17          2HB       TRP  17  -1.733  -6.622   2.573
  136   2HB   TRP  17          1HB       TRP  17  -3.085  -7.632   2.061
  137    HD1  TRP  17           HD       TRP  17   0.191  -8.518   3.930
  138    HE1  TRP  17           1HE      TRP  17  -0.432  -9.846   6.049
  139    HE3  TRP  17           3HE      TRP  17  -4.900  -8.435   3.556
  140    HZ2  TRP  17           2HZ      TRP  17  -2.779 -10.750   7.408
  141    HZ3  TRP  17           3HZ      TRP  17  -6.304  -9.535   5.278
  142    HH2  TRP  17           HH       TRP  17  -5.250 -10.692   7.201
  143    H    TYR  18           H        TYR  18  -3.271  -9.575   2.039
  144    HA   TYR  18           HA       TYR  18  -3.583 -10.910  -0.611
  145   1HB   TYR  18          2HB       TYR  18  -2.211 -12.181   1.212
  146   2HB   TYR  18          1HB       TYR  18  -3.776 -12.436   1.980
  147    HD1  TYR  18           1HD      TYR  18  -4.698 -14.515   1.519
  148    HD2  TYR  18           2HD      TYR  18  -2.481 -12.482  -1.548
  149    HE1  TYR  18           1HE      TYR  18  -5.165 -16.376  -0.051
  150    HE2  TYR  18           2HE      TYR  18  -2.948 -14.343  -3.120
  151    HH   TYR  18           HH       TYR  18  -4.330 -17.337  -2.062
  152    H    ASN  19           H        ASN  19  -5.101  -8.786   0.888
  153    HA   ASN  19           HA       ASN  19  -7.756 -10.146   0.814
  154   1HB   ASN  19          2HB       ASN  19  -6.374  -9.536   3.160
  155   2HB   ASN  19          1HB       ASN  19  -7.507  -8.197   2.980
  156   1HD2  ASN  19          1HD2      ASN  19  -9.784  -9.280   1.974
  157   2HD2  ASN  19          2HD2      ASN  19 -10.370 -10.538   2.951
  158    H    ASN  20           H        ASN  20  -9.264  -8.867  -0.214
  159    HA   ASN  20           HA       ASN  20  -8.489  -6.377  -1.451
  160   1HB   ASN  20          2HB       ASN  20 -11.210  -7.652  -1.001
  161   2HB   ASN  20          1HB       ASN  20 -10.844  -6.407  -2.196
  162   1HD2  ASN  20          1HD2      ASN  20  -8.117  -7.703  -2.702
  163   2HD2  ASN  20          2HD2      ASN  20  -8.466  -9.049  -3.675
  164    H    LYS  21           H        LYS  21  -9.435  -7.072   1.720
  165    HA   LYS  21           HA       LYS  21 -10.625  -4.355   2.115
  166   1HB   LYS  21          2HB       LYS  21 -11.625  -5.303   4.078
  167   2HB   LYS  21          1HB       LYS  21 -11.798  -6.520   2.813
  168   1HG   LYS  21          2HG       LYS  21  -9.882  -7.749   3.653
  169   2HG   LYS  21          1HG       LYS  21  -9.529  -6.478   4.824
  170   1HD   LYS  21          2HD       LYS  21 -12.285  -7.405   5.040
  171   2HD   LYS  21          1HD       LYS  21 -11.133  -8.722   5.265
  172   1HE   LYS  21          2HE       LYS  21 -11.341  -7.826   7.445
  173   2HE   LYS  21          1HE       LYS  21  -9.889  -7.010   6.832
  174   1HZ   LYS  21          1HZ       LYS  21 -12.647  -5.941   6.554
  175   2HZ   LYS  21          2HZ       LYS  21 -11.201  -5.153   6.139
  176   3HZ   LYS  21          3HZ       LYS  21 -11.566  -5.461   7.770
  177    H    TYR  22           H        TYR  22  -7.843  -6.335   2.821
  178    HA   TYR  22           HA       TYR  22  -6.886  -4.827   5.109
  179   1HB   TYR  22          2HB       TYR  22  -6.313  -7.213   4.180
  180   2HB   TYR  22          1HB       TYR  22  -5.160  -6.345   3.165
  181    HD1  TYR  22           1HD      TYR  22  -3.000  -6.246   4.007
  182    HD2  TYR  22           2HD      TYR  22  -6.308  -6.195   6.742
  183    HE1  TYR  22           1HE      TYR  22  -1.419  -6.104   5.913
  184    HE2  TYR  22           2HE      TYR  22  -4.731  -6.051   8.649
  185    HH   TYR  22           HH       TYR  22  -2.458  -6.502   9.191
  186    H    CYS  23           H        CYS  23  -5.782  -4.954   1.703
  187    HA   CYS  23           HA       CYS  23  -3.979  -2.775   1.806
  188   1HB   CYS  23          2HB       CYS  23  -3.929  -4.188  -0.082
  189   2HB   CYS  23          1HB       CYS  23  -5.676  -4.109  -0.300
  190    H    ASN  24           H        ASN  24  -7.498  -2.846   1.519
  191    HA   ASN  24           HA       ASN  24  -7.707   0.005   0.836
  192   1HB   ASN  24          2HB       ASN  24  -9.276  -1.977   0.263
  193   2HB   ASN  24          1HB       ASN  24  -9.868  -1.818   1.916
  194   1HD2  ASN  24          1HD2      ASN  24  -9.862  -0.322  -1.266
  195   2HD2  ASN  24          2HD2      ASN  24 -10.948   0.927  -0.888
  196    H    ASP  25           H        ASP  25  -8.000  -2.009   3.761
  197    HA   ASP  25           HA       ASP  25  -9.033   0.013   5.513
  198   1HB   ASP  25          2HB       ASP  25  -9.079  -2.334   6.088
  199   2HB   ASP  25          1HB       ASP  25  -7.327  -2.464   5.919
  200    H    LEU  26           H        LEU  26  -5.679  -1.081   4.904
  201    HA   LEU  26           HA       LEU  26  -4.453   0.917   6.602
  202   1HB   LEU  26          2HB       LEU  26  -3.750  -1.288   4.833
  203   2HB   LEU  26          1HB       LEU  26  -2.634   0.065   4.634
  204    HG   LEU  26           HG       LEU  26  -3.317  -0.535   7.437
  205   1HD1  LEU  26          1HD1      LEU  26  -2.122  -2.590   5.611
  206   2HD1  LEU  26          2HD1      LEU  26  -3.205  -2.812   6.985
  207   3HD1  LEU  26          3HD1      LEU  26  -1.500  -2.453   7.255
  208   1HD2  LEU  26          1HD2      LEU  26  -1.124   0.156   7.787
  209   2HD2  LEU  26          2HD2      LEU  26  -1.483   0.994   6.278
  210   3HD2  LEU  26          3HD2      LEU  26  -0.562  -0.510   6.254
  211    H    CYS  27           H        CYS  27  -5.117   0.696   3.114
  212    HA   CYS  27           HA       CYS  27  -3.760   3.083   2.323
  213   1HB   CYS  27          2HB       CYS  27  -5.988   1.353   1.293
  214   2HB   CYS  27          1HB       CYS  27  -5.623   2.865   0.465
  215    H    LYS  28           H        LYS  28  -7.108   2.501   3.422
  216    HA   LYS  28           HA       LYS  28  -8.060   5.178   3.023
  217   1HB   LYS  28          2HB       LYS  28  -8.921   2.674   4.147
  218   2HB   LYS  28          1HB       LYS  28  -9.318   3.968   5.275
  219   1HG   LYS  28          2HG       LYS  28 -11.000   4.666   3.956
  220   2HG   LYS  28          1HG       LYS  28  -9.899   4.825   2.587
  221   1HD   LYS  28          2HD       LYS  28 -10.422   2.752   1.743
  222   2HD   LYS  28          1HD       LYS  28 -10.720   2.063   3.340
  223   1HE   LYS  28          2HE       LYS  28 -12.569   4.118   2.093
  224   2HE   LYS  28          1HE       LYS  28 -12.809   2.370   1.907
  225   1HZ   LYS  28          1HZ       LYS  28 -13.174   2.080   4.130
  226   2HZ   LYS  28          2HZ       LYS  28 -13.820   3.640   3.948
  227   3HZ   LYS  28          3HZ       LYS  28 -12.259   3.433   4.584
  228    H    GLY  29           H        GLY  29  -6.049   3.705   5.474
  229   1HA   GLY  29          2HA       GLY  29  -6.420   5.590   7.588
  230   2HA   GLY  29          1HA       GLY  29  -4.938   4.662   7.317
  231    H    LEU  30           H        LEU  30  -4.454   5.589   4.668
  232    HA   LEU  30           HA       LEU  30  -3.360   8.283   5.278
  233   1HB   LEU  30          2HB       LEU  30  -2.978   6.431   2.900
  234   2HB   LEU  30          1HB       LEU  30  -1.972   7.819   3.318
  235    HG   LEU  30           HG       LEU  30  -2.238   6.002   5.571
  236   1HD1  LEU  30          1HD1      LEU  30  -1.746   4.845   2.911
  237   2HD1  LEU  30          2HD1      LEU  30  -2.177   4.046   4.424
  238   3HD1  LEU  30          3HD1      LEU  30  -0.495   4.463   4.095
  239   1HD2  LEU  30          1HD2      LEU  30   0.357   6.047   5.112
  240   2HD2  LEU  30          2HD2      LEU  30  -0.457   7.508   5.674
  241   3HD2  LEU  30          3HD2      LEU  30  -0.066   7.318   3.965
  242    H    LYS  31           H        LYS  31  -6.265   7.516   4.543
  243    HA   LYS  31           HA       LYS  31  -8.016   8.648   3.447
  244   1HB   LYS  31          2HB       LYS  31  -6.446  10.585   4.009
  245   2HB   LYS  31          1HB       LYS  31  -5.855  10.458   2.352
  246   1HG   LYS  31          2HG       LYS  31  -7.590  11.726   1.692
  247   2HG   LYS  31          1HG       LYS  31  -8.668  10.413   2.163
  248   1HD   LYS  31          2HD       LYS  31  -9.505  11.748   3.765
  249   2HD   LYS  31          1HD       LYS  31  -7.933  11.699   4.563
  250   1HE   LYS  31          2HE       LYS  31  -7.180  13.646   3.265
  251   2HE   LYS  31          1HE       LYS  31  -8.730  13.684   2.403
  252   1HZ   LYS  31          1HZ       LYS  31  -9.885  14.229   4.307
  253   2HZ   LYS  31          2HZ       LYS  31  -8.447  15.108   4.530
  254   3HZ   LYS  31          3HZ       LYS  31  -8.682  13.637   5.346
  255    H    ALA  32           H        ALA  32  -5.975   6.639   2.031
  256    HA   ALA  32           HA       ALA  32  -6.275   7.366  -0.787
  257   1HB   ALA  32          1HB       ALA  32  -5.058   5.338  -1.133
  258   2HB   ALA  32          2HB       ALA  32  -5.588   4.676   0.412
  259   3HB   ALA  32          3HB       ALA  32  -4.430   6.002   0.375
  260    H    ASP  33           H        ASP  33  -8.610   7.618  -0.882
  261    HA   ASP  33           HA       ASP  33 -10.683   6.037  -0.086
  262   1HB   ASP  33          2HB       ASP  33 -10.161   7.239  -2.819
  263   2HB   ASP  33          1HB       ASP  33 -11.748   6.706  -2.266
  264    H    SER  34           H        SER  34 -10.059   5.481  -3.484
  265    HA   SER  34           HA       SER  34 -10.774   2.705  -3.335
  266   1HB   SER  34          2HB       SER  34  -9.868   2.798  -5.733
  267   2HB   SER  34          1HB       SER  34 -11.145   3.946  -5.338
  268    HG   SER  34           HG       SER  34  -9.757   5.544  -5.477
  269    H    GLY  35           H        GLY  35  -9.339   1.662  -1.833
  270   1HA   GLY  35          2HA       GLY  35  -6.543   1.335  -2.852
  271   2HA   GLY  35          1HA       GLY  35  -6.920   1.368  -1.126
  272    H    TYR  36           H        TYR  36  -6.554  -0.656  -3.828
  273    HA   TYR  36           HA       TYR  36  -7.700  -2.943  -2.266
  274   1HB   TYR  36          2HB       TYR  36  -8.628  -3.782  -4.399
  275   2HB   TYR  36          1HB       TYR  36  -9.255  -2.175  -4.033
  276    HD1  TYR  36           1HD      TYR  36  -8.867  -0.342  -5.492
  277    HD2  TYR  36           2HD      TYR  36  -6.661  -3.993  -6.001
  278    HE1  TYR  36           1HE      TYR  36  -7.965   0.503  -7.642
  279    HE2  TYR  36           2HE      TYR  36  -5.760  -3.147  -8.149
  280    HH   TYR  36           HH       TYR  36  -6.798  -0.013  -9.471
  281    H    CYS  37           H        CYS  37  -6.809  -5.064  -3.051
  282    HA   CYS  37           HA       CYS  37  -3.963  -4.746  -3.916
  283   1HB   CYS  37          2HB       CYS  37  -5.290  -6.115  -1.810
  284   2HB   CYS  37          1HB       CYS  37  -4.659  -7.350  -2.901
  285    H    TRP  38           H        TRP  38  -3.422  -5.540  -5.921
  286    HA   TRP  38           HA       TRP  38  -5.467  -6.856  -7.553
  287   1HB   TRP  38          2HB       TRP  38  -3.671  -5.136  -8.225
  288   2HB   TRP  38          1HB       TRP  38  -2.531  -6.482  -8.179
  289    HD1  TRP  38           HD       TRP  38  -2.225  -7.591 -10.434
  290    HE1  TRP  38           1HE      TRP  38  -3.683  -7.988 -12.524
  291    HE3  TRP  38           3HE      TRP  38  -6.577  -5.402  -8.903
  292    HZ2  TRP  38           2HZ      TRP  38  -6.342  -7.449 -13.425
  293    HZ3  TRP  38           3HZ      TRP  38  -8.555  -5.359 -10.395
  294    HH2  TRP  38           HH       TRP  38  -8.443  -6.380 -12.652
  295    H    GLY  39           H        GLY  39  -4.886  -8.943  -8.732
  296   1HA   GLY  39          2HA       GLY  39  -3.768 -10.863  -6.760
  297   2HA   GLY  39          1HA       GLY  39  -4.794 -11.284  -8.128
  298    H    TRP  40           H        TRP  40  -3.135  -9.546  -9.952
  299    HA   TRP  40           HA       TRP  40  -1.187 -11.608 -10.672
  300   1HB   TRP  40          2HB       TRP  40  -2.376 -10.469 -12.415
  301   2HB   TRP  40          1HB       TRP  40  -1.979  -8.889 -11.748
  302    HD1  TRP  40           HD       TRP  40  -0.097  -7.733 -12.959
  303    HE1  TRP  40           1HE      TRP  40   1.940  -8.472 -14.339
  304    HE3  TRP  40           3HE      TRP  40  -0.558 -12.805 -12.589
  305    HZ2  TRP  40           2HZ      TRP  40   3.223 -10.886 -15.180
  306    HZ3  TRP  40           3HZ      TRP  40   1.084 -14.300 -13.690
  307    HH2  TRP  40           HH       TRP  40   2.974 -13.347 -14.984
  308    H    THR  41           H        THR  41  -0.288  -8.234 -10.940
  309    HA   THR  41           HA       THR  41   1.654  -8.449  -8.706
  310    HB   THR  41           HB       THR  41   3.550  -8.123 -10.201
  311    HG1  THR  41           1HG      THR  41   2.469  -6.858 -11.752
  312   1HG2  THR  41          1HG2      THR  41   1.780 -10.263 -11.408
  313   2HG2  THR  41          2HG2      THR  41   2.601 -10.444  -9.857
  314   3HG2  THR  41          3HG2      THR  41   3.543 -10.246 -11.333
  315    H    LEU  42           H        LEU  42  -0.662  -6.712  -9.280
  316    HA   LEU  42           HA       LEU  42   0.498  -4.100 -10.037
  317   1HB   LEU  42          2HB       LEU  42  -2.051  -5.403  -9.983
  318   2HB   LEU  42          1HB       LEU  42  -2.162  -3.943  -9.003
  319    HG   LEU  42           HG       LEU  42  -0.803  -3.790 -11.670
  320   1HD1  LEU  42          1HD1      LEU  42  -3.758  -4.077 -11.156
  321   2HD1  LEU  42          2HD1      LEU  42  -2.777  -4.839 -12.409
  322   3HD1  LEU  42          3HD1      LEU  42  -3.174  -3.124 -12.520
  323   1HD2  LEU  42          1HD2      LEU  42  -2.305  -1.561 -11.384
  324   2HD2  LEU  42          2HD2      LEU  42  -0.689  -1.712 -10.693
  325   3HD2  LEU  42          3HD2      LEU  42  -2.109  -1.996  -9.686
  326    H    SER  43           H        SER  43   0.491  -5.931  -7.258
  327    HA   SER  43           HA       SER  43   0.908  -5.377  -5.003
  328   1HB   SER  43          2HB       SER  43   1.213  -2.506  -5.698
  329   2HB   SER  43          1HB       SER  43   2.308  -3.568  -4.817
  330    HG   SER  43           HG       SER  43   3.023  -2.926  -6.958
  331    H    CYS  44           H        CYS  44   0.151  -3.473  -3.330
  332    HA   CYS  44           HA       CYS  44  -2.778  -3.424  -3.504
  333   1HB   CYS  44          2HB       CYS  44  -1.929  -3.801  -1.344
  334   2HB   CYS  44          1HB       CYS  44  -0.624  -2.636  -1.552
  335    H    TYR  45           H        TYR  45  -3.259  -2.012  -5.278
  336    HA   TYR  45           HA       TYR  45  -2.003   0.616  -5.479
  337   1HB   TYR  45          2HB       TYR  45  -2.843  -0.849  -7.367
  338   2HB   TYR  45          1HB       TYR  45  -4.482  -0.451  -6.852
  339    HD1  TYR  45           1HD      TYR  45  -1.450   1.730  -6.866
  340    HD2  TYR  45           2HD      TYR  45  -5.305   0.938  -8.588
  341    HE1  TYR  45           1HE      TYR  45  -1.327   3.865  -8.120
  342    HE2  TYR  45           2HE      TYR  45  -5.182   3.073  -9.842
  343    HH   TYR  45           HH       TYR  45  -2.299   4.872 -10.133
  344    H    CYS  46           H        CYS  46  -2.842   2.568  -4.773
  345    HA   CYS  46           HA       CYS  46  -5.633   2.685  -3.782
  346   1HB   CYS  46          2HB       CYS  46  -3.168   3.272  -2.116
  347   2HB   CYS  46          1HB       CYS  46  -4.827   3.568  -1.603
  348    H    GLN  47           H        GLN  47  -6.472   4.795  -3.896
  349    HA   GLN  47           HA       GLN  47  -4.577   6.930  -4.829
  350   1HB   GLN  47          2HB       GLN  47  -7.296   6.031  -5.792
  351   2HB   GLN  47          1HB       GLN  47  -6.712   7.659  -6.135
  352   1HG   GLN  47          2HG       GLN  47  -4.558   6.454  -6.975
  353   2HG   GLN  47          1HG       GLN  47  -5.586   5.022  -7.051
  354   1HE2  GLN  47          1HE2      GLN  47  -6.183   4.782  -9.217
  355   2HE2  GLN  47          2HE2      GLN  47  -6.764   6.034 -10.206
  356    H    GLY  48           H        GLY  48  -5.070   9.057  -4.052
  357   1HA   GLY  48          2HA       GLY  48  -6.473  10.658  -2.882
  358   2HA   GLY  48          1HA       GLY  48  -7.352   9.308  -2.160
  359    H    LEU  49           H        LEU  49  -3.896   9.115  -2.259
  360    HA   LEU  49           HA       LEU  49  -3.864   9.440   0.712
  361   1HB   LEU  49          2HB       LEU  49  -1.470   8.369   0.197
  362   2HB   LEU  49          1HB       LEU  49  -2.918   7.373   0.261
  363    HG   LEU  49           HG       LEU  49  -2.114   8.608  -2.353
  364   1HD1  LEU  49          1HD1      LEU  49  -0.957   6.194  -2.575
  365   2HD1  LEU  49          2HD1      LEU  49  -0.684   6.465  -0.854
  366   3HD1  LEU  49          3HD1      LEU  49  -0.062   7.616  -2.037
  367   1HD2  LEU  49          1HD2      LEU  49  -3.102   5.814  -1.986
  368   2HD2  LEU  49          2HD2      LEU  49  -3.496   6.987  -3.243
  369   3HD2  LEU  49          3HD2      LEU  49  -4.237   7.122  -1.649
  370    HA   PRO  50           HA       PRO  50  -1.422  13.056   0.561
  371   1HB   PRO  50          2HB       PRO  50   0.549  12.612   2.408
  372   2HB   PRO  50          1HB       PRO  50  -1.141  12.917   2.853
  373   1HG   PRO  50          2HG       PRO  50   0.337  10.339   2.700
  374   2HG   PRO  50          1HG       PRO  50  -0.865  10.881   3.881
  375   1HD   PRO  50          2HD       PRO  50  -1.436   9.169   1.845
  376   2HD   PRO  50          1HD       PRO  50  -2.632  10.272   2.558
  377    H    ASP  51           H        ASP  51   0.667  13.943  -0.170
  378    HA   ASP  51           HA       ASP  51   1.931  12.457  -2.245
  379   1HB   ASP  51          2HB       ASP  51   1.865  14.923  -2.041
  380   2HB   ASP  51          1HB       ASP  51   2.902  14.831  -0.617
  381    H    ASN  52           H        ASN  52   2.506  12.594   1.186
  382    HA   ASN  52           HA       ASN  52   5.164  11.309   0.965
  383   1HB   ASN  52          2HB       ASN  52   3.836  13.041   2.726
  384   2HB   ASN  52          1HB       ASN  52   4.022  11.534   3.619
  385   1HD2  ASN  52          1HD2      ASN  52   5.915  13.894   1.669
  386   2HD2  ASN  52          2HD2      ASN  52   7.385  13.605   2.469
  387    H    ALA  53           H        ALA  53   2.323  10.094   0.351
  388    HA   ALA  53           HA       ALA  53   1.557   8.125   2.166
  389   1HB   ALA  53          1HB       ALA  53   1.053   8.810  -0.466
  390   2HB   ALA  53          2HB       ALA  53   0.312   7.454   0.381
  391   3HB   ALA  53          3HB       ALA  53   1.740   7.193  -0.621
  392    H    ARG  54           H        ARG  54   2.324   6.065   2.722
  393    HA   ARG  54           HA       ARG  54   5.175   5.545   2.206
  394   1HB   ARG  54          2HB       ARG  54   4.316   5.252   4.432
  395   2HB   ARG  54          1HB       ARG  54   2.986   4.248   3.850
  396   1HG   ARG  54          2HG       ARG  54   4.500   2.474   3.233
  397   2HG   ARG  54          1HG       ARG  54   5.904   3.493   3.552
  398   1HD   ARG  54          2HD       ARG  54   5.272   1.812   5.402
  399   2HD   ARG  54          1HD       ARG  54   5.470   3.499   5.920
  400    HE   ARG  54           HE       ARG  54   3.084   3.695   6.105
  401   1HH1  ARG  54          1HH1      ARG  54   4.093   0.544   6.263
  402   2HH1  ARG  54          2HH1      ARG  54   2.583  -0.171   5.806
  403   1HH2  ARG  54          1HH2      ARG  54   1.134   2.843   4.883
  404   2HH2  ARG  54          2HH2      ARG  54   0.906   1.131   5.023
  405    H    ILE  55           H        ILE  55   5.198   4.953  -0.049
  406    HA   ILE  55           HA       ILE  55   4.152   2.206  -0.576
  407    HB   ILE  55           HB       ILE  55   3.272   2.948  -2.728
  408   1HG1  ILE  55          2HG1      ILE  55   5.061   4.739  -2.994
  409   2HG1  ILE  55          1HG1      ILE  55   3.443   5.201  -3.514
  410   1HG2  ILE  55          1HG2      ILE  55   2.032   5.121  -1.273
  411   2HG2  ILE  55          2HG2      ILE  55   2.235   3.718  -0.228
  412   3HG2  ILE  55          3HG2      ILE  55   1.351   3.566  -1.744
  413   1HD1  ILE  55          1HD1      ILE  55   5.098   6.365  -1.437
  414   2HD1  ILE  55          2HD1      ILE  55   3.544   5.855  -0.782
  415   3HD1  ILE  55          3HD1      ILE  55   3.602   6.978  -2.140
  416    H    LYS  56           H        LYS  56   5.227   1.276  -2.584
  417    HA   LYS  56           HA       LYS  56   7.298   0.649  -3.574
  418   1HB   LYS  56          2HB       LYS  56   7.403   3.674  -3.825
  419   2HB   LYS  56          1HB       LYS  56   8.226   2.514  -4.868
  420   1HG   LYS  56          2HG       LYS  56   6.294   1.924  -5.971
  421   2HG   LYS  56          1HG       LYS  56   5.279   2.202  -4.556
  422   1HD   LYS  56          2HD       LYS  56   4.882   4.357  -5.127
  423   2HD   LYS  56          1HD       LYS  56   6.574   4.644  -5.534
  424   1HE   LYS  56          2HE       LYS  56   6.242   4.203  -7.756
  425   2HE   LYS  56          1HE       LYS  56   5.108   2.880  -7.420
  426   1HZ   LYS  56          1HZ       LYS  56   4.134   5.023  -8.363
  427   2HZ   LYS  56          2HZ       LYS  56   4.424   5.697  -6.829
  428   3HZ   LYS  56          3HZ       LYS  56   3.379   4.368  -6.993
  429    H    ARG  57           H        ARG  57   7.890   0.238  -1.107
  430    HA   ARG  57           HA       ARG  57  10.289   1.920  -0.451
  431   1HB   ARG  57          2HB       ARG  57   8.199   0.621   1.322
  432   2HB   ARG  57          1HB       ARG  57   9.666   1.387   1.934
  433   1HG   ARG  57          2HG       ARG  57   7.966   2.951   0.044
  434   2HG   ARG  57          1HG       ARG  57   7.387   2.751   1.698
  435   1HD   ARG  57          2HD       ARG  57  10.129   3.823   0.932
  436   2HD   ARG  57          1HD       ARG  57   8.763   4.802   1.502
  437    HE   ARG  57           HE       ARG  57  10.422   3.081   3.168
  438   1HH1  ARG  57          1HH2      ARG  57   8.471   5.623   3.503
  439   2HH1  ARG  57          2HH2      ARG  57   7.496   5.012   4.798
  440   1HH2  ARG  57          1HH1      ARG  57   8.659   1.762   4.494
  441   2HH2  ARG  57          2HH1      ARG  57   7.603   2.827   5.358
  442    H    SER  58           H        SER  58   9.717  -0.858  -1.830
  443    HA   SER  58           HA       SER  58  10.574  -3.058  -0.404
  444   1HB   SER  58          2HB       SER  58  11.923  -2.468  -3.007
  445   2HB   SER  58          1HB       SER  58  11.082  -3.927  -2.493
  446    HG   SER  58           HG       SER  58   9.365  -3.146  -3.397
  447    H    GLY  59           H        GLY  59  12.499  -3.733   0.553
  448   1HA   GLY  59          2HA       GLY  59  15.048  -2.469  -0.063
  449   2HA   GLY  59          1HA       GLY  59  14.412  -1.984   1.508
  450    H    ARG  60           H        ARG  60  15.459  -3.141   3.052
  451    HA   ARG  60           HA       ARG  60  15.899  -6.062   2.551
  452   1HB   ARG  60          2HB       ARG  60  17.673  -5.485   4.491
  453   2HB   ARG  60          1HB       ARG  60  18.049  -5.260   2.786
  454   1HG   ARG  60          2HG       ARG  60  18.674  -3.254   4.038
  455   2HG   ARG  60          1HG       ARG  60  17.324  -2.884   2.968
  456   1HD   ARG  60          2HD       ARG  60  16.778  -1.901   5.098
  457   2HD   ARG  60          1HD       ARG  60  15.795  -3.373   4.983
  458    HE   ARG  60           HE       ARG  60  17.316  -4.471   6.511
  459   1HH1  ARG  60          1HH2      ARG  60  16.932  -1.637   7.695
  460   2HH1  ARG  60          2HH2      ARG  60  18.561  -1.271   8.156
  461   1HH2  ARG  60          1HH1      ARG  60  19.952  -3.822   6.261
  462   2HH2  ARG  60          2HH1      ARG  60  20.270  -2.508   7.344
  463    H    CYS  61           H        CYS  61  13.433  -5.263   3.528
  464    HA   CYS  61           HA       CYS  61  11.929  -5.667   5.299
  465   1HB   CYS  61          2HB       CYS  61  14.313  -7.435   5.880
  466   2HB   CYS  61          1HB       CYS  61  12.883  -7.462   6.911
  467    H    ARG  62           H        ARG  62  11.483  -4.140   6.831
  468    HA   ARG  62           HA       ARG  62  13.675  -2.833   8.315
  469   1HB   ARG  62          2HB       ARG  62  11.127  -2.169   7.302
  470   2HB   ARG  62          1HB       ARG  62  10.978  -2.077   9.057
  471   1HG   ARG  62          2HG       ARG  62  12.148  -0.158   9.102
  472   2HG   ARG  62          1HG       ARG  62  13.488  -0.916   8.243
  473   1HD   ARG  62          2HD       ARG  62  12.959   0.485   6.526
  474   2HD   ARG  62          1HD       ARG  62  11.560  -0.575   6.256
  475    HE   ARG  62           HE       ARG  62  11.458   2.069   7.448
  476   1HH1  ARG  62          1HH2      ARG  62   9.500  -0.195   6.167
  477   2HH1  ARG  62          2HH2      ARG  62   8.237  -0.095   7.349
  478   1HH2  ARG  62          1HH1      ARG  62  10.100   1.810   9.566
  479   2HH2  ARG  62          2HH1      ARG  62   8.577   1.039   9.273
  480    H    ALA  63           H        ALA  63  13.236  -5.624   8.980
  481    HA   ALA  63           HA       ALA  63  12.691  -5.312  11.878
  482   1HB   ALA  63          1HB       ALA  63  11.247  -7.573  11.316
  483   2HB   ALA  63          2HB       ALA  63  10.943  -6.603   9.875
  484   3HB   ALA  63          3HB       ALA  63  10.541  -5.963  11.468
  Start of MODEL   18
    1   1H    LYS   1          1HT       LYS   1  -2.561  13.469  -1.905
    2   2H    LYS   1          2HT       LYS   1  -4.147  13.536  -1.298
    3   3H    LYS   1          3HT       LYS   1  -3.438  14.919  -1.982
    4    HA   LYS   1           HA       LYS   1  -4.873  12.817  -3.270
    5   1HB   LYS   1          2HB       LYS   1  -3.625  15.413  -4.232
    6   2HB   LYS   1          1HB       LYS   1  -4.985  14.566  -4.972
    7   1HG   LYS   1          2HG       LYS   1  -5.627  14.929  -2.227
    8   2HG   LYS   1          1HG       LYS   1  -5.028  16.476  -2.829
    9   1HD   LYS   1          2HD       LYS   1  -6.740  16.701  -4.364
   10   2HD   LYS   1          1HD       LYS   1  -6.950  14.960  -4.544
   11   1HE   LYS   1          2HE       LYS   1  -8.095  14.797  -2.421
   12   2HE   LYS   1          1HE       LYS   1  -7.702  16.484  -2.026
   13   1HZ   LYS   1          1HZ       LYS   1  -9.937  16.294  -2.963
   14   2HZ   LYS   1          2HZ       LYS   1  -9.298  15.590  -4.371
   15   3HZ   LYS   1          3HZ       LYS   1  -8.924  17.199  -3.978
   16    H    ILE   2           H        ILE   2  -2.675  11.384  -2.864
   17    HA   ILE   2           HA       ILE   2  -1.047  11.621  -5.374
   18    HB   ILE   2           HB       ILE   2   0.158  12.055  -3.252
   19   1HG1  ILE   2          2HG1      ILE   2   1.006   9.323  -4.205
   20   2HG1  ILE   2          1HG1      ILE   2   1.136  10.726  -5.268
   21   1HG2  ILE   2          1HG2      ILE   2   0.124   9.311  -2.286
   22   2HG2  ILE   2          2HG2      ILE   2  -1.493  10.014  -2.275
   23   3HG2  ILE   2          3HG2      ILE   2  -0.181  10.807  -1.403
   24   1HD1  ILE   2          1HD1      ILE   2   3.241  10.361  -4.029
   25   2HD1  ILE   2          2HD1      ILE   2   2.365  10.495  -2.504
   26   3HD1  ILE   2          3HD1      ILE   2   2.495  11.892  -3.572
   27    H    ASP   3           H        ASP   3  -0.321   9.506  -6.258
   28    HA   ASP   3           HA       ASP   3  -2.131   7.230  -5.519
   29   1HB   ASP   3          2HB       ASP   3  -1.275   7.992  -8.323
   30   2HB   ASP   3          1HB       ASP   3  -2.562   6.879  -7.854
   31    H    GLY   4           H        GLY   4  -1.000   5.330  -5.211
   32   1HA   GLY   4          2HA       GLY   4   1.355   4.650  -6.744
   33   2HA   GLY   4          1HA       GLY   4   1.792   5.169  -5.117
   34    H    TYR   5           H        TYR   5   2.539   2.737  -5.351
   35    HA   TYR   5           HA       TYR   5   0.306   0.897  -4.584
   36   1HB   TYR   5          2HB       TYR   5   3.133   0.502  -5.617
   37   2HB   TYR   5          1HB       TYR   5   2.085  -0.830  -5.129
   38    HD1  TYR   5           1HD      TYR   5   2.344   2.067  -7.464
   39    HD2  TYR   5           2HD      TYR   5   0.399  -1.660  -6.577
   40    HE1  TYR   5           1HE      TYR   5   1.254   2.105  -9.691
   41    HE2  TYR   5           2HE      TYR   5  -0.690  -1.622  -8.803
   42    HH   TYR   5           HH       TYR   5   0.038   0.937 -11.161
   43    HA   PRO   6           HA       PRO   6   2.241   1.626  -0.539
   44   1HB   PRO   6          2HB       PRO   6   0.073   0.762   0.897
   45   2HB   PRO   6          1HB       PRO   6   0.209   2.408   0.244
   46   1HG   PRO   6          2HG       PRO   6  -1.295   0.068  -0.822
   47   2HG   PRO   6          1HG       PRO   6  -1.760   1.776  -0.764
   48   1HD   PRO   6          2HD       PRO   6  -0.841   0.564  -3.017
   49   2HD   PRO   6          1HD       PRO   6  -0.600   2.292  -2.676
   50    H    VAL   7           H        VAL   7   3.328   0.100   0.722
   51    HA   VAL   7           HA       VAL   7   2.783  -2.776   0.081
   52    HB   VAL   7           HB       VAL   7   5.211  -2.966   0.939
   53   1HG1  VAL   7          1HG1      VAL   7   6.040  -2.539  -1.221
   54   2HG1  VAL   7          2HG1      VAL   7   4.960  -1.167  -1.466
   55   3HG1  VAL   7          3HG1      VAL   7   4.320  -2.810  -1.505
   56   1HG2  VAL   7          1HG2      VAL   7   5.290  -0.009   0.350
   57   2HG2  VAL   7          2HG2      VAL   7   6.489  -1.000   1.180
   58   3HG2  VAL   7          3HG2      VAL   7   4.974  -0.591   1.985
   59    H    ASP   8           H        ASP   8   3.976  -4.050   2.143
   60    HA   ASP   8           HA       ASP   8   2.101  -3.846   4.292
   61   1HB   ASP   8          2HB       ASP   8   3.864  -5.673   3.379
   62   2HB   ASP   8          1HB       ASP   8   4.793  -5.040   4.739
   63    H    TYR   9           H        TYR   9   4.204  -4.138   6.420
   64    HA   TYR   9           HA       TYR   9   4.367  -1.291   7.150
   65   1HB   TYR   9          2HB       TYR   9   4.660  -3.972   8.400
   66   2HB   TYR   9          1HB       TYR   9   5.576  -2.665   9.150
   67    HD1  TYR   9           1HD      TYR   9   4.490  -1.660  10.934
   68    HD2  TYR   9           2HD      TYR   9   2.174  -3.030   7.587
   69    HE1  TYR   9           1HE      TYR   9   2.424  -0.832  12.026
   70    HE2  TYR   9           2HE      TYR   9   0.106  -2.202   8.679
   71    HH   TYR   9           HH       TYR   9  -0.149  -1.507  11.836
   72    H    TRP  10           H        TRP  10   6.689  -3.984   6.672
   73    HA   TRP  10           HA       TRP  10   8.841  -1.914   6.346
   74   1HB   TRP  10          2HB       TRP  10   9.182  -4.787   7.235
   75   2HB   TRP  10          1HB       TRP  10  10.315  -3.450   7.433
   76    HD1  TRP  10           HD       TRP  10   9.431  -1.410   9.096
   77    HE1  TRP  10           1HE      TRP  10   8.069  -1.593  11.278
   78    HE3  TRP  10           3HE      TRP  10   7.474  -6.089   8.520
   79    HZ2  TRP  10           2HZ      TRP  10   6.370  -3.480  12.603
   80    HZ3  TRP  10           3HZ      TRP  10   5.989  -7.056  10.252
   81    HH2  TRP  10           HH       TRP  10   5.435  -5.758  12.291
   82    H    ASN  11           H        ASN  11   6.983  -3.412   4.349
   83    HA   ASN  11           HA       ASN  11   7.228  -4.310   2.175
   84   1HB   ASN  11          2HB       ASN  11  10.067  -3.339   2.646
   85   2HB   ASN  11          1HB       ASN  11   9.317  -3.636   1.076
   86   1HD2  ASN  11          1HD2      ASN  11   9.653  -1.312   0.539
   87   2HD2  ASN  11          2HD2      ASN  11   8.618  -0.135   1.191
   88    H    CYS  12           H        CYS  12   8.237  -5.794   4.799
   89    HA   CYS  12           HA       CYS  12  10.165  -7.715   3.689
   90   1HB   CYS  12          2HB       CYS  12   9.765  -6.728   6.132
   91   2HB   CYS  12          1HB       CYS  12   8.679  -8.113   6.254
   92    H    LYS  13           H        LYS  13   6.837  -7.924   4.977
   93    HA   LYS  13           HA       LYS  13   6.375 -10.642   4.248
   94   1HB   LYS  13          2HB       LYS  13   5.020  -8.466   5.440
   95   2HB   LYS  13          1HB       LYS  13   3.998  -9.000   4.105
   96   1HG   LYS  13          2HG       LYS  13   3.375 -10.294   6.042
   97   2HG   LYS  13          1HG       LYS  13   4.268 -11.364   4.960
   98   1HD   LYS  13          2HD       LYS  13   6.342 -10.877   6.277
   99   2HD   LYS  13          1HD       LYS  13   5.358  -9.951   7.410
  100   1HE   LYS  13          2HE       LYS  13   4.370 -11.838   8.306
  101   2HE   LYS  13          1HE       LYS  13   4.459 -12.733   6.775
  102   1HZ   LYS  13          1HZ       LYS  13   6.999 -11.919   7.927
  103   2HZ   LYS  13          2HZ       LYS  13   6.574 -13.369   7.151
  104   3HZ   LYS  13          3HZ       LYS  13   6.166 -13.123   8.783
  105    H    ARG  14           H        ARG  14   5.398  -7.638   2.536
  106    HA   ARG  14           HA       ARG  14   5.993  -8.610  -0.082
  107   1HB   ARG  14          2HB       ARG  14   3.579  -9.609   1.206
  108   2HB   ARG  14          1HB       ARG  14   3.201  -8.770  -0.299
  109   1HG   ARG  14          2HG       ARG  14   5.448 -10.265  -0.950
  110   2HG   ARG  14          1HG       ARG  14   4.533 -11.341   0.107
  111   1HD   ARG  14          2HD       ARG  14   2.586 -11.219  -1.292
  112   2HD   ARG  14          1HD       ARG  14   3.264  -9.868  -2.224
  113    HE   ARG  14           HE       ARG  14   4.056 -12.695  -2.469
  114   1HH1  ARG  14          1HH2      ARG  14   3.723 -10.011  -4.276
  115   2HH1  ARG  14          2HH2      ARG  14   5.291 -10.037  -5.011
  116   1HH2  ARG  14          1HH1      ARG  14   6.546 -12.467  -2.883
  117   2HH2  ARG  14          2HH1      ARG  14   6.887 -11.425  -4.225
  118    H    ILE  15           H        ILE  15   3.813  -7.477  -1.501
  119    HA   ILE  15           HA       ILE  15   3.954  -4.605  -0.642
  120    HB   ILE  15           HB       ILE  15   3.657  -4.305  -3.220
  121   1HG1  ILE  15          2HG1      ILE  15   3.203  -6.888  -3.358
  122   2HG1  ILE  15          1HG1      ILE  15   4.157  -6.114  -4.620
  123   1HG2  ILE  15          1HG2      ILE  15   5.746  -3.592  -2.745
  124   2HG2  ILE  15          2HG2      ILE  15   6.282  -5.182  -3.283
  125   3HG2  ILE  15          3HG2      ILE  15   6.004  -4.878  -1.568
  126   1HD1  ILE  15          1HD1      ILE  15   4.956  -8.320  -3.174
  127   2HD1  ILE  15          2HD1      ILE  15   5.758  -7.003  -2.316
  128   3HD1  ILE  15          3HD1      ILE  15   6.043  -7.235  -4.041
  129    H    CYS  16           H        CYS  16   1.967  -7.279  -1.509
  130    HA   CYS  16           HA       CYS  16  -0.467  -5.540  -1.361
  131   1HB   CYS  16          2HB       CYS  16   0.429  -6.584  -3.646
  132   2HB   CYS  16          1HB       CYS  16  -0.406  -8.011  -3.044
  133    H    TRP  17           H        TRP  17  -1.407  -6.153   0.568
  134    HA   TRP  17           HA       TRP  17  -1.006  -8.496   2.047
  135   1HB   TRP  17          2HB       TRP  17  -2.700  -6.223   2.020
  136   2HB   TRP  17          1HB       TRP  17  -3.755  -7.624   2.201
  137    HD1  TRP  17           HD       TRP  17  -1.913  -9.505   3.886
  138    HE1  TRP  17           1HE      TRP  17  -1.356  -8.924   6.336
  139    HE3  TRP  17           3HE      TRP  17  -2.837  -4.484   3.835
  140    HZ2  TRP  17           2HZ      TRP  17  -1.310  -6.631   8.048
  141    HZ3  TRP  17           3HZ      TRP  17  -2.530  -3.126   5.884
  142    HH2  TRP  17           HH       TRP  17  -1.767  -4.192   7.989
  143    H    TYR  18           H        TYR  18  -2.526 -10.361   2.334
  144    HA   TYR  18           HA       TYR  18  -3.222 -11.561  -0.243
  145   1HB   TYR  18          2HB       TYR  18  -2.357 -12.459   2.180
  146   2HB   TYR  18          1HB       TYR  18  -4.085 -12.788   2.317
  147    HD1  TYR  18           1HD      TYR  18  -5.191 -13.903   0.184
  148    HD2  TYR  18           2HD      TYR  18  -0.999 -14.031   1.115
  149    HE1  TYR  18           1HE      TYR  18  -4.928 -15.898  -1.267
  150    HE2  TYR  18           2HE      TYR  18  -0.737 -16.026  -0.336
  151    HH   TYR  18           HH       TYR  18  -1.795 -17.565  -1.548
  152    H    ASN  19           H        ASN  19  -4.897  -9.887   2.334
  153    HA   ASN  19           HA       ASN  19  -7.569 -10.800   1.517
  154   1HB   ASN  19          2HB       ASN  19  -6.277  -9.489   3.724
  155   2HB   ASN  19          1HB       ASN  19  -7.627  -8.488   3.186
  156   1HD2  ASN  19          1HD2      ASN  19  -9.769  -9.753   2.861
  157   2HD2  ASN  19          2HD2      ASN  19 -10.097 -11.010   3.953
  158    H    ASN  20           H        ASN  20  -9.077  -9.532   0.359
  159    HA   ASN  20           HA       ASN  20  -7.954  -7.505  -1.429
  160   1HB   ASN  20          2HB       ASN  20 -10.337  -7.542  -2.276
  161   2HB   ASN  20          1HB       ASN  20  -9.563  -9.127  -2.236
  162   1HD2  ASN  20          1HD2      ASN  20 -10.783 -10.728  -1.234
  163   2HD2  ASN  20          2HD2      ASN  20 -11.998 -10.452  -0.083
  164    H    LYS  21           H        LYS  21  -8.755  -7.245   1.713
  165    HA   LYS  21           HA       LYS  21  -9.822  -4.463   1.358
  166   1HB   LYS  21          2HB       LYS  21 -11.587  -6.008   2.067
  167   2HB   LYS  21          1HB       LYS  21 -10.582  -6.571   3.403
  168   1HG   LYS  21          2HG       LYS  21 -10.517  -4.160   4.214
  169   2HG   LYS  21          1HG       LYS  21 -11.769  -3.813   3.022
  170   1HD   LYS  21          2HD       LYS  21 -12.067  -6.037   5.045
  171   2HD   LYS  21          1HD       LYS  21 -12.570  -4.384   5.396
  172   1HE   LYS  21          2HE       LYS  21 -14.158  -4.392   3.580
  173   2HE   LYS  21          1HE       LYS  21 -13.531  -5.937   2.971
  174   1HZ   LYS  21          1HZ       LYS  21 -14.032  -6.823   5.273
  175   2HZ   LYS  21          2HZ       LYS  21 -15.377  -6.507   4.283
  176   3HZ   LYS  21          3HZ       LYS  21 -14.953  -5.419   5.518
  177    H    TYR  22           H        TYR  22  -7.561  -6.586   2.933
  178    HA   TYR  22           HA       TYR  22  -6.908  -5.074   5.250
  179   1HB   TYR  22          2HB       TYR  22  -5.989  -7.335   3.792
  180   2HB   TYR  22          1HB       TYR  22  -4.590  -6.294   4.050
  181    HD1  TYR  22           1HD      TYR  22  -5.614  -4.990   6.636
  182    HD2  TYR  22           2HD      TYR  22  -5.397  -9.082   5.346
  183    HE1  TYR  22           1HE      TYR  22  -5.504  -5.729   9.000
  184    HE2  TYR  22           2HE      TYR  22  -5.288  -9.820   7.712
  185    HH   TYR  22           HH       TYR  22  -4.505  -7.907  10.198
  186    H    CYS  23           H        CYS  23  -6.454  -4.318   1.930
  187    HA   CYS  23           HA       CYS  23  -4.267  -2.379   2.551
  188   1HB   CYS  23          2HB       CYS  23  -4.757  -4.187   0.480
  189   2HB   CYS  23          1HB       CYS  23  -5.152  -2.619  -0.224
  190    H    ASN  24           H        ASN  24  -7.620  -2.603   1.481
  191    HA   ASN  24           HA       ASN  24  -7.894   0.181   0.675
  192   1HB   ASN  24          2HB       ASN  24  -9.319  -1.787  -0.015
  193   2HB   ASN  24          1HB       ASN  24  -9.971  -1.827   1.623
  194   1HD2  ASN  24          1HD2      ASN  24 -11.471  -1.213  -0.877
  195   2HD2  ASN  24          2HD2      ASN  24 -12.098   0.350  -0.672
  196    H    ASP  25           H        ASP  25  -8.972  -1.642   3.582
  197    HA   ASP  25           HA       ASP  25  -9.996   0.525   5.074
  198   1HB   ASP  25          2HB       ASP  25  -9.969  -2.036   5.481
  199   2HB   ASP  25          1HB       ASP  25  -8.405  -1.761   6.250
  200    H    LEU  26           H        LEU  26  -6.650  -0.707   4.875
  201    HA   LEU  26           HA       LEU  26  -5.581   1.215   6.768
  202   1HB   LEU  26          2HB       LEU  26  -4.018  -0.423   6.628
  203   2HB   LEU  26          1HB       LEU  26  -4.769  -1.068   5.174
  204    HG   LEU  26           HG       LEU  26  -3.559   0.667   3.838
  205   1HD1  LEU  26          1HD1      LEU  26  -2.633   2.411   4.918
  206   2HD1  LEU  26          2HD1      LEU  26  -1.486   1.306   5.673
  207   3HD1  LEU  26          3HD1      LEU  26  -3.013   1.676   6.476
  208   1HD2  LEU  26          1HD2      LEU  26  -2.520  -1.462   3.854
  209   2HD2  LEU  26          2HD2      LEU  26  -2.040  -1.310   5.544
  210   3HD2  LEU  26          3HD2      LEU  26  -1.225  -0.354   4.307
  211    H    CYS  27           H        CYS  27  -5.750   1.018   3.215
  212    HA   CYS  27           HA       CYS  27  -4.228   3.350   2.617
  213   1HB   CYS  27          2HB       CYS  27  -6.296   1.629   1.329
  214   2HB   CYS  27          1HB       CYS  27  -6.002   3.202   0.589
  215    H    LYS  28           H        LYS  28  -7.685   2.912   3.353
  216    HA   LYS  28           HA       LYS  28  -8.540   5.590   2.843
  217   1HB   LYS  28          2HB       LYS  28  -9.519   3.595   4.915
  218   2HB   LYS  28          1HB       LYS  28 -10.455   4.918   4.220
  219   1HG   LYS  28          2HG       LYS  28  -9.237   3.099   2.238
  220   2HG   LYS  28          1HG       LYS  28 -10.473   2.359   3.256
  221   1HD   LYS  28          2HD       LYS  28 -11.197   5.038   2.289
  222   2HD   LYS  28          1HD       LYS  28 -10.983   3.854   0.999
  223   1HE   LYS  28          2HE       LYS  28 -13.330   3.878   1.851
  224   2HE   LYS  28          1HE       LYS  28 -12.547   2.314   2.151
  225   1HZ   LYS  28          1HZ       LYS  28 -12.124   2.856   4.362
  226   2HZ   LYS  28          2HZ       LYS  28 -13.701   3.441   4.115
  227   3HZ   LYS  28          3HZ       LYS  28 -12.385   4.514   4.116
  228    H    GLY  29           H        GLY  29  -6.908   4.099   5.584
  229   1HA   GLY  29          2HA       GLY  29  -7.361   6.135   7.527
  230   2HA   GLY  29          1HA       GLY  29  -5.955   5.063   7.504
  231    H    LEU  30           H        LEU  30  -5.107   5.843   4.847
  232    HA   LEU  30           HA       LEU  30  -3.767   8.395   5.549
  233   1HB   LEU  30          2HB       LEU  30  -3.411   6.236   3.455
  234   2HB   LEU  30          1HB       LEU  30  -2.463   7.725   3.438
  235    HG   LEU  30           HG       LEU  30  -2.648   5.957   5.883
  236   1HD1  LEU  30          1HD1      LEU  30  -1.674   4.867   3.720
  237   2HD1  LEU  30          2HD1      LEU  30  -0.737   4.767   5.210
  238   3HD1  LEU  30          3HD1      LEU  30  -0.313   5.958   3.980
  239   1HD2  LEU  30          1HD2      LEU  30  -1.792   8.010   6.566
  240   2HD2  LEU  30          2HD2      LEU  30  -1.048   8.336   5.002
  241   3HD2  LEU  30          3HD2      LEU  30  -0.306   7.180   6.106
  242    H    LYS  31           H        LYS  31  -6.668   7.961   4.491
  243    HA   LYS  31           HA       LYS  31  -8.124   9.387   3.284
  244   1HB   LYS  31          2HB       LYS  31  -6.156  11.011   3.812
  245   2HB   LYS  31          1HB       LYS  31  -5.682  10.732   2.135
  246   1HG   LYS  31          2HG       LYS  31  -7.223  12.215   1.454
  247   2HG   LYS  31          1HG       LYS  31  -8.489  11.211   2.159
  248   1HD   LYS  31          2HD       LYS  31  -8.667  13.373   3.193
  249   2HD   LYS  31          1HD       LYS  31  -7.954  12.293   4.394
  250   1HE   LYS  31          2HE       LYS  31  -6.255  13.790   4.571
  251   2HE   LYS  31          1HE       LYS  31  -5.767  13.310   2.933
  252   1HZ   LYS  31          1HZ       LYS  31  -7.724  15.424   3.663
  253   2HZ   LYS  31          2HZ       LYS  31  -7.458  14.877   2.076
  254   3HZ   LYS  31          3HZ       LYS  31  -6.211  15.652   2.930
  255    H    ALA  32           H        ALA  32  -6.305   6.998   2.117
  256    HA   ALA  32           HA       ALA  32  -6.549   7.583  -0.768
  257   1HB   ALA  32          1HB       ALA  32  -5.749   5.018   0.627
  258   2HB   ALA  32          2HB       ALA  32  -4.638   6.371   0.429
  259   3HB   ALA  32          3HB       ALA  32  -5.292   5.555  -0.988
  260    H    ASP  33           H        ASP  33  -8.933   7.775  -0.718
  261    HA   ASP  33           HA       ASP  33 -10.839   5.975   0.170
  262   1HB   ASP  33          2HB       ASP  33 -10.647   7.482  -2.452
  263   2HB   ASP  33          1HB       ASP  33 -12.140   6.786  -1.821
  264    H    SER  34           H        SER  34  -9.954   5.879  -3.267
  265    HA   SER  34           HA       SER  34 -10.765   3.130  -3.576
  266   1HB   SER  34          2HB       SER  34 -10.700   4.999  -5.289
  267   2HB   SER  34          1HB       SER  34  -8.951   4.799  -5.338
  268    HG   SER  34           HG       SER  34 -10.572   2.536  -5.614
  269    H    GLY  35           H        GLY  35  -9.498   1.898  -2.019
  270   1HA   GLY  35          2HA       GLY  35  -6.631   1.609  -2.818
  271   2HA   GLY  35          1HA       GLY  35  -7.160   1.471  -1.138
  272    H    TYR  36           H        TYR  36  -6.448  -0.307  -3.891
  273    HA   TYR  36           HA       TYR  36  -7.927  -2.669  -2.786
  274   1HB   TYR  36          2HB       TYR  36  -8.562  -3.270  -5.027
  275   2HB   TYR  36          1HB       TYR  36  -8.939  -1.557  -4.848
  276    HD1  TYR  36           1HD      TYR  36  -7.296   0.166  -5.723
  277    HD2  TYR  36           2HD      TYR  36  -6.970  -4.020  -6.627
  278    HE1  TYR  36           1HE      TYR  36  -5.794   0.693  -7.624
  279    HE2  TYR  36           2HE      TYR  36  -5.469  -3.492  -8.528
  280    HH   TYR  36           HH       TYR  36  -4.318  -1.895  -9.570
  281    H    CYS  37           H        CYS  37  -6.857  -4.709  -3.171
  282    HA   CYS  37           HA       CYS  37  -3.925  -4.426  -3.690
  283   1HB   CYS  37          2HB       CYS  37  -5.274  -5.410  -1.544
  284   2HB   CYS  37          1HB       CYS  37  -5.076  -6.885  -2.490
  285    H    TRP  38           H        TRP  38  -3.329  -5.126  -5.717
  286    HA   TRP  38           HA       TRP  38  -5.091  -6.930  -7.243
  287   1HB   TRP  38          2HB       TRP  38  -3.691  -4.841  -7.993
  288   2HB   TRP  38          1HB       TRP  38  -2.354  -5.988  -8.072
  289    HD1  TRP  38           HD       TRP  38  -2.157  -7.352 -10.214
  290    HE1  TRP  38           1HE      TRP  38  -3.691  -7.846 -12.226
  291    HE3  TRP  38           3HE      TRP  38  -6.468  -5.127  -8.611
  292    HZ2  TRP  38           2HZ      TRP  38  -6.385  -7.367 -13.046
  293    HZ3  TRP  38           3HZ      TRP  38  -8.502  -5.164 -10.028
  294    HH2  TRP  38           HH       TRP  38  -8.466  -6.281 -12.241
  295    H    GLY  39           H        GLY  39  -4.935  -9.008  -6.341
  296   1HA   GLY  39          2HA       GLY  39  -2.423 -10.176  -5.502
  297   2HA   GLY  39          1HA       GLY  39  -3.940 -11.048  -5.724
  298    H    TRP  40           H        TRP  40  -1.416  -9.449  -7.699
  299    HA   TRP  40           HA       TRP  40  -1.224 -11.854  -9.393
  300   1HB   TRP  40          2HB       TRP  40  -3.180 -10.677 -10.287
  301   2HB   TRP  40          1HB       TRP  40  -2.255  -9.189 -10.408
  302    HD1  TRP  40           HD       TRP  40  -1.464  -8.758 -12.770
  303    HE1  TRP  40           1HE      TRP  40  -0.744 -10.213 -14.765
  304    HE3  TRP  40           3HE      TRP  40  -1.996 -13.387 -10.715
  305    HZ2  TRP  40           2HZ      TRP  40  -0.423 -12.988 -15.412
  306    HZ3  TRP  40           3HZ      TRP  40  -1.480 -15.425 -12.034
  307    HH2  TRP  40           HH       TRP  40  -0.693 -15.230 -14.380
  308    H    THR  41           H        THR  41  -0.520  -8.607 -10.535
  309    HA   THR  41           HA       THR  41   2.357  -8.903  -9.811
  310    HB   THR  41           HB       THR  41   2.924  -8.488 -12.211
  311    HG1  THR  41           1HG      THR  41   1.069  -8.901 -13.650
  312   1HG2  THR  41          1HG2      THR  41   1.114 -10.871 -11.726
  313   2HG2  THR  41          2HG2      THR  41   2.831 -10.792 -11.335
  314   3HG2  THR  41          3HG2      THR  41   2.306 -10.734 -13.018
  315    H    LEU  42           H        LEU  42  -0.039  -7.036  -9.232
  316    HA   LEU  42           HA       LEU  42   1.287  -4.485 -10.096
  317   1HB   LEU  42          2HB       LEU  42  -1.512  -5.474 -10.041
  318   2HB   LEU  42          1HB       LEU  42  -1.283  -3.796  -9.550
  319    HG   LEU  42           HG       LEU  42   0.212  -4.615 -11.969
  320   1HD1  LEU  42          1HD1      LEU  42  -1.606  -4.837 -13.418
  321   2HD1  LEU  42          2HD1      LEU  42  -2.721  -4.055 -12.299
  322   3HD1  LEU  42          3HD1      LEU  42  -2.180  -5.706 -11.996
  323   1HD2  LEU  42          1HD2      LEU  42   0.101  -2.379 -12.365
  324   2HD2  LEU  42          2HD2      LEU  42  -0.463  -2.260 -10.699
  325   3HD2  LEU  42          3HD2      LEU  42  -1.628  -2.318 -12.021
  326    H    SER  43           H        SER  43   1.160  -6.388  -7.482
  327    HA   SER  43           HA       SER  43   1.166  -6.011  -5.152
  328   1HB   SER  43          2HB       SER  43   2.122  -3.330  -6.194
  329   2HB   SER  43          1HB       SER  43   2.451  -3.993  -4.597
  330    HG   SER  43           HG       SER  43   3.693  -4.459  -6.952
  331    H    CYS  44           H        CYS  44   0.575  -3.890  -3.550
  332    HA   CYS  44           HA       CYS  44  -2.309  -3.556  -3.912
  333   1HB   CYS  44          2HB       CYS  44  -1.179  -3.880  -1.722
  334   2HB   CYS  44          1HB       CYS  44  -0.334  -2.351  -1.945
  335    H    TYR  45           H        TYR  45  -3.369  -1.485  -4.281
  336    HA   TYR  45           HA       TYR  45  -1.605   0.785  -5.054
  337   1HB   TYR  45          2HB       TYR  45  -2.091  -0.848  -6.975
  338   2HB   TYR  45          1HB       TYR  45  -3.758  -0.279  -6.886
  339    HD1  TYR  45           1HD      TYR  45  -0.569   1.607  -6.378
  340    HD2  TYR  45           2HD      TYR  45  -4.065   1.045  -8.809
  341    HE1  TYR  45           1HE      TYR  45   0.038   3.606  -7.714
  342    HE2  TYR  45           2HE      TYR  45  -3.458   3.044 -10.145
  343    HH   TYR  45           HH       TYR  45  -0.838   4.269 -10.527
  344    H    CYS  46           H        CYS  46  -2.465   2.596  -4.152
  345    HA   CYS  46           HA       CYS  46  -5.448   2.829  -3.953
  346   1HB   CYS  46          2HB       CYS  46  -3.334   3.624  -1.916
  347   2HB   CYS  46          1HB       CYS  46  -5.065   3.898  -1.747
  348    H    GLN  47           H        GLN  47  -6.229   4.907  -4.476
  349    HA   GLN  47           HA       GLN  47  -4.153   6.892  -5.346
  350   1HB   GLN  47          2HB       GLN  47  -6.907   6.163  -6.376
  351   2HB   GLN  47          1HB       GLN  47  -6.053   7.612  -6.905
  352   1HG   GLN  47          2HG       GLN  47  -5.090   6.293  -8.469
  353   2HG   GLN  47          1HG       GLN  47  -4.129   5.630  -7.147
  354   1HE2  GLN  47          1HE2      GLN  47  -5.260   4.249  -9.612
  355   2HE2  GLN  47          2HE2      GLN  47  -6.168   2.952  -9.002
  356    H    GLY  48           H        GLY  48  -4.232   8.867  -4.319
  357   1HA   GLY  48          2HA       GLY  48  -5.521  10.779  -3.478
  358   2HA   GLY  48          1HA       GLY  48  -6.773   9.649  -2.963
  359    H    LEU  49           H        LEU  49  -3.256   9.423  -2.446
  360    HA   LEU  49           HA       LEU  49  -3.829   9.220   0.485
  361   1HB   LEU  49          2HB       LEU  49  -1.094   8.623  -0.234
  362   2HB   LEU  49          1HB       LEU  49  -2.306   7.546   0.442
  363    HG   LEU  49           HG       LEU  49  -1.957   8.167  -2.509
  364   1HD1  LEU  49          1HD1      LEU  49  -0.229   6.708  -2.186
  365   2HD1  LEU  49          2HD1      LEU  49  -1.523   5.513  -2.242
  366   3HD1  LEU  49          3HD1      LEU  49  -0.910   6.075  -0.688
  367   1HD2  LEU  49          1HD2      LEU  49  -4.264   7.399  -1.239
  368   2HD2  LEU  49          2HD2      LEU  49  -3.540   5.836  -1.614
  369   3HD2  LEU  49          3HD2      LEU  49  -3.873   6.986  -2.909
  370    HA   PRO  50           HA       PRO  50  -1.400  12.815   1.254
  371   1HB   PRO  50          2HB       PRO  50   0.247  12.105   3.313
  372   2HB   PRO  50          1HB       PRO  50  -1.508  12.268   3.501
  373   1HG   PRO  50          2HG       PRO  50   0.148   9.847   3.413
  374   2HG   PRO  50          1HG       PRO  50  -1.455  10.094   4.114
  375   1HD   PRO  50          2HD       PRO  50  -0.816   8.860   1.630
  376   2HD   PRO  50          1HD       PRO  50  -2.427   9.201   2.288
  377    H    ASP  51           H        ASP  51   0.773  13.838   1.075
  378    HA   ASP  51           HA       ASP  51   2.411  12.734  -0.975
  379   1HB   ASP  51          2HB       ASP  51   2.249  15.123  -0.354
  380   2HB   ASP  51          1HB       ASP  51   3.027  14.775   1.190
  381    H    ASN  52           H        ASN  52   2.309  12.129   2.429
  382    HA   ASN  52           HA       ASN  52   5.013  10.876   2.414
  383   1HB   ASN  52          2HB       ASN  52   3.674  12.447   4.211
  384   2HB   ASN  52          1HB       ASN  52   3.319  10.838   4.839
  385   1HD2  ASN  52          1HD2      ASN  52   5.002   9.742   5.936
  386   2HD2  ASN  52          2HD2      ASN  52   6.587  10.335   6.066
  387    H    ALA  53           H        ALA  53   2.398   9.830   1.120
  388    HA   ALA  53           HA       ALA  53   1.406   7.592   2.575
  389   1HB   ALA  53          1HB       ALA  53   0.136   7.535   0.710
  390   2HB   ALA  53          2HB       ALA  53   1.539   7.104  -0.267
  391   3HB   ALA  53          3HB       ALA  53   1.157   8.800   0.025
  392    H    ARG  54           H        ARG  54   2.203   5.515   2.859
  393    HA   ARG  54           HA       ARG  54   5.013   5.000   2.254
  394   1HB   ARG  54          2HB       ARG  54   3.311   4.263   4.202
  395   2HB   ARG  54          1HB       ARG  54   3.125   2.864   3.144
  396   1HG   ARG  54          2HG       ARG  54   5.579   2.550   3.137
  397   2HG   ARG  54          1HG       ARG  54   5.751   3.931   4.221
  398   1HD   ARG  54          2HD       ARG  54   5.790   1.906   5.576
  399   2HD   ARG  54          1HD       ARG  54   4.233   2.710   5.857
  400    HE   ARG  54           HE       ARG  54   4.639   0.288   4.179
  401   1HH1  ARG  54          1HH2      ARG  54   2.732   1.096   6.614
  402   2HH1  ARG  54          2HH2      ARG  54   1.209   0.988   5.795
  403   1HH2  ARG  54          1HH1      ARG  54   2.620   0.844   2.630
  404   2HH2  ARG  54          2HH1      ARG  54   1.146   0.846   3.539
  405    H    ILE  55           H        ILE  55   5.777   3.974   0.432
  406    HA   ILE  55           HA       ILE  55   3.858   2.319  -1.178
  407    HB   ILE  55           HB       ILE  55   5.924   4.220  -2.315
  408   1HG1  ILE  55          2HG1      ILE  55   4.268   5.438  -0.860
  409   2HG1  ILE  55          1HG1      ILE  55   4.179   5.890  -2.564
  410   1HG2  ILE  55          1HG2      ILE  55   4.265   4.113  -4.258
  411   2HG2  ILE  55          2HG2      ILE  55   3.499   2.778  -3.401
  412   3HG2  ILE  55          3HG2      ILE  55   5.173   2.637  -3.936
  413   1HD1  ILE  55          1HD1      ILE  55   2.066   5.115  -2.753
  414   2HD1  ILE  55          2HD1      ILE  55   2.050   5.013  -0.992
  415   3HD1  ILE  55          3HD1      ILE  55   2.478   3.597  -1.954
  416    H    LYS  56           H        LYS  56   5.294   1.088  -2.938
  417    HA   LYS  56           HA       LYS  56   7.208  -0.547  -1.533
  418   1HB   LYS  56          2HB       LYS  56   7.577  -1.435  -3.871
  419   2HB   LYS  56          1HB       LYS  56   5.878  -1.374  -3.397
  420   1HG   LYS  56          2HG       LYS  56   5.421   0.453  -4.772
  421   2HG   LYS  56          1HG       LYS  56   7.101   0.989  -4.787
  422   1HD   LYS  56          2HD       LYS  56   6.576  -1.699  -5.939
  423   2HD   LYS  56          1HD       LYS  56   5.967  -0.324  -6.861
  424   1HE   LYS  56          2HE       LYS  56   8.112   0.564  -7.206
  425   2HE   LYS  56          1HE       LYS  56   8.795  -0.292  -5.810
  426   1HZ   LYS  56          1HZ       LYS  56   9.273  -1.287  -8.077
  427   2HZ   LYS  56          2HZ       LYS  56   7.633  -1.728  -8.123
  428   3HZ   LYS  56          3HZ       LYS  56   8.647  -2.343  -6.907
  429    H    ARG  57           H        ARG  57   8.284   1.739  -0.904
  430    HA   ARG  57           HA       ARG  57  10.181   2.765  -2.903
  431   1HB   ARG  57          2HB       ARG  57   9.035   4.270  -1.393
  432   2HB   ARG  57          1HB       ARG  57   9.563   3.339   0.008
  433   1HG   ARG  57          2HG       ARG  57  11.697   4.181  -0.060
  434   2HG   ARG  57          1HG       ARG  57  11.679   4.371  -1.813
  435   1HD   ARG  57          2HD       ARG  57  10.232   6.137   0.194
  436   2HD   ARG  57          1HD       ARG  57  11.629   6.595  -0.801
  437    HE   ARG  57           HE       ARG  57   8.871   6.200  -1.782
  438   1HH1  ARG  57          1HH2      ARG  57  12.212   6.090  -2.567
  439   2HH1  ARG  57          2HH2      ARG  57  12.005   6.757  -4.152
  440   1HH2  ARG  57          1HH1      ARG  57   8.591   7.258  -3.784
  441   2HH2  ARG  57          2HH1      ARG  57   9.953   7.419  -4.842
  442    H    SER  58           H        SER  58  10.187   0.528  -0.201
  443    HA   SER  58           HA       SER  58  13.155   0.205  -0.534
  444   1HB   SER  58          2HB       SER  58  11.327   0.277   1.850
  445   2HB   SER  58          1HB       SER  58  12.822  -0.648   1.942
  446    HG   SER  58           HG       SER  58  12.870   1.964   0.918
  447    H    GLY  59           H        GLY  59  13.907  -2.050  -0.099
  448   1HA   GLY  59          2HA       GLY  59  11.803  -4.135  -0.266
  449   2HA   GLY  59          1HA       GLY  59  12.999  -4.080  -1.562
  450    H    ARG  60           H        ARG  60  14.231  -3.079   1.463
  451    HA   ARG  60           HA       ARG  60  15.639  -5.702   1.723
  452   1HB   ARG  60          2HB       ARG  60  16.284  -2.868   2.591
  453   2HB   ARG  60          1HB       ARG  60  17.284  -4.261   3.008
  454   1HG   ARG  60          2HG       ARG  60  18.300  -4.131   1.008
  455   2HG   ARG  60          1HG       ARG  60  16.749  -4.376   0.205
  456   1HD   ARG  60          2HD       ARG  60  17.616  -2.263  -0.589
  457   2HD   ARG  60          1HD       ARG  60  16.323  -1.872   0.563
  458    HE   ARG  60           HE       ARG  60  18.428  -1.955   2.241
  459   1HH1  ARG  60          1HH1      ARG  60  17.320   0.397   0.296
  460   2HH1  ARG  60          2HH1      ARG  60  18.830   1.200   0.021
  461   1HH2  ARG  60          1HH2      ARG  60  20.739  -1.361   1.374
  462   2HH2  ARG  60          2HH2      ARG  60  20.767   0.203   0.632
  463    H    CYS  61           H        CYS  61  13.021  -5.477   2.740
  464    HA   CYS  61           HA       CYS  61  11.745  -5.675   4.731
  465   1HB   CYS  61          2HB       CYS  61  13.162  -7.730   4.500
  466   2HB   CYS  61          1HB       CYS  61  14.362  -6.973   5.548
  467    H    ARG  62           H        ARG  62  11.418  -3.695   5.746
  468    HA   ARG  62           HA       ARG  62  13.579  -2.289   7.146
  469   1HB   ARG  62          2HB       ARG  62  10.935  -1.807   6.118
  470   2HB   ARG  62          1HB       ARG  62  10.997  -1.292   7.803
  471   1HG   ARG  62          2HG       ARG  62  12.437   0.415   7.362
  472   2HG   ARG  62          1HG       ARG  62  13.358  -0.538   6.198
  473   1HD   ARG  62          2HD       ARG  62  12.357   0.858   4.670
  474   2HD   ARG  62          1HD       ARG  62  10.981  -0.246   4.865
  475    HE   ARG  62           HE       ARG  62  11.060   2.467   5.820
  476   1HH1  ARG  62          1HH2      ARG  62   8.487   1.156   5.396
  477   2HH1  ARG  62          2HH2      ARG  62   7.925   0.834   7.003
  478   1HH2  ARG  62          1HH1      ARG  62  11.044   1.239   8.461
  479   2HH2  ARG  62          2HH1      ARG  62   9.373   0.881   8.738
  480    H    ALA  63           H        ALA  63  13.268  -4.885   8.251
  481    HA   ALA  63           HA       ALA  63  12.754  -4.219  11.046
  482   1HB   ALA  63          1HB       ALA  63  10.842  -5.767  11.285
  483   2HB   ALA  63          2HB       ALA  63  10.897  -6.101   9.554
  484   3HB   ALA  63          3HB       ALA  63  10.470  -4.489  10.128
  Start of MODEL   19
    1   1H    LYS   1          1HT       LYS   1  -3.255  15.347  -3.563
    2   2H    LYS   1          2HT       LYS   1  -2.044  14.852  -2.479
    3   3H    LYS   1          3HT       LYS   1  -3.626  15.119  -1.925
    4    HA   LYS   1           HA       LYS   1  -3.532  12.811  -2.070
    5   1HB   LYS   1          2HB       LYS   1  -5.168  12.416  -3.758
    6   2HB   LYS   1          1HB       LYS   1  -5.367  14.115  -3.327
    7   1HG   LYS   1          2HG       LYS   1  -3.961  14.769  -5.252
    8   2HG   LYS   1          1HG       LYS   1  -3.774  13.070  -5.689
    9   1HD   LYS   1          2HD       LYS   1  -6.186  12.858  -6.034
   10   2HD   LYS   1          1HD       LYS   1  -6.429  14.525  -5.510
   11   1HE   LYS   1          2HE       LYS   1  -6.104  15.197  -7.649
   12   2HE   LYS   1          1HE       LYS   1  -4.444  14.574  -7.560
   13   1HZ   LYS   1          1HZ       LYS   1  -5.752  13.464  -9.301
   14   2HZ   LYS   1          2HZ       LYS   1  -6.853  12.925  -8.126
   15   3HZ   LYS   1          3HZ       LYS   1  -5.244  12.379  -8.100
   16    H    ILE   2           H        ILE   2  -2.357  11.023  -2.753
   17    HA   ILE   2           HA       ILE   2  -0.602  11.358  -5.161
   18    HB   ILE   2           HB       ILE   2   0.514  11.709  -2.907
   19   1HG1  ILE   2          2HG1      ILE   2   1.450   9.299  -4.495
   20   2HG1  ILE   2          1HG1      ILE   2   1.745  10.978  -4.948
   21   1HG2  ILE   2          1HG2      ILE   2  -0.815  10.009  -1.682
   22   2HG2  ILE   2          2HG2      ILE   2   0.915   9.707  -1.536
   23   3HG2  ILE   2          3HG2      ILE   2  -0.058   8.741  -2.645
   24   1HD1  ILE   2          1HD1      ILE   2   2.767   9.514  -2.507
   25   2HD1  ILE   2          2HD1      ILE   2   2.823  11.270  -2.651
   26   3HD1  ILE   2          3HD1      ILE   2   3.712  10.263  -3.795
   27    H    ASP   3           H        ASP   3   0.064   9.256  -6.088
   28    HA   ASP   3           HA       ASP   3  -1.824   7.024  -5.405
   29   1HB   ASP   3          2HB       ASP   3  -0.961   8.214  -8.050
   30   2HB   ASP   3          1HB       ASP   3  -1.701   6.616  -7.944
   31    H    GLY   4           H        GLY   4  -0.926   4.919  -5.560
   32   1HA   GLY   4          2HA       GLY   4   1.406   4.073  -6.796
   33   2HA   GLY   4          1HA       GLY   4   1.971   4.771  -5.279
   34    H    TYR   5           H        TYR   5   2.556   2.235  -5.347
   35    HA   TYR   5           HA       TYR   5   0.307   0.627  -4.244
   36   1HB   TYR   5          2HB       TYR   5   3.120   0.021  -5.197
   37   2HB   TYR   5          1HB       TYR   5   2.046  -1.204  -4.519
   38    HD1  TYR   5           1HD      TYR   5   2.070   1.495  -7.126
   39    HD2  TYR   5           2HD      TYR   5   0.618  -2.371  -5.946
   40    HE1  TYR   5           1HE      TYR   5   0.961   1.240  -9.330
   41    HE2  TYR   5           2HE      TYR   5  -0.492  -2.626  -8.149
   42    HH   TYR   5           HH       TYR   5  -0.333  -0.035 -10.596
   43    HA   PRO   6           HA       PRO   6   2.144   1.719  -0.281
   44   1HB   PRO   6          2HB       PRO   6   0.003   0.893   1.209
   45   2HB   PRO   6          1HB       PRO   6   0.055   2.462   0.380
   46   1HG   PRO   6          2HG       PRO   6  -1.329  -0.047  -0.403
   47   2HG   PRO   6          1HG       PRO   6  -1.844   1.635  -0.596
   48   1HD   PRO   6          2HD       PRO   6  -0.796   0.100  -2.615
   49   2HD   PRO   6          1HD       PRO   6  -0.740   1.876  -2.576
   50    H    VAL   7           H        VAL   7   3.487   0.347   0.851
   51    HA   VAL   7           HA       VAL   7   2.814  -2.585   0.902
   52    HB   VAL   7           HB       VAL   7   5.348  -2.812   0.990
   53   1HG1  VAL   7          1HG1      VAL   7   4.724  -1.255  -1.479
   54   2HG1  VAL   7          2HG1      VAL   7   3.707  -2.657  -1.138
   55   3HG1  VAL   7          3HG1      VAL   7   5.451  -2.853  -1.312
   56   1HG2  VAL   7          1HG2      VAL   7   5.252   0.120   0.209
   57   2HG2  VAL   7          2HG2      VAL   7   6.693  -0.874   0.428
   58   3HG2  VAL   7          3HG2      VAL   7   5.691  -0.454   1.818
   59    H    ASP   8           H        ASP   8   4.632  -3.429   2.759
   60    HA   ASP   8           HA       ASP   8   3.475  -2.641   5.273
   61   1HB   ASP   8          2HB       ASP   8   5.062  -4.677   4.232
   62   2HB   ASP   8          1HB       ASP   8   6.133  -3.862   5.370
   63    H    TYR   9           H        TYR   9   5.280  -2.103   7.107
   64    HA   TYR   9           HA       TYR   9   6.233   0.591   6.481
   65   1HB   TYR   9          2HB       TYR   9   5.675  -1.114   8.764
   66   2HB   TYR   9          1HB       TYR   9   7.224  -0.296   8.969
   67    HD1  TYR   9           1HD      TYR   9   6.625   2.203   7.360
   68    HD2  TYR   9           2HD      TYR   9   4.326   0.095  10.313
   69    HE1  TYR   9           1HE      TYR   9   5.437   4.303   7.936
   70    HE2  TYR   9           2HE      TYR   9   3.138   2.194  10.887
   71    HH   TYR   9           HH       TYR   9   3.477   4.601  10.724
   72    H    TRP  10           H        TRP  10   7.509  -2.498   6.008
   73    HA   TRP  10           HA       TRP  10  10.272  -1.369   5.839
   74   1HB   TRP  10          2HB       TRP  10   9.606  -4.124   6.901
   75   2HB   TRP  10          1HB       TRP  10  11.139  -3.262   7.024
   76    HD1  TRP  10           HD       TRP  10  11.288  -1.240   8.771
   77    HE1  TRP  10           1HE      TRP  10   9.882  -0.682  10.860
   78    HE3  TRP  10           3HE      TRP  10   7.249  -4.241   7.936
   79    HZ2  TRP  10           2HZ      TRP  10   7.373  -1.415  12.023
   80    HZ3  TRP  10           3HZ      TRP  10   5.363  -4.295   9.546
   81    HH2  TRP  10           HH       TRP  10   5.420  -2.887  11.587
   82    H    ASN  11           H        ASN  11   7.784  -2.750   4.185
   83    HA   ASN  11           HA       ASN  11   7.645  -3.818   2.082
   84   1HB   ASN  11          2HB       ASN  11  10.619  -3.228   2.078
   85   2HB   ASN  11          1HB       ASN  11   9.585  -3.451   0.664
   86   1HD2  ASN  11          1HD2      ASN  11  10.638  -1.122   0.322
   87   2HD2  ASN  11          2HD2      ASN  11   9.721   0.179   0.911
   88    H    CYS  12           H        CYS  12   8.941  -5.180   4.695
   89    HA   CYS  12           HA       CYS  12  10.508  -7.341   3.546
   90   1HB   CYS  12          2HB       CYS  12  10.482  -6.247   5.923
   91   2HB   CYS  12          1HB       CYS  12   9.174  -7.388   6.238
   92    H    LYS  13           H        LYS  13   7.385  -7.457   5.301
   93    HA   LYS  13           HA       LYS  13   6.543  -9.611   3.394
   94   1HB   LYS  13          2HB       LYS  13   7.464 -10.618   5.417
   95   2HB   LYS  13          1HB       LYS  13   6.428  -9.604   6.423
   96   1HG   LYS  13          2HG       LYS  13   4.939 -11.092   4.384
   97   2HG   LYS  13          1HG       LYS  13   5.787 -12.140   5.523
   98   1HD   LYS  13          2HD       LYS  13   4.752 -10.253   7.209
   99   2HD   LYS  13          1HD       LYS  13   3.496 -10.335   5.974
  100   1HE   LYS  13          2HE       LYS  13   3.734 -12.928   6.240
  101   2HE   LYS  13          1HE       LYS  13   4.490 -12.522   7.794
  102   1HZ   LYS  13          1HZ       LYS  13   2.571 -11.762   8.626
  103   2HZ   LYS  13          2HZ       LYS  13   1.826 -12.641   7.378
  104   3HZ   LYS  13          3HZ       LYS  13   2.128 -10.980   7.188
  105    H    ARG  14           H        ARG  14   4.946  -8.344   2.376
  106    HA   ARG  14           HA       ARG  14   2.361  -8.218   3.436
  107   1HB   ARG  14          2HB       ARG  14   4.162  -6.253   4.540
  108   2HB   ARG  14          1HB       ARG  14   2.847  -5.442   3.688
  109   1HG   ARG  14          2HG       ARG  14   2.186  -7.747   5.478
  110   2HG   ARG  14          1HG       ARG  14   2.550  -6.185   6.212
  111   1HD   ARG  14          2HD       ARG  14   0.855  -5.242   4.442
  112   2HD   ARG  14          1HD       ARG  14   0.280  -6.921   4.374
  113    HE   ARG  14           HE       ARG  14  -0.294  -5.155   6.508
  114   1HH1  ARG  14          1HH1      ARG  14  -0.663  -8.307   5.799
  115   2HH1  ARG  14          2HH1      ARG  14  -0.393  -8.932   7.391
  116   1HH2  ARG  14          1HH2      ARG  14   0.808  -5.931   8.651
  117   2HH2  ARG  14          2HH2      ARG  14   0.440  -7.585   9.008
  118    H    ILE  15           H        ILE  15   3.665  -5.209   2.104
  119    HA   ILE  15           HA       ILE  15   3.294  -4.196  -0.002
  120    HB   ILE  15           HB       ILE  15   3.673  -7.138  -0.568
  121   1HG1  ILE  15          2HG1      ILE  15   5.504  -5.076  -1.632
  122   2HG1  ILE  15          1HG1      ILE  15   5.429  -5.155   0.129
  123   1HG2  ILE  15          1HG2      ILE  15   2.643  -5.073  -2.362
  124   2HG2  ILE  15          2HG2      ILE  15   2.742  -6.818  -2.602
  125   3HG2  ILE  15          3HG2      ILE  15   4.137  -5.798  -2.958
  126   1HD1  ILE  15          1HD1      ILE  15   5.585  -7.768  -1.258
  127   2HD1  ILE  15          2HD1      ILE  15   6.396  -7.223   0.210
  128   3HD1  ILE  15          3HD1      ILE  15   7.027  -6.761  -1.371
  129    H    CYS  16           H        CYS  16   1.655  -7.211  -0.791
  130    HA   CYS  16           HA       CYS  16  -0.963  -5.744  -0.858
  131   1HB   CYS  16          2HB       CYS  16  -0.101  -6.182  -3.091
  132   2HB   CYS  16          1HB       CYS  16   0.195  -7.869  -2.689
  133    H    TRP  17           H        TRP  17  -2.503  -6.686   0.441
  134    HA   TRP  17           HA       TRP  17  -1.957  -9.091   1.951
  135   1HB   TRP  17          2HB       TRP  17  -3.553  -6.933   2.229
  136   2HB   TRP  17          1HB       TRP  17  -4.733  -8.072   1.578
  137    HD1  TRP  17           HD       TRP  17  -1.894  -8.348   4.210
  138    HE1  TRP  17           1HE      TRP  17  -2.832  -9.603   6.259
  139    HE3  TRP  17           3HE      TRP  17  -6.678  -9.156   2.628
  140    HZ2  TRP  17           2HZ      TRP  17  -5.290 -10.794   7.110
  141    HZ3  TRP  17           3HZ      TRP  17  -8.296 -10.353   4.074
  142    HH2  TRP  17           HH       TRP  17  -7.611 -11.172   6.311
  143    H    TYR  18           H        TYR  18  -4.779 -10.097   1.622
  144    HA   TYR  18           HA       TYR  18  -4.375 -11.573  -0.962
  145   1HB   TYR  18          2HB       TYR  18  -4.456 -12.476   1.676
  146   2HB   TYR  18          1HB       TYR  18  -6.070 -12.833   1.061
  147    HD1  TYR  18           1HD      TYR  18  -2.436 -13.285   0.362
  148    HD2  TYR  18           2HD      TYR  18  -6.439 -14.595  -0.484
  149    HE1  TYR  18           1HE      TYR  18  -1.535 -15.225  -0.896
  150    HE2  TYR  18           2HE      TYR  18  -5.539 -16.532  -1.742
  151    HH   TYR  18           HH       TYR  18  -2.541 -16.749  -2.886
  152    H    ASN  19           H        ASN  19  -6.389  -9.419   0.736
  153    HA   ASN  19           HA       ASN  19  -8.733 -10.134  -0.999
  154   1HB   ASN  19          2HB       ASN  19  -8.365  -9.374   1.837
  155   2HB   ASN  19          1HB       ASN  19  -9.716  -8.578   1.029
  156   1HD2  ASN  19          1HD2      ASN  19  -8.542 -11.829   0.172
  157   2HD2  ASN  19          2HD2      ASN  19  -9.937 -12.651   0.682
  158    H    ASN  20           H        ASN  20 -10.080  -8.170  -1.582
  159    HA   ASN  20           HA       ASN  20  -8.311  -5.999  -2.519
  160   1HB   ASN  20          2HB       ASN  20  -9.843  -6.871  -4.111
  161   2HB   ASN  20          1HB       ASN  20 -11.174  -6.862  -2.954
  162   1HD2  ASN  20          1HD2      ASN  20 -12.619  -5.202  -3.409
  163   2HD2  ASN  20          2HD2      ASN  20 -12.194  -3.672  -4.007
  164    H    LYS  21           H        LYS  21 -11.494  -6.094  -0.852
  165    HA   LYS  21           HA       LYS  21 -11.490  -3.371  -0.024
  166   1HB   LYS  21          2HB       LYS  21 -13.235  -5.418  -0.006
  167   2HB   LYS  21          1HB       LYS  21 -12.738  -5.473   1.686
  168   1HG   LYS  21          2HG       LYS  21 -13.171  -2.935   1.716
  169   2HG   LYS  21          1HG       LYS  21 -14.024  -3.185   0.193
  170   1HD   LYS  21          2HD       LYS  21 -15.667  -3.319   1.946
  171   2HD   LYS  21          1HD       LYS  21 -15.395  -4.963   1.367
  172   1HE   LYS  21          2HE       LYS  21 -14.841  -5.582   3.472
  173   2HE   LYS  21          1HE       LYS  21 -13.479  -4.444   3.429
  174   1HZ   LYS  21          1HZ       LYS  21 -14.907  -3.741   5.174
  175   2HZ   LYS  21          2HZ       LYS  21 -16.289  -3.869   4.194
  176   3HZ   LYS  21          3HZ       LYS  21 -15.139  -2.654   3.893
  177    H    TYR  22           H        TYR  22  -9.930  -6.205   1.339
  178    HA   TYR  22           HA       TYR  22  -9.474  -5.332   4.000
  179   1HB   TYR  22          2HB       TYR  22  -8.561  -7.340   2.123
  180   2HB   TYR  22          1HB       TYR  22  -7.213  -6.763   3.104
  181    HD1  TYR  22           1HD      TYR  22  -7.199  -7.048   5.531
  182    HD2  TYR  22           2HD      TYR  22 -10.485  -8.450   3.147
  183    HE1  TYR  22           1HE      TYR  22  -8.020  -8.387   7.450
  184    HE2  TYR  22           2HE      TYR  22 -11.306  -9.790   5.067
  185    HH   TYR  22           HH       TYR  22 -10.405  -9.313   8.156
  186    H    CYS  23           H        CYS  23  -7.291  -5.005   1.164
  187    HA   CYS  23           HA       CYS  23  -5.356  -3.366   2.522
  188   1HB   CYS  23          2HB       CYS  23  -5.524  -4.733   0.177
  189   2HB   CYS  23          1HB       CYS  23  -5.752  -3.085  -0.407
  190    H    ASN  24           H        ASN  24  -8.372  -2.645   0.874
  191    HA   ASN  24           HA       ASN  24  -7.952   0.164   0.418
  192   1HB   ASN  24          2HB       ASN  24  -9.737  -1.544  -0.432
  193   2HB   ASN  24          1HB       ASN  24 -10.601  -1.130   1.050
  194   1HD2  ASN  24          1HD2      ASN  24 -11.977  -0.390  -1.145
  195   2HD2  ASN  24          2HD2      ASN  24 -11.833   1.272  -1.463
  196    H    ASP  25           H        ASP  25  -9.810  -1.499   3.003
  197    HA   ASP  25           HA       ASP  25 -10.556   0.634   4.595
  198   1HB   ASP  25          2HB       ASP  25 -10.519  -2.081   4.787
  199   2HB   ASP  25          1HB       ASP  25  -9.328  -1.661   6.019
  200    H    LEU  26           H        LEU  26  -7.382  -1.034   4.776
  201    HA   LEU  26           HA       LEU  26  -6.261   0.692   6.773
  202   1HB   LEU  26          2HB       LEU  26  -5.475  -1.456   4.955
  203   2HB   LEU  26          1HB       LEU  26  -4.181  -0.278   5.181
  204    HG   LEU  26           HG       LEU  26  -5.704  -1.280   7.568
  205   1HD1  LEU  26          1HD1      LEU  26  -3.770  -2.986   7.751
  206   2HD1  LEU  26          2HD1      LEU  26  -3.557  -2.728   6.020
  207   3HD1  LEU  26          3HD1      LEU  26  -5.083  -3.364   6.635
  208   1HD2  LEU  26          1HD2      LEU  26  -3.418  -0.896   8.588
  209   2HD2  LEU  26          2HD2      LEU  26  -4.182   0.557   7.942
  210   3HD2  LEU  26          3HD2      LEU  26  -2.905  -0.248   7.030
  211    H    CYS  27           H        CYS  27  -6.145   0.788   3.203
  212    HA   CYS  27           HA       CYS  27  -4.379   3.008   2.929
  213   1HB   CYS  27          2HB       CYS  27  -6.365   1.505   1.353
  214   2HB   CYS  27          1HB       CYS  27  -6.161   3.175   0.829
  215    H    LYS  28           H        LYS  28  -7.905   2.853   3.378
  216    HA   LYS  28           HA       LYS  28  -8.428   5.655   3.088
  217   1HB   LYS  28          2HB       LYS  28  -9.859   3.751   4.959
  218   2HB   LYS  28          1HB       LYS  28 -10.550   5.078   4.025
  219   1HG   LYS  28          2HG       LYS  28  -9.310   3.375   2.145
  220   2HG   LYS  28          1HG       LYS  28 -10.187   2.318   3.253
  221   1HD   LYS  28          2HD       LYS  28 -11.623   4.763   2.386
  222   2HD   LYS  28          1HD       LYS  28 -11.362   3.537   1.143
  223   1HE   LYS  28          2HE       LYS  28 -12.203   1.898   3.077
  224   2HE   LYS  28          1HE       LYS  28 -13.006   3.378   3.642
  225   1HZ   LYS  28          1HZ       LYS  28 -14.079   3.661   1.599
  226   2HZ   LYS  28          2HZ       LYS  28 -14.240   2.001   1.919
  227   3HZ   LYS  28          3HZ       LYS  28 -13.079   2.545   0.803
  228    H    GLY  29           H        GLY  29  -7.340   3.669   5.794
  229   1HA   GLY  29          2HA       GLY  29  -7.705   5.422   7.954
  230   2HA   GLY  29          1HA       GLY  29  -6.339   4.310   7.825
  231    H    LEU  30           H        LEU  30  -5.162   5.408   5.471
  232    HA   LEU  30           HA       LEU  30  -3.763   7.693   6.664
  233   1HB   LEU  30          2HB       LEU  30  -3.599   6.363   3.937
  234   2HB   LEU  30          1HB       LEU  30  -2.409   7.484   4.600
  235    HG   LEU  30           HG       LEU  30  -3.130   5.112   6.261
  236   1HD1  LEU  30          1HD1      LEU  30  -1.514   5.022   3.707
  237   2HD1  LEU  30          2HD1      LEU  30  -2.853   3.978   4.180
  238   3HD1  LEU  30          3HD1      LEU  30  -1.297   3.843   4.999
  239   1HD2  LEU  30          1HD2      LEU  30  -1.444   6.156   7.371
  240   2HD2  LEU  30          2HD2      LEU  30  -0.964   7.076   5.945
  241   3HD2  LEU  30          3HD2      LEU  30  -0.387   5.424   6.163
  242    H    LYS  31           H        LYS  31  -6.123   7.113   4.130
  243    HA   LYS  31           HA       LYS  31  -7.718   9.223   3.977
  244   1HB   LYS  31          2HB       LYS  31  -6.021  10.874   4.300
  245   2HB   LYS  31          1HB       LYS  31  -4.988  10.160   3.062
  246   1HG   LYS  31          2HG       LYS  31  -6.256  11.021   1.315
  247   2HG   LYS  31          1HG       LYS  31  -7.721  11.117   2.292
  248   1HD   LYS  31          2HD       LYS  31  -5.981  12.808   3.624
  249   2HD   LYS  31          1HD       LYS  31  -5.597  13.101   1.928
  250   1HE   LYS  31          2HE       LYS  31  -7.378  14.619   2.422
  251   2HE   LYS  31          1HE       LYS  31  -8.165  13.271   1.577
  252   1HZ   LYS  31          1HZ       LYS  31  -8.455  14.103   4.295
  253   2HZ   LYS  31          2HZ       LYS  31  -8.006  12.468   4.196
  254   3HZ   LYS  31          3HZ       LYS  31  -9.402  13.019   3.399
  255    H    ALA  32           H        ALA  32  -6.045   6.842   2.363
  256    HA   ALA  32           HA       ALA  32  -6.790   7.580  -0.380
  257   1HB   ALA  32          1HB       ALA  32  -5.677   5.470  -0.896
  258   2HB   ALA  32          2HB       ALA  32  -5.727   4.995   0.801
  259   3HB   ALA  32          3HB       ALA  32  -4.714   6.346   0.293
  260    H    ASP  33           H        ASP  33  -8.879   7.315  -1.041
  261    HA   ASP  33           HA       ASP  33 -10.711   5.504   0.365
  262   1HB   ASP  33          2HB       ASP  33 -11.073   7.869  -0.711
  263   2HB   ASP  33          1HB       ASP  33 -11.268   6.958  -2.209
  264    H    SER  34           H        SER  34  -9.752   5.847  -3.062
  265    HA   SER  34           HA       SER  34 -10.724   3.188  -3.751
  266   1HB   SER  34          2HB       SER  34 -10.255   5.500  -5.082
  267   2HB   SER  34          1HB       SER  34  -8.770   4.635  -5.467
  268    HG   SER  34           HG       SER  34  -9.877   3.252  -6.628
  269    H    GLY  35           H        GLY  35  -9.491   1.805  -2.280
  270   1HA   GLY  35          2HA       GLY  35  -6.626   1.527  -3.097
  271   2HA   GLY  35          1HA       GLY  35  -7.150   1.298  -1.427
  272    H    TYR  36           H        TYR  36  -6.569  -0.276  -4.361
  273    HA   TYR  36           HA       TYR  36  -7.997  -2.713  -3.353
  274   1HB   TYR  36          2HB       TYR  36  -8.468  -3.239  -5.706
  275   2HB   TYR  36          1HB       TYR  36  -9.085  -1.634  -5.314
  276    HD1  TYR  36           1HD      TYR  36  -6.369  -3.495  -7.011
  277    HD2  TYR  36           2HD      TYR  36  -8.136   0.354  -6.290
  278    HE1  TYR  36           1HE      TYR  36  -4.981  -2.518  -8.818
  279    HE2  TYR  36           2HE      TYR  36  -6.745   1.330  -8.096
  280    HH   TYR  36           HH       TYR  36  -5.121  -0.524 -10.365
  281    H    CYS  37           H        CYS  37  -6.833  -4.669  -3.588
  282    HA   CYS  37           HA       CYS  37  -3.909  -4.351  -3.914
  283   1HB   CYS  37          2HB       CYS  37  -5.631  -5.782  -2.267
  284   2HB   CYS  37          1HB       CYS  37  -5.001  -7.013  -3.363
  285    H    TRP  38           H        TRP  38  -2.725  -5.298  -5.592
  286    HA   TRP  38           HA       TRP  38  -4.197  -6.171  -7.976
  287   1HB   TRP  38          2HB       TRP  38  -2.025  -4.774  -7.765
  288   2HB   TRP  38          1HB       TRP  38  -1.219  -6.314  -7.469
  289    HD1  TRP  38           HD       TRP  38  -0.558  -7.683  -9.513
  290    HE1  TRP  38           1HE      TRP  38  -1.065  -7.572 -12.038
  291    HE3  TRP  38           3HE      TRP  38  -4.084  -3.991  -9.542
  292    HZ2  TRP  38           2HZ      TRP  38  -2.744  -6.109 -13.833
  293    HZ3  TRP  38           3HZ      TRP  38  -5.120  -3.258 -11.672
  294    HH2  TRP  38           HH       TRP  38  -4.454  -4.311 -13.815
  295    H    GLY  39           H        GLY  39  -5.111  -8.222  -7.711
  296   1HA   GLY  39          2HA       GLY  39  -3.752 -10.322  -6.229
  297   2HA   GLY  39          1HA       GLY  39  -5.239 -10.512  -7.157
  298    H    TRP  40           H        TRP  40  -1.723 -10.183  -7.533
  299    HA   TRP  40           HA       TRP  40  -1.725 -12.272  -9.595
  300   1HB   TRP  40          2HB       TRP  40  -2.336 -10.410 -10.974
  301   2HB   TRP  40          1HB       TRP  40  -1.181  -9.352 -10.168
  302    HD1  TRP  40           HD       TRP  40   0.458  -8.811 -12.069
  303    HE1  TRP  40           1HE      TRP  40   1.989 -10.219 -13.587
  304    HE3  TRP  40           3HE      TRP  40  -1.200 -13.494 -10.897
  305    HZ2  TRP  40           2HZ      TRP  40   2.454 -12.970 -14.222
  306    HZ3  TRP  40           3HZ      TRP  40  -0.197 -15.489 -11.970
  307    HH2  TRP  40           HH       TRP  40   1.627 -15.234 -13.629
  308    H    THR  41           H        THR  41   0.432  -9.524  -8.962
  309    HA   THR  41           HA       THR  41   2.278 -10.905  -7.253
  310    HB   THR  41           HB       THR  41   2.421 -12.212  -9.435
  311    HG1  THR  41           1HG      THR  41   4.579 -10.887  -8.229
  312   1HG2  THR  41          1HG2      THR  41   3.000 -11.203 -11.394
  313   2HG2  THR  41          2HG2      THR  41   4.112 -10.085 -10.603
  314   3HG2  THR  41          3HG2      THR  41   2.379  -9.753 -10.605
  315    H    LEU  42           H        LEU  42   1.089  -8.230  -7.656
  316    HA   LEU  42           HA       LEU  42   3.558  -6.626  -8.241
  317   1HB   LEU  42          2HB       LEU  42   0.740  -6.446  -8.931
  318   2HB   LEU  42          1HB       LEU  42   1.302  -4.960  -8.162
  319    HG   LEU  42           HG       LEU  42   2.820  -6.300 -10.407
  320   1HD1  LEU  42          1HD1      LEU  42   1.798  -4.391 -11.786
  321   2HD1  LEU  42          2HD1      LEU  42   0.617  -4.231 -10.485
  322   3HD1  LEU  42          3HD1      LEU  42   0.726  -5.738 -11.396
  323   1HD2  LEU  42          1HD2      LEU  42   3.859  -4.585  -8.762
  324   2HD2  LEU  42          2HD2      LEU  42   2.836  -3.398  -9.574
  325   3HD2  LEU  42          3HD2      LEU  42   4.057  -4.285 -10.488
  326    H    SER  43           H        SER  43   0.674  -5.569  -6.519
  327    HA   SER  43           HA       SER  43   1.505  -5.828  -3.832
  328   1HB   SER  43          2HB       SER  43   3.485  -4.634  -4.250
  329   2HB   SER  43          1HB       SER  43   2.708  -3.574  -5.421
  330    HG   SER  43           HG       SER  43   3.196  -2.772  -3.172
  331    H    CYS  44           H        CYS  44   0.452  -3.925  -2.447
  332    HA   CYS  44           HA       CYS  44  -2.302  -3.662  -3.219
  333   1HB   CYS  44          2HB       CYS  44  -1.158  -3.540  -0.908
  334   2HB   CYS  44          1HB       CYS  44  -0.777  -1.867  -1.314
  335    H    TYR  45           H        TYR  45  -3.402  -1.571  -3.770
  336    HA   TYR  45           HA       TYR  45  -1.616   0.530  -4.887
  337   1HB   TYR  45          2HB       TYR  45  -2.150  -1.348  -6.560
  338   2HB   TYR  45          1HB       TYR  45  -3.807  -0.748  -6.534
  339    HD1  TYR  45           1HD      TYR  45  -2.757  -0.637  -9.109
  340    HD2  TYR  45           2HD      TYR  45  -1.951   2.082  -5.879
  341    HE1  TYR  45           1HE      TYR  45  -2.149   1.128 -10.741
  342    HE2  TYR  45           2HE      TYR  45  -1.345   3.843  -7.515
  343    HH   TYR  45           HH       TYR  45  -1.942   3.485 -10.908
  344    H    CYS  46           H        CYS  46  -2.426   2.380  -4.003
  345    HA   CYS  46           HA       CYS  46  -5.406   2.735  -3.955
  346   1HB   CYS  46          2HB       CYS  46  -3.322   3.567  -1.903
  347   2HB   CYS  46          1HB       CYS  46  -5.036   3.965  -1.816
  348    H    GLN  47           H        GLN  47  -6.107   4.884  -4.433
  349    HA   GLN  47           HA       GLN  47  -3.956   6.751  -5.382
  350   1HB   GLN  47          2HB       GLN  47  -6.661   6.116  -6.615
  351   2HB   GLN  47          1HB       GLN  47  -5.497   7.279  -7.254
  352   1HG   GLN  47          2HG       GLN  47  -4.761   5.504  -8.481
  353   2HG   GLN  47          1HG       GLN  47  -3.918   5.069  -6.993
  354   1HE2  GLN  47          1HE2      GLN  47  -7.420   4.834  -7.822
  355   2HE2  GLN  47          2HE2      GLN  47  -7.528   3.166  -7.527
  356    H    GLY  48           H        GLY  48  -4.050   8.302  -3.752
  357   1HA   GLY  48          2HA       GLY  48  -5.454  10.453  -3.441
  358   2HA   GLY  48          1HA       GLY  48  -6.744   9.339  -2.984
  359    H    LEU  49           H        LEU  49  -3.266   9.424  -2.186
  360    HA   LEU  49           HA       LEU  49  -4.052   9.381   0.710
  361   1HB   LEU  49          2HB       LEU  49  -1.533   8.279   0.612
  362   2HB   LEU  49          1HB       LEU  49  -3.023   7.346   0.608
  363    HG   LEU  49           HG       LEU  49  -1.821   8.350  -1.973
  364   1HD1  LEU  49          1HD1      LEU  49  -0.950   5.856  -2.013
  365   2HD1  LEU  49          2HD1      LEU  49  -0.974   6.041  -0.259
  366   3HD1  LEU  49          3HD1      LEU  49   0.011   7.120  -1.246
  367   1HD2  LEU  49          1HD2      LEU  49  -3.253   6.804  -2.972
  368   2HD2  LEU  49          2HD2      LEU  49  -4.212   7.273  -1.568
  369   3HD2  LEU  49          3HD2      LEU  49  -3.292   5.768  -1.545
  370    HA   PRO  50           HA       PRO  50  -1.454  12.820   1.452
  371   1HB   PRO  50          2HB       PRO  50   0.092  12.081   3.591
  372   2HB   PRO  50          1HB       PRO  50  -1.638  12.455   3.728
  373   1HG   PRO  50          2HG       PRO  50  -0.281   9.806   3.590
  374   2HG   PRO  50          1HG       PRO  50  -1.659  10.319   4.577
  375   1HD   PRO  50          2HD       PRO  50  -1.928   8.845   2.315
  376   2HD   PRO  50          1HD       PRO  50  -3.167   9.981   2.886
  377    H    ASP  51           H        ASP  51   0.749  13.651   1.201
  378    HA   ASP  51           HA       ASP  51   2.347  12.285  -0.717
  379   1HB   ASP  51          2HB       ASP  51   2.294  14.730  -0.280
  380   2HB   ASP  51          1HB       ASP  51   3.082  14.457   1.275
  381    H    ASN  52           H        ASN  52   2.160  11.946   2.720
  382    HA   ASN  52           HA       ASN  52   4.853  10.751   2.967
  383   1HB   ASN  52          2HB       ASN  52   3.132  12.154   4.605
  384   2HB   ASN  52          1HB       ASN  52   2.943  10.500   5.185
  385   1HD2  ASN  52          1HD2      ASN  52   4.720   9.539   6.310
  386   2HD2  ASN  52          2HD2      ASN  52   6.161  10.371   6.647
  387    H    ALA  53           H        ALA  53   2.145   9.648   1.590
  388    HA   ALA  53           HA       ALA  53   1.437   7.220   2.875
  389   1HB   ALA  53          1HB       ALA  53   0.442   8.496   0.852
  390   2HB   ALA  53          2HB       ALA  53   0.395   6.735   0.801
  391   3HB   ALA  53          3HB       ALA  53   1.621   7.610  -0.114
  392    H    ARG  54           H        ARG  54   2.717   5.464   3.299
  393    HA   ARG  54           HA       ARG  54   5.355   5.167   2.081
  394   1HB   ARG  54          2HB       ARG  54   5.111   4.542   4.361
  395   2HB   ARG  54          1HB       ARG  54   3.640   3.625   4.035
  396   1HG   ARG  54          2HG       ARG  54   4.847   1.761   3.676
  397   2HG   ARG  54          1HG       ARG  54   5.771   2.576   2.414
  398   1HD   ARG  54          2HD       ARG  54   6.394   3.017   5.341
  399   2HD   ARG  54          1HD       ARG  54   7.123   1.687   4.421
  400    HE   ARG  54           HE       ARG  54   7.990   4.363   4.223
  401   1HH1  ARG  54          1HH2      ARG  54   8.595   1.593   2.686
  402   2HH1  ARG  54          2HH2      ARG  54   8.692   2.225   1.077
  403   1HH2  ARG  54          1HH1      ARG  54   7.341   5.306   1.919
  404   2HH2  ARG  54          2HH1      ARG  54   7.983   4.328   0.642
  405    H    ILE  55           H        ILE  55   5.829   3.958   0.282
  406    HA   ILE  55           HA       ILE  55   3.957   1.799  -0.554
  407    HB   ILE  55           HB       ILE  55   4.134   2.826  -2.906
  408   1HG1  ILE  55          2HG1      ILE  55   4.540   5.323  -2.835
  409   2HG1  ILE  55          1HG1      ILE  55   5.153   5.111  -1.195
  410   1HG2  ILE  55          1HG2      ILE  55   2.669   4.142  -0.615
  411   2HG2  ILE  55          2HG2      ILE  55   2.041   2.990  -1.793
  412   3HG2  ILE  55          3HG2      ILE  55   2.419   4.640  -2.288
  413   1HD1  ILE  55          1HD1      ILE  55   6.302   3.230  -3.139
  414   2HD1  ILE  55          2HD1      ILE  55   7.106   4.215  -1.916
  415   3HD1  ILE  55          3HD1      ILE  55   6.681   4.918  -3.476
  416    H    LYS  56           H        LYS  56   5.035   0.788  -2.698
  417    HA   LYS  56           HA       LYS  56   7.435  -0.480  -1.995
  418   1HB   LYS  56          2HB       LYS  56   7.558  -0.944  -4.468
  419   2HB   LYS  56          1HB       LYS  56   5.960  -1.230  -3.779
  420   1HG   LYS  56          2HG       LYS  56   5.016   0.429  -5.001
  421   2HG   LYS  56          1HG       LYS  56   6.351   1.536  -4.681
  422   1HD   LYS  56          2HD       LYS  56   6.214   0.994  -7.085
  423   2HD   LYS  56          1HD       LYS  56   7.716   0.388  -6.386
  424   1HE   LYS  56          2HE       LYS  56   6.403  -1.831  -6.015
  425   2HE   LYS  56          1HE       LYS  56   5.265  -1.171  -7.208
  426   1HZ   LYS  56          1HZ       LYS  56   7.072  -2.428  -8.266
  427   2HZ   LYS  56          2HZ       LYS  56   8.209  -1.367  -7.582
  428   3HZ   LYS  56          3HZ       LYS  56   7.088  -0.795  -8.724
  429    H    ARG  57           H        ARG  57   8.879   1.159  -1.141
  430    HA   ARG  57           HA       ARG  57  10.073   2.993  -3.191
  431   1HB   ARG  57          2HB       ARG  57   9.028   3.497  -0.713
  432   2HB   ARG  57          1HB       ARG  57  10.730   3.260  -0.315
  433   1HG   ARG  57          2HG       ARG  57   9.591   5.212  -2.328
  434   2HG   ARG  57          1HG       ARG  57  10.388   5.606  -0.804
  435   1HD   ARG  57          2HD       ARG  57  11.677   4.262  -3.208
  436   2HD   ARG  57          1HD       ARG  57  12.009   5.898  -2.605
  437    HE   ARG  57           HE       ARG  57  12.955   3.408  -1.393
  438   1HH1  ARG  57          1HH1      ARG  57  14.688   5.760  -1.398
  439   2HH1  ARG  57          2HH1      ARG  57  14.536   6.380   0.211
  440   1HH2  ARG  57          1HH2      ARG  57  11.631   4.613   0.899
  441   2HH2  ARG  57          2HH2      ARG  57  12.804   5.730   1.513
  442    H    SER  58           H        SER  58  10.682   0.425  -0.895
  443    HA   SER  58           HA       SER  58  13.531   0.296  -1.837
  444   1HB   SER  58          2HB       SER  58  12.270   0.349   0.832
  445   2HB   SER  58          1HB       SER  58  13.496  -0.900   0.636
  446    HG   SER  58           HG       SER  58  14.918   0.628   0.776
  447    H    GLY  59           H        GLY  59  14.425  -2.008  -1.487
  448   1HA   GLY  59          2HA       GLY  59  12.279  -4.030  -2.003
  449   2HA   GLY  59          1HA       GLY  59  13.792  -4.026  -2.910
  450    H    ARG  60           H        ARG  60  14.703  -3.063   0.066
  451    HA   ARG  60           HA       ARG  60  15.373  -5.861   0.893
  452   1HB   ARG  60          2HB       ARG  60  17.216  -4.644   2.123
  453   2HB   ARG  60          1HB       ARG  60  17.267  -4.435   0.371
  454   1HG   ARG  60          2HG       ARG  60  16.987  -2.209   0.563
  455   2HG   ARG  60          1HG       ARG  60  15.563  -2.428   1.580
  456   1HD   ARG  60          2HD       ARG  60  17.357  -1.194   2.784
  457   2HD   ARG  60          1HD       ARG  60  17.032  -2.761   3.554
  458    HE   ARG  60           HE       ARG  60  18.972  -3.613   2.066
  459   1HH1  ARG  60          1HH1      ARG  60  18.868  -0.341   1.672
  460   2HH1  ARG  60          2HH1      ARG  60  20.456  -0.010   2.278
  461   1HH2  ARG  60          1HH2      ARG  60  20.940  -3.216   3.511
  462   2HH2  ARG  60          2HH2      ARG  60  21.629  -1.639   3.320
  463    H    CYS  61           H        CYS  61  14.521  -6.595   2.823
  464    HA   CYS  61           HA       CYS  61  12.451  -5.434   4.258
  465   1HB   CYS  61          2HB       CYS  61  14.762  -7.229   5.041
  466   2HB   CYS  61          1HB       CYS  61  13.510  -6.810   6.209
  467    H    ARG  62           H        ARG  62  12.316  -3.588   5.486
  468    HA   ARG  62           HA       ARG  62  14.767  -2.103   6.178
  469   1HB   ARG  62          2HB       ARG  62  12.078  -1.557   5.526
  470   2HB   ARG  62          1HB       ARG  62  12.274  -1.032   7.198
  471   1HG   ARG  62          2HG       ARG  62  14.492  -0.310   5.374
  472   2HG   ARG  62          1HG       ARG  62  12.958   0.500   5.056
  473   1HD   ARG  62          2HD       ARG  62  13.491   0.447   7.910
  474   2HD   ARG  62          1HD       ARG  62  14.833   1.208   7.031
  475    HE   ARG  62           HE       ARG  62  13.365   2.966   6.462
  476   1HH1  ARG  62          1HH1      ARG  62  11.694   1.050   8.552
  477   2HH1  ARG  62          2HH1      ARG  62  10.116   1.374   7.916
  478   1HH2  ARG  62          1HH2      ARG  62  11.303   2.993   5.089
  479   2HH2  ARG  62          2HH2      ARG  62   9.895   2.474   5.954
  480    H    ALA  63           H        ALA  63  14.791  -4.471   7.607
  481    HA   ALA  63           HA       ALA  63  14.698  -3.507  10.374
  482   1HB   ALA  63          1HB       ALA  63  12.661  -4.334  10.890
  483   2HB   ALA  63          2HB       ALA  63  13.135  -5.928  10.302
  484   3HB   ALA  63          3HB       ALA  63  12.433  -4.751   9.192
  Start of MODEL   20
    1   1H    LYS   1          1HT       LYS   1  -3.047  16.184  -2.615
    2   2H    LYS   1          2HT       LYS   1  -1.905  15.895  -3.840
    3   3H    LYS   1          3HT       LYS   1  -1.508  15.593  -2.217
    4    HA   LYS   1           HA       LYS   1  -2.928  13.726  -2.090
    5   1HB   LYS   1          2HB       LYS   1  -4.599  13.336  -3.815
    6   2HB   LYS   1          1HB       LYS   1  -4.727  15.016  -3.293
    7   1HG   LYS   1          2HG       LYS   1  -3.127  15.568  -5.227
    8   2HG   LYS   1          1HG       LYS   1  -3.466  13.942  -5.818
    9   1HD   LYS   1          2HD       LYS   1  -5.805  14.414  -6.045
   10   2HD   LYS   1          1HD       LYS   1  -5.647  15.934  -5.166
   11   1HE   LYS   1          2HE       LYS   1  -4.444  16.964  -6.960
   12   2HE   LYS   1          1HE       LYS   1  -4.185  15.406  -7.770
   13   1HZ   LYS   1          1HZ       LYS   1  -6.911  16.343  -7.139
   14   2HZ   LYS   1          2HZ       LYS   1  -6.416  15.211  -8.306
   15   3HZ   LYS   1          3HZ       LYS   1  -6.134  16.868  -8.553
   16    H    ILE   2           H        ILE   2  -2.417  11.641  -3.050
   17    HA   ILE   2           HA       ILE   2  -0.648  11.580  -5.422
   18    HB   ILE   2           HB       ILE   2   0.903  12.107  -3.665
   19   1HG1  ILE   2          2HG1      ILE   2   0.859   9.105  -4.093
   20   2HG1  ILE   2          1HG1      ILE   2   1.666  10.288  -5.123
   21   1HG2  ILE   2          1HG2      ILE   2   0.857  10.318  -1.675
   22   2HG2  ILE   2          2HG2      ILE   2  -0.849  10.266  -2.116
   23   3HG2  ILE   2          3HG2      ILE   2  -0.112  11.790  -1.632
   24   1HD1  ILE   2          1HD1      ILE   2   2.912   8.985  -3.091
   25   2HD1  ILE   2          2HD1      ILE   2   2.350  10.428  -2.247
   26   3HD1  ILE   2          3HD1      ILE   2   3.392  10.583  -3.661
   27    H    ASP   3           H        ASP   3  -0.118   9.255  -5.972
   28    HA   ASP   3           HA       ASP   3  -1.882   7.224  -4.702
   29   1HB   ASP   3          2HB       ASP   3  -2.613   6.649  -7.117
   30   2HB   ASP   3          1HB       ASP   3  -3.316   8.094  -6.391
   31    H    GLY   4           H        GLY   4  -1.334   5.001  -5.592
   32   1HA   GLY   4          2HA       GLY   4   0.648   4.234  -7.308
   33   2HA   GLY   4          1HA       GLY   4   1.575   4.770  -5.907
   34    H    TYR   5           H        TYR   5   2.315   2.606  -5.505
   35    HA   TYR   5           HA       TYR   5   0.198   0.683  -4.615
   36   1HB   TYR   5          2HB       TYR   5   3.108   0.159  -5.277
   37   2HB   TYR   5          1HB       TYR   5   1.802  -1.022  -5.173
   38    HD1  TYR   5           1HD      TYR   5   3.764  -0.162  -7.560
   39    HD2  TYR   5           2HD      TYR   5  -0.342   0.615  -6.568
   40    HE1  TYR   5           1HE      TYR   5   3.252   0.190  -9.959
   41    HE2  TYR   5           2HE      TYR   5  -0.855   0.968  -8.969
   42    HH   TYR   5           HH       TYR   5   1.409   1.539 -11.265
   43    HA   PRO   6           HA       PRO   6   2.062   1.928  -0.669
   44   1HB   PRO   6          2HB       PRO   6  -0.136   1.292   0.829
   45   2HB   PRO   6          1HB       PRO   6   0.030   2.835  -0.031
   46   1HG   PRO   6          2HG       PRO   6  -1.525   0.413  -0.772
   47   2HG   PRO   6          1HG       PRO   6  -1.921   2.123  -0.997
   48   1HD   PRO   6          2HD       PRO   6  -0.980   0.488  -2.989
   49   2HD   PRO   6          1HD       PRO   6  -0.788   2.255  -2.974
   50    H    VAL   7           H        VAL   7   3.358   0.472   0.376
   51    HA   VAL   7           HA       VAL   7   2.922  -2.407   0.069
   52    HB   VAL   7           HB       VAL   7   5.073  -2.516   1.232
   53   1HG1  VAL   7          1HG1      VAL   7   6.335  -0.794  -0.190
   54   2HG1  VAL   7          2HG1      VAL   7   4.754  -0.271  -0.771
   55   3HG1  VAL   7          3HG1      VAL   7   5.301  -1.921  -1.067
   56   1HG2  VAL   7          1HG2      VAL   7   4.101  -0.234   2.549
   57   2HG2  VAL   7          2HG2      VAL   7   5.474   0.340   1.603
   58   3HG2  VAL   7          3HG2      VAL   7   5.689  -0.973   2.761
   59    H    ASP   8           H        ASP   8   3.559  -3.573   2.408
   60    HA   ASP   8           HA       ASP   8   1.174  -3.188   4.048
   61   1HB   ASP   8          2HB       ASP   8   2.272  -5.057   5.346
   62   2HB   ASP   8          1HB       ASP   8   2.091  -5.398   3.624
   63    H    TYR   9           H        TYR   9   4.664  -2.710   4.500
   64    HA   TYR   9           HA       TYR   9   4.411  -0.394   6.155
   65   1HB   TYR   9          2HB       TYR   9   3.468  -2.502   7.492
   66   2HB   TYR   9          1HB       TYR   9   5.182  -2.772   7.810
   67    HD1  TYR   9           1HD      TYR   9   2.313  -1.185   9.026
   68    HD2  TYR   9           2HD      TYR   9   6.511  -0.502   8.425
   69    HE1  TYR   9           1HE      TYR   9   2.275   0.583  10.766
   70    HE2  TYR   9           2HE      TYR   9   6.474   1.265  10.164
   71    HH   TYR   9           HH       TYR   9   5.131   1.913  12.093
   72    H    TRP  10           H        TRP  10   6.414  -3.342   6.467
   73    HA   TRP  10           HA       TRP  10   8.828  -1.662   5.900
   74   1HB   TRP  10          2HB       TRP  10   8.763  -4.444   7.082
   75   2HB   TRP  10          1HB       TRP  10  10.000  -3.203   7.276
   76    HD1  TRP  10           HD       TRP  10   9.454  -1.156   8.919
   77    HE1  TRP  10           1HE      TRP  10   7.811  -0.962  10.897
   78    HE3  TRP  10           3HE      TRP  10   6.478  -5.196   7.992
   79    HZ2  TRP  10           2HZ      TRP  10   5.534  -2.340  11.948
   80    HZ3  TRP  10           3HZ      TRP  10   4.581  -5.735   9.495
   81    HH2  TRP  10           HH       TRP  10   4.106  -4.313  11.469
   82    H    ASN  11           H        ASN  11   6.848  -3.070   3.994
   83    HA   ASN  11           HA       ASN  11   7.002  -4.212   1.936
   84   1HB   ASN  11          2HB       ASN  11   9.952  -3.707   2.452
   85   2HB   ASN  11          1HB       ASN  11   9.224  -4.064   0.885
   86   1HD2  ASN  11          1HD2      ASN  11   9.276  -2.119  -0.266
   87   2HD2  ASN  11          2HD2      ASN  11   8.744  -0.625   0.339
   88    H    CYS  12           H        CYS  12   7.658  -5.557   4.749
   89    HA   CYS  12           HA       CYS  12   9.322  -7.835   4.139
   90   1HB   CYS  12          2HB       CYS  12   7.352  -7.013   6.251
   91   2HB   CYS  12          1HB       CYS  12   7.932  -8.679   6.226
   92    H    LYS  13           H        LYS  13   5.842  -7.216   3.956
   93    HA   LYS  13           HA       LYS  13   5.408  -9.970   2.873
   94   1HB   LYS  13          2HB       LYS  13   3.785  -7.875   4.276
   95   2HB   LYS  13          1HB       LYS  13   2.945  -9.019   3.228
   96   1HG   LYS  13          2HG       LYS  13   3.038 -10.559   4.862
   97   2HG   LYS  13          1HG       LYS  13   4.799 -10.514   4.783
   98   1HD   LYS  13          2HD       LYS  13   4.818  -9.593   6.835
   99   2HD   LYS  13          1HD       LYS  13   4.022  -8.171   6.158
  100   1HE   LYS  13          2HE       LYS  13   2.382  -8.731   7.677
  101   2HE   LYS  13          1HE       LYS  13   1.889  -9.859   6.398
  102   1HZ   LYS  13          1HZ       LYS  13   2.223 -11.043   8.476
  103   2HZ   LYS  13          2HZ       LYS  13   3.808 -10.442   8.593
  104   3HZ   LYS  13          3HZ       LYS  13   3.393 -11.514   7.343
  105    H    ARG  14           H        ARG  14   6.705  -8.130   1.159
  106    HA   ARG  14           HA       ARG  14   6.532  -7.316  -1.049
  107   1HB   ARG  14          2HB       ARG  14   4.653  -9.418  -0.666
  108   2HB   ARG  14          1HB       ARG  14   3.842  -8.172  -1.615
  109   1HG   ARG  14          2HG       ARG  14   5.415  -8.288  -3.351
  110   2HG   ARG  14          1HG       ARG  14   6.641  -9.025  -2.320
  111   1HD   ARG  14          2HD       ARG  14   4.051 -10.417  -3.086
  112   2HD   ARG  14          1HD       ARG  14   5.592 -10.657  -3.933
  113    HE   ARG  14           HE       ARG  14   5.122 -11.325  -1.056
  114   1HH1  ARG  14          1HH2      ARG  14   6.165 -12.434  -4.046
  115   2HH1  ARG  14          2HH2      ARG  14   7.583 -13.232  -3.455
  116   1HH2  ARG  14          1HH1      ARG  14   7.297 -11.945  -0.248
  117   2HH2  ARG  14          2HH1      ARG  14   8.224 -12.957  -1.306
  118    H    ILE  15           H        ILE  15   4.814  -5.955  -2.460
  119    HA   ILE  15           HA       ILE  15   4.059  -3.669  -0.784
  120    HB   ILE  15           HB       ILE  15   3.682  -4.223  -3.744
  121   1HG1  ILE  15          2HG1      ILE  15   5.880  -2.466  -3.036
  122   2HG1  ILE  15          1HG1      ILE  15   6.073  -4.040  -2.265
  123   1HG2  ILE  15          1HG2      ILE  15   4.032  -1.595  -3.624
  124   2HG2  ILE  15          2HG2      ILE  15   3.430  -1.814  -1.981
  125   3HG2  ILE  15          3HG2      ILE  15   2.440  -2.303  -3.356
  126   1HD1  ILE  15          1HD1      ILE  15   5.172  -4.252  -5.041
  127   2HD1  ILE  15          2HD1      ILE  15   6.515  -5.062  -4.234
  128   3HD1  ILE  15          3HD1      ILE  15   6.730  -3.440  -4.893
  129    H    CYS  16           H        CYS  16   2.512  -6.527  -1.687
  130    HA   CYS  16           HA       CYS  16  -0.175  -5.289  -1.192
  131   1HB   CYS  16          2HB       CYS  16   0.161  -5.785  -3.579
  132   2HB   CYS  16          1HB       CYS  16   0.606  -7.443  -3.184
  133    H    TRP  17           H        TRP  17  -1.756  -6.891  -0.333
  134    HA   TRP  17           HA       TRP  17  -0.400  -8.941   1.372
  135   1HB   TRP  17          2HB       TRP  17  -1.989  -6.890   2.070
  136   2HB   TRP  17          1HB       TRP  17  -3.240  -8.089   1.741
  137    HD1  TRP  17           HD       TRP  17   0.240  -8.580   3.355
  138    HE1  TRP  17           1HE      TRP  17  -0.091  -9.716   5.646
  139    HE3  TRP  17           3HE      TRP  17  -4.863  -8.738   3.536
  140    HZ2  TRP  17           2HZ      TRP  17  -2.234 -10.578   7.332
  141    HZ3  TRP  17           3HZ      TRP  17  -6.021  -9.724   5.494
  142    HH2  TRP  17           HH       TRP  17  -4.714 -10.643   7.391
  143    H    TYR  18           H        TYR  18  -2.912 -10.318   1.910
  144    HA   TYR  18           HA       TYR  18  -3.167 -11.824  -0.661
  145   1HB   TYR  18          2HB       TYR  18  -2.540 -12.622   1.884
  146   2HB   TYR  18          1HB       TYR  18  -4.279 -12.917   1.850
  147    HD1  TYR  18           1HD      TYR  18  -2.030 -15.034   1.964
  148    HD2  TYR  18           2HD      TYR  18  -4.257 -13.318  -1.285
  149    HE1  TYR  18           1HE      TYR  18  -1.655 -17.087   0.621
  150    HE2  TYR  18           2HE      TYR  18  -3.881 -15.370  -2.626
  151    HH   TYR  18           HH       TYR  18  -2.931 -17.371  -2.698
  152    H    ASN  19           H        ASN  19  -4.910  -9.846   1.601
  153    HA   ASN  19           HA       ASN  19  -7.539 -10.684   0.466
  154   1HB   ASN  19          2HB       ASN  19  -6.553  -9.947   3.010
  155   2HB   ASN  19          1HB       ASN  19  -7.607  -8.627   2.503
  156   1HD2  ASN  19          1HD2      ASN  19  -7.603 -12.241   2.550
  157   2HD2  ASN  19          2HD2      ASN  19  -9.253 -12.380   2.922
  158    H    ASN  20           H        ASN  20  -8.909  -9.119  -0.539
  159    HA   ASN  20           HA       ASN  20  -7.495  -6.911  -1.872
  160   1HB   ASN  20          2HB       ASN  20  -9.130  -8.473  -2.956
  161   2HB   ASN  20          1HB       ASN  20 -10.399  -7.790  -1.939
  162   1HD2  ASN  20          1HD2      ASN  20 -11.457  -5.977  -2.767
  163   2HD2  ASN  20          2HD2      ASN  20 -10.882  -5.020  -4.045
  164    H    LYS  21           H        LYS  21  -9.727  -7.333   0.799
  165    HA   LYS  21           HA       LYS  21 -10.397  -4.454   0.907
  166   1HB   LYS  21          2HB       LYS  21 -12.029  -6.295   1.353
  167   2HB   LYS  21          1HB       LYS  21 -11.063  -6.772   2.750
  168   1HG   LYS  21          2HG       LYS  21 -11.404  -4.548   3.756
  169   2HG   LYS  21          1HG       LYS  21 -12.360  -4.057   2.357
  170   1HD   LYS  21          2HD       LYS  21 -13.367  -6.560   3.364
  171   2HD   LYS  21          1HD       LYS  21 -13.274  -5.395   4.685
  172   1HE   LYS  21          2HE       LYS  21 -15.168  -4.432   3.902
  173   2HE   LYS  21          1HE       LYS  21 -14.294  -3.996   2.420
  174   1HZ   LYS  21          1HZ       LYS  21 -14.637  -6.475   1.843
  175   2HZ   LYS  21          2HZ       LYS  21 -15.930  -5.396   1.622
  176   3HZ   LYS  21          3HZ       LYS  21 -15.889  -6.410   2.984
  177    H    TYR  22           H        TYR  22  -8.280  -6.776   2.504
  178    HA   TYR  22           HA       TYR  22  -7.673  -5.369   4.890
  179   1HB   TYR  22          2HB       TYR  22  -7.014  -7.716   4.040
  180   2HB   TYR  22          1HB       TYR  22  -5.684  -6.906   3.212
  181    HD1  TYR  22           1HD      TYR  22  -3.811  -5.992   4.429
  182    HD2  TYR  22           2HD      TYR  22  -7.175  -7.658   6.516
  183    HE1  TYR  22           1HE      TYR  22  -2.519  -5.946   6.545
  184    HE2  TYR  22           2HE      TYR  22  -5.883  -7.615   8.633
  185    HH   TYR  22           HH       TYR  22  -2.480  -6.942   8.696
  186    H    CYS  23           H        CYS  23  -6.110  -5.147   1.669
  187    HA   CYS  23           HA       CYS  23  -4.175  -3.159   2.401
  188   1HB   CYS  23          2HB       CYS  23  -4.783  -4.725   0.224
  189   2HB   CYS  23          1HB       CYS  23  -5.250  -3.123  -0.350
  190    H    ASN  24           H        ASN  24  -7.448  -2.904   0.991
  191    HA   ASN  24           HA       ASN  24  -7.540  -0.087   0.620
  192   1HB   ASN  24          2HB       ASN  24  -9.156  -2.048  -0.003
  193   2HB   ASN  24          1HB       ASN  24  -9.861  -1.759   1.588
  194   1HD2  ASN  24          1HD2      ASN  24 -11.861  -1.006   0.471
  195   2HD2  ASN  24          2HD2      ASN  24 -11.916   0.551  -0.203
  196    H    ASP  25           H        ASP  25  -8.270  -2.079   3.492
  197    HA   ASP  25           HA       ASP  25  -9.270  -0.045   5.197
  198   1HB   ASP  25          2HB       ASP  25  -7.885  -2.681   5.467
  199   2HB   ASP  25          1HB       ASP  25  -8.041  -1.689   6.918
  200    H    LEU  26           H        LEU  26  -5.902  -1.290   5.044
  201    HA   LEU  26           HA       LEU  26  -4.768   0.708   6.742
  202   1HB   LEU  26          2HB       LEU  26  -3.954  -1.462   4.986
  203   2HB   LEU  26          1HB       LEU  26  -2.828  -0.109   4.878
  204    HG   LEU  26           HG       LEU  26  -3.679  -0.732   7.626
  205   1HD1  LEU  26          1HD1      LEU  26  -2.438  -2.781   7.852
  206   2HD1  LEU  26          2HD1      LEU  26  -1.866  -2.686   6.186
  207   3HD1  LEU  26          3HD1      LEU  26  -3.567  -3.010   6.518
  208   1HD2  LEU  26          1HD2      LEU  26  -1.008  -0.787   7.661
  209   2HD2  LEU  26          2HD2      LEU  26  -1.891   0.735   7.549
  210   3HD2  LEU  26          3HD2      LEU  26  -1.213  -0.001   6.096
  211    H    CYS  27           H        CYS  27  -5.309   0.625   3.223
  212    HA   CYS  27           HA       CYS  27  -3.830   2.989   2.573
  213   1HB   CYS  27          2HB       CYS  27  -6.056   1.361   1.389
  214   2HB   CYS  27          1HB       CYS  27  -5.674   2.922   0.659
  215    H    LYS  28           H        LYS  28  -7.250   2.490   3.486
  216    HA   LYS  28           HA       LYS  28  -8.146   5.174   3.212
  217   1HB   LYS  28          2HB       LYS  28  -8.908   3.053   5.251
  218   2HB   LYS  28          1HB       LYS  28  -9.908   4.421   4.763
  219   1HG   LYS  28          2HG       LYS  28  -8.925   2.778   2.522
  220   2HG   LYS  28          1HG       LYS  28 -10.029   1.938   3.612
  221   1HD   LYS  28          2HD       LYS  28 -10.738   4.710   2.744
  222   2HD   LYS  28          1HD       LYS  28 -10.948   3.396   1.587
  223   1HE   LYS  28          2HE       LYS  28 -12.022   2.324   3.907
  224   2HE   LYS  28          1HE       LYS  28 -12.530   4.023   3.978
  225   1HZ   LYS  28          1HZ       LYS  28 -12.701   2.429   1.489
  226   2HZ   LYS  28          2HZ       LYS  28 -13.464   3.906   1.846
  227   3HZ   LYS  28          3HZ       LYS  28 -13.975   2.476   2.607
  228    H    GLY  29           H        GLY  29  -6.194   3.602   5.671
  229   1HA   GLY  29          2HA       GLY  29  -6.482   5.513   7.772
  230   2HA   GLY  29          1HA       GLY  29  -5.058   4.493   7.527
  231    H    LEU  30           H        LEU  30  -4.428   5.381   4.905
  232    HA   LEU  30           HA       LEU  30  -3.160   7.978   5.545
  233   1HB   LEU  30          2HB       LEU  30  -2.963   6.136   3.135
  234   2HB   LEU  30          1HB       LEU  30  -1.864   7.462   3.520
  235    HG   LEU  30           HG       LEU  30  -2.296   5.413   5.637
  236   1HD1  LEU  30          1HD1      LEU  30  -0.588   3.932   4.605
  237   2HD1  LEU  30          2HD1      LEU  30  -0.626   4.927   3.150
  238   3HD1  LEU  30          3HD1      LEU  30  -2.057   4.016   3.633
  239   1HD2  LEU  30          1HD2      LEU  30  -0.311   7.417   4.793
  240   2HD2  LEU  30          2HD2      LEU  30   0.402   5.890   5.315
  241   3HD2  LEU  30          3HD2      LEU  30  -0.656   6.787   6.405
  242    H    LYS  31           H        LYS  31  -6.127   7.498   4.862
  243    HA   LYS  31           HA       LYS  31  -7.788   8.797   3.813
  244   1HB   LYS  31          2HB       LYS  31  -5.978  10.558   4.331
  245   2HB   LYS  31          1HB       LYS  31  -5.511  10.397   2.638
  246   1HG   LYS  31          2HG       LYS  31  -7.108  11.936   2.203
  247   2HG   LYS  31          1HG       LYS  31  -8.268  10.640   2.503
  248   1HD   LYS  31          2HD       LYS  31  -7.762  11.394   5.052
  249   2HD   LYS  31          1HD       LYS  31  -7.504  12.933   4.228
  250   1HE   LYS  31          2HE       LYS  31  -9.818  12.992   4.664
  251   2HE   LYS  31          1HE       LYS  31  -9.779  12.326   3.018
  252   1HZ   LYS  31          1HZ       LYS  31  -9.476  10.094   4.270
  253   2HZ   LYS  31          2HZ       LYS  31 -11.033  10.759   4.122
  254   3HZ   LYS  31          3HZ       LYS  31 -10.171  10.922   5.577
  255    H    ALA  32           H        ALA  32  -5.966   6.612   2.392
  256    HA   ALA  32           HA       ALA  32  -6.383   7.362  -0.433
  257   1HB   ALA  32          1HB       ALA  32  -5.423   4.751   0.770
  258   2HB   ALA  32          2HB       ALA  32  -4.369   6.147   0.556
  259   3HB   ALA  32          3HB       ALA  32  -5.098   5.369  -0.848
  260    H    ASP  33           H        ASP  33  -8.818   7.474   0.048
  261    HA   ASP  33           HA       ASP  33 -10.561   5.518   0.835
  262   1HB   ASP  33          2HB       ASP  33 -10.533   7.770  -0.942
  263   2HB   ASP  33          1HB       ASP  33 -11.523   6.498  -1.658
  264    H    SER  34           H        SER  34 -10.031   5.748  -2.667
  265    HA   SER  34           HA       SER  34 -10.727   3.006  -3.152
  266   1HB   SER  34          2HB       SER  34 -10.636   5.179  -4.646
  267   2HB   SER  34          1HB       SER  34  -8.991   4.646  -4.977
  268    HG   SER  34           HG       SER  34 -11.296   3.010  -5.239
  269    H    GLY  35           H        GLY  35  -9.368   1.641  -1.851
  270   1HA   GLY  35          2HA       GLY  35  -6.530   1.536  -2.784
  271   2HA   GLY  35          1HA       GLY  35  -6.941   1.327  -1.081
  272    H    TYR  36           H        TYR  36  -6.948  -0.181  -4.226
  273    HA   TYR  36           HA       TYR  36  -7.961  -2.717  -2.988
  274   1HB   TYR  36          2HB       TYR  36  -8.782  -3.256  -5.172
  275   2HB   TYR  36          1HB       TYR  36  -9.179  -1.556  -4.930
  276    HD1  TYR  36           1HD      TYR  36  -6.630  -3.834  -6.431
  277    HD2  TYR  36           2HD      TYR  36  -8.340   0.107  -6.389
  278    HE1  TYR  36           1HE      TYR  36  -5.313  -3.241  -8.447
  279    HE2  TYR  36           2HE      TYR  36  -7.023   0.700  -8.405
  280    HH   TYR  36           HH       TYR  36  -5.960  -0.790 -10.410
  281    H    CYS  37           H        CYS  37  -6.772  -4.674  -3.506
  282    HA   CYS  37           HA       CYS  37  -3.931  -4.141  -4.283
  283   1HB   CYS  37          2HB       CYS  37  -5.102  -5.366  -2.074
  284   2HB   CYS  37          1HB       CYS  37  -4.574  -6.725  -3.066
  285    H    TRP  38           H        TRP  38  -3.032  -5.280  -5.995
  286    HA   TRP  38           HA       TRP  38  -4.853  -6.646  -7.836
  287   1HB   TRP  38          2HB       TRP  38  -2.860  -5.083  -8.316
  288   2HB   TRP  38          1HB       TRP  38  -1.834  -6.469  -7.944
  289    HD1  TRP  38           HD       TRP  38  -1.444  -8.170  -9.818
  290    HE1  TRP  38           1HE      TRP  38  -2.419  -8.543 -12.176
  291    HE3  TRP  38           3HE      TRP  38  -5.248  -4.765  -9.747
  292    HZ2  TRP  38           2HZ      TRP  38  -4.533  -7.529 -13.815
  293    HZ3  TRP  38           3HZ      TRP  38  -6.725  -4.488 -11.718
  294    HH2  TRP  38           HH       TRP  38  -6.373  -5.865 -13.750
  295    H    GLY  39           H        GLY  39  -5.471  -8.518  -6.509
  296   1HA   GLY  39          2HA       GLY  39  -3.596 -10.317  -5.335
  297   2HA   GLY  39          1HA       GLY  39  -5.246 -10.739  -5.789
  298    H    TRP  40           H        TRP  40  -1.956 -10.421  -7.048
  299    HA   TRP  40           HA       TRP  40  -2.372 -12.749  -8.791
  300   1HB   TRP  40          2HB       TRP  40  -3.350 -10.955 -10.124
  301   2HB   TRP  40          1HB       TRP  40  -1.936  -9.942  -9.855
  302    HD1  TRP  40           HD       TRP  40  -0.787  -9.812 -12.125
  303    HE1  TRP  40           1HE      TRP  40   0.042 -11.532 -13.852
  304    HE3  TRP  40           3HE      TRP  40  -2.655 -14.084 -10.071
  305    HZ2  TRP  40           2HZ      TRP  40  -0.068 -14.359 -14.304
  306    HZ3  TRP  40           3HZ      TRP  40  -2.283 -16.279 -11.163
  307    HH2  TRP  40           HH       TRP  40  -0.993 -16.421 -13.276
  308    H    THR  41           H        THR  41  -0.201  -9.957  -9.034
  309    HA   THR  41           HA       THR  41   2.022 -11.094  -7.624
  310    HB   THR  41           HB       THR  41   1.739 -12.718  -9.532
  311    HG1  THR  41           1HG      THR  41   4.114 -11.318  -9.993
  312   1HG2  THR  41          1HG2      THR  41   2.858 -10.692 -11.403
  313   2HG2  THR  41          2HG2      THR  41   1.137 -10.579 -11.039
  314   3HG2  THR  41          3HG2      THR  41   1.795 -12.061 -11.732
  315    H    LEU  42           H        LEU  42   0.771  -8.507  -7.958
  316    HA   LEU  42           HA       LEU  42   3.003  -6.990  -9.282
  317   1HB   LEU  42          2HB       LEU  42   0.029  -6.779  -9.322
  318   2HB   LEU  42          1HB       LEU  42   0.941  -5.270  -9.365
  319    HG   LEU  42           HG       LEU  42   2.127  -7.211 -11.154
  320   1HD1  LEU  42          1HD1      LEU  42  -0.189  -8.102 -11.242
  321   2HD1  LEU  42          2HD1      LEU  42   0.286  -7.364 -12.771
  322   3HD1  LEU  42          3HD1      LEU  42  -0.776  -6.494 -11.665
  323   1HD2  LEU  42          1HD2      LEU  42   0.750  -4.889 -12.308
  324   2HD2  LEU  42          2HD2      LEU  42   2.461  -5.313 -12.351
  325   3HD2  LEU  42          3HD2      LEU  42   1.797  -4.467 -10.953
  326    H    SER  43           H        SER  43   0.332  -5.808  -7.286
  327    HA   SER  43           HA       SER  43   1.599  -5.564  -4.776
  328   1HB   SER  43          2HB       SER  43   2.234  -3.009  -5.243
  329   2HB   SER  43          1HB       SER  43   3.372  -4.308  -5.590
  330    HG   SER  43           HG       SER  43   2.980  -2.762  -7.332
  331    H    CYS  44           H        CYS  44   0.654  -3.529  -3.546
  332    HA   CYS  44           HA       CYS  44  -2.221  -3.522  -3.966
  333   1HB   CYS  44          2HB       CYS  44  -0.790  -3.353  -1.808
  334   2HB   CYS  44          1HB       CYS  44  -0.633  -1.645  -2.214
  335    H    TYR  45           H        TYR  45  -3.443  -1.401  -4.148
  336    HA   TYR  45           HA       TYR  45  -1.980   0.760  -5.566
  337   1HB   TYR  45          2HB       TYR  45  -2.857  -1.141  -7.110
  338   2HB   TYR  45          1HB       TYR  45  -4.454  -0.478  -6.770
  339    HD1  TYR  45           1HD      TYR  45  -3.006   2.428  -6.426
  340    HD2  TYR  45           2HD      TYR  45  -3.288  -0.536  -9.526
  341    HE1  TYR  45           1HE      TYR  45  -2.648   4.183  -8.136
  342    HE2  TYR  45           2HE      TYR  45  -2.927   1.224 -11.235
  343    HH   TYR  45           HH       TYR  45  -3.408   3.980 -11.165
  344    H    CYS  46           H        CYS  46  -2.595   2.439  -4.229
  345    HA   CYS  46           HA       CYS  46  -5.533   2.814  -3.756
  346   1HB   CYS  46          2HB       CYS  46  -3.213   3.394  -1.878
  347   2HB   CYS  46          1HB       CYS  46  -4.920   3.654  -1.519
  348    H    GLN  47           H        GLN  47  -6.259   4.895  -4.222
  349    HA   GLN  47           HA       GLN  47  -4.167   6.942  -4.900
  350   1HB   GLN  47          2HB       GLN  47  -6.891   6.717  -6.186
  351   2HB   GLN  47          1HB       GLN  47  -5.448   7.513  -6.812
  352   1HG   GLN  47          2HG       GLN  47  -4.457   5.038  -6.624
  353   2HG   GLN  47          1HG       GLN  47  -6.159   4.612  -6.800
  354   1HE2  GLN  47          1HE2      GLN  47  -6.827   6.946  -8.488
  355   2HE2  GLN  47          2HE2      GLN  47  -6.110   6.666 -10.001
  356    H    GLY  48           H        GLY  48  -4.381   8.819  -3.732
  357   1HA   GLY  48          2HA       GLY  48  -6.019  10.643  -3.106
  358   2HA   GLY  48          1HA       GLY  48  -7.037   9.356  -2.459
  359    H    LEU  49           H        LEU  49  -3.550   9.304  -2.075
  360    HA   LEU  49           HA       LEU  49  -3.977   9.651   0.867
  361   1HB   LEU  49          2HB       LEU  49  -1.498   8.611   0.703
  362   2HB   LEU  49          1HB       LEU  49  -2.939   7.601   0.667
  363    HG   LEU  49           HG       LEU  49  -1.797   8.697  -1.893
  364   1HD1  LEU  49          1HD1      LEU  49  -0.729   6.264  -1.922
  365   2HD1  LEU  49          2HD1      LEU  49  -0.732   6.491  -0.173
  366   3HD1  LEU  49          3HD1      LEU  49   0.139   7.622  -1.209
  367   1HD2  LEU  49          1HD2      LEU  49  -3.997   7.091  -1.177
  368   2HD2  LEU  49          2HD2      LEU  49  -2.819   5.985  -1.881
  369   3HD2  LEU  49          3HD2      LEU  49  -3.383   7.377  -2.805
  370    HA   PRO  50           HA       PRO  50  -1.572  13.313   1.073
  371   1HB   PRO  50          2HB       PRO  50   0.228  12.831   3.081
  372   2HB   PRO  50          1HB       PRO  50  -1.500  13.119   3.373
  373   1HG   PRO  50          2HG       PRO  50  -0.016  10.531   3.222
  374   2HG   PRO  50          1HG       PRO  50  -1.255  11.049   4.379
  375   1HD   PRO  50          2HD       PRO  50  -1.838   9.418   2.328
  376   2HD   PRO  50          1HD       PRO  50  -2.991  10.641   2.910
  377    H    ASP  51           H        ASP  51   0.510  14.266   0.539
  378    HA   ASP  51           HA       ASP  51   2.025  12.920  -1.447
  379   1HB   ASP  51          2HB       ASP  51   1.981  15.315  -1.315
  380   2HB   ASP  51          1HB       ASP  51   2.534  15.298   0.360
  381    H    ASN  52           H        ASN  52   2.352  13.012   2.046
  382    HA   ASN  52           HA       ASN  52   5.026  11.727   1.977
  383   1HB   ASN  52          2HB       ASN  52   4.224  13.548   3.600
  384   2HB   ASN  52          1HB       ASN  52   3.223  12.301   4.343
  385   1HD2  ASN  52          1HD2      ASN  52   6.320  13.705   4.431
  386   2HD2  ASN  52          2HD2      ASN  52   7.116  12.482   5.296
  387    H    ALA  53           H        ALA  53   2.335  10.497   1.068
  388    HA   ALA  53           HA       ALA  53   1.556   8.419   2.862
  389   1HB   ALA  53          1HB       ALA  53   0.274   9.208   0.916
  390   2HB   ALA  53          2HB       ALA  53   0.572   7.476   0.776
  391   3HB   ALA  53          3HB       ALA  53   1.532   8.614  -0.169
  392    H    ARG  54           H        ARG  54   3.032   6.940   3.645
  393    HA   ARG  54           HA       ARG  54   5.448   6.149   2.312
  394   1HB   ARG  54          2HB       ARG  54   5.147   5.992   4.717
  395   2HB   ARG  54          1HB       ARG  54   3.768   4.910   4.513
  396   1HG   ARG  54          2HG       ARG  54   6.286   4.049   3.203
  397   2HG   ARG  54          1HG       ARG  54   6.289   4.021   4.966
  398   1HD   ARG  54          2HD       ARG  54   3.978   2.828   3.433
  399   2HD   ARG  54          1HD       ARG  54   5.452   1.886   3.737
  400    HE   ARG  54           HE       ARG  54   3.477   2.478   5.717
  401   1HH1  ARG  54          1HH1      ARG  54   6.740   1.700   5.150
  402   2HH1  ARG  54          2HH1      ARG  54   7.215   1.803   6.812
  403   1HH2  ARG  54          1HH2      ARG  54   4.134   2.972   7.894
  404   2HH2  ARG  54          2HH2      ARG  54   5.739   2.524   8.366
  405    H    ILE  55           H        ILE  55   5.739   4.689   0.707
  406    HA   ILE  55           HA       ILE  55   3.843   2.442   0.337
  407    HB   ILE  55           HB       ILE  55   3.663   3.205  -2.123
  408   1HG1  ILE  55          2HG1      ILE  55   4.706   5.722  -0.792
  409   2HG1  ILE  55          1HG1      ILE  55   5.421   4.865  -2.157
  410   1HG2  ILE  55          1HG2      ILE  55   2.323   5.288  -0.512
  411   2HG2  ILE  55          2HG2      ILE  55   2.071   3.640   0.060
  412   3HG2  ILE  55          3HG2      ILE  55   1.627   4.078  -1.589
  413   1HD1  ILE  55          1HD1      ILE  55   4.059   6.946  -2.732
  414   2HD1  ILE  55          2HD1      ILE  55   2.634   6.026  -2.255
  415   3HD1  ILE  55          3HD1      ILE  55   3.628   5.475  -3.603
  416    H    LYS  56           H        LYS  56   4.732   1.654  -2.173
  417    HA   LYS  56           HA       LYS  56   6.972   0.108  -1.799
  418   1HB   LYS  56          2HB       LYS  56   7.242   0.279  -4.287
  419   2HB   LYS  56          1HB       LYS  56   5.563   0.055  -3.794
  420   1HG   LYS  56          2HG       LYS  56   5.405   2.633  -3.826
  421   2HG   LYS  56          1HG       LYS  56   6.911   2.582  -4.744
  422   1HD   LYS  56          2HD       LYS  56   5.071   0.644  -5.820
  423   2HD   LYS  56          1HD       LYS  56   4.284   2.221  -5.739
  424   1HE   LYS  56          2HE       LYS  56   6.962   1.627  -7.052
  425   2HE   LYS  56          1HE       LYS  56   5.452   2.051  -7.881
  426   1HZ   LYS  56          1HZ       LYS  56   7.186   3.728  -6.210
  427   2HZ   LYS  56          2HZ       LYS  56   5.515   4.030  -6.192
  428   3HZ   LYS  56          3HZ       LYS  56   6.380   4.115  -7.652
  429    H    ARG  57           H        ARG  57   8.601   1.164  -0.532
  430    HA   ARG  57           HA       ARG  57  10.258   3.135  -2.064
  431   1HB   ARG  57          2HB       ARG  57   8.719   4.092  -0.248
  432   2HB   ARG  57          1HB       ARG  57   9.732   3.238   0.916
  433   1HG   ARG  57          2HG       ARG  57  11.014   5.106   0.890
  434   2HG   ARG  57          1HG       ARG  57  11.605   4.500  -0.658
  435   1HD   ARG  57          2HD       ARG  57  10.685   6.277  -1.716
  436   2HD   ARG  57          1HD       ARG  57   9.086   5.847  -1.074
  437    HE   ARG  57           HE       ARG  57  10.713   7.960  -0.056
  438   1HH1  ARG  57          1HH1      ARG  57   8.039   6.046   0.590
  439   2HH1  ARG  57          2HH1      ARG  57   8.010   6.347   2.295
  440   1HH2  ARG  57          1HH2      ARG  57  11.054   8.007   2.322
  441   2HH2  ARG  57          2HH2      ARG  57   9.716   7.457   3.276
  442    H    SER  58           H        SER  58  10.145   0.136  -0.706
  443    HA   SER  58           HA       SER  58  13.091   0.002  -0.459
  444   1HB   SER  58          2HB       SER  58  11.333   0.324   1.757
  445   2HB   SER  58          1HB       SER  58  11.920  -1.336   1.804
  446    HG   SER  58           HG       SER  58  13.224   0.996   2.305
  447    H    GLY  59           H        GLY  59  13.463  -2.519   0.385
  448   1HA   GLY  59          2HA       GLY  59  11.485  -4.400  -0.603
  449   2HA   GLY  59          1HA       GLY  59  12.826  -4.204  -1.732
  450    H    ARG  60           H        ARG  60  13.442  -3.852   1.685
  451    HA   ARG  60           HA       ARG  60  14.534  -6.629   1.777
  452   1HB   ARG  60          2HB       ARG  60  16.648  -5.754   2.584
  453   2HB   ARG  60          1HB       ARG  60  16.238  -4.895   1.099
  454   1HG   ARG  60          2HG       ARG  60  15.216  -3.682   3.609
  455   2HG   ARG  60          1HG       ARG  60  16.963  -3.634   3.385
  456   1HD   ARG  60          2HD       ARG  60  15.752  -2.954   0.884
  457   2HD   ARG  60          1HD       ARG  60  15.008  -1.960   2.153
  458    HE   ARG  60           HE       ARG  60  17.727  -1.963   2.764
  459   1HH1  ARG  60          1HH2      ARG  60  15.579  -0.864   0.315
  460   2HH1  ARG  60          2HH2      ARG  60  16.714   0.251  -0.370
  461   1HH2  ARG  60          1HH1      ARG  60  19.287  -0.635   1.779
  462   2HH2  ARG  60          2HH1      ARG  60  18.812   0.381   0.458
  463    H    CYS  61           H        CYS  61  12.157  -5.897   2.991
  464    HA   CYS  61           HA       CYS  61  11.061  -5.777   5.085
  465   1HB   CYS  61          2HB       CYS  61  13.309  -7.625   5.105
  466   2HB   CYS  61          1HB       CYS  61  12.966  -7.021   6.726
  467    H    ARG  62           H        ARG  62  10.999  -3.641   5.771
  468    HA   ARG  62           HA       ARG  62  13.363  -2.232   6.765
  469   1HB   ARG  62          2HB       ARG  62  10.764  -1.667   5.794
  470   2HB   ARG  62          1HB       ARG  62  10.814  -1.047   7.444
  471   1HG   ARG  62          2HG       ARG  62  11.823   0.766   6.519
  472   2HG   ARG  62          1HG       ARG  62  13.261  -0.256   6.464
  473   1HD   ARG  62          2HD       ARG  62  13.235  -0.168   4.203
  474   2HD   ARG  62          1HD       ARG  62  11.610  -0.880   4.191
  475    HE   ARG  62           HE       ARG  62  12.180   1.907   3.789
  476   1HH1  ARG  62          1HH1      ARG  62   9.628   0.025   3.492
  477   2HH1  ARG  62          2HH1      ARG  62   8.486   0.990   4.367
  478   1HH2  ARG  62          1HH2      ARG  62  10.900   3.047   5.769
  479   2HH2  ARG  62          2HH2      ARG  62   9.207   2.701   5.656
  480    H    ALA  63           H        ALA  63  13.265  -4.459   8.328
  481    HA   ALA  63           HA       ALA  63  12.912  -3.398  11.001
  482   1HB   ALA  63          1HB       ALA  63  10.728  -4.851   9.631
  483   2HB   ALA  63          2HB       ALA  63  10.650  -3.732  10.991
  484   3HB   ALA  63          3HB       ALA  63  11.083  -5.420  11.262